762	490	778	0:SP2_SP3_SPD5	C[6]	C	C[3x3,4,3x5,15x6]	5:3:4:	3:1:1:1:	6:6:6:6:3:	C[3x3,4,3x5,15x6]-5:C[6,6a]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,22x6]-6:B[4x3,4,5x5,21x6]-6:C[6]-3:	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6,6a]C[6,6a]C[6a])(CH3)	C(C[6]C[3x3,4,3x5,15x6]C[6,6a])(H)3	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6,6a]C)	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6,6a]C[6,6a]C[6a])(CH3){1|C<5>,3|C<3>,4|H<1>,5|B<6>}	C(C[6]C[3x3,4,3x5,15x6]C[6,6a])(H)3	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6,6a]C){1|B<6>,2|C<3>,2|C<4>,5|H<1>}	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	116.4882	0.371	4	116.4882	0.371	4
762	490	778	0:SP2_SP3_SPD5	C[6]	C	C[3x3,4,3x5,15x6]	5:3:4:	3:4:1:1:	6:6:6:6:3:	C[3x3,4,3x5,15x6]-5:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,22x6]-6:B[4x3,4,5x5,21x6]-6:C[6]-3:	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6]C)(CCHH)	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C)	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6]C)(CCHH){1|C<3>,1|C<4>,1|C<5>,3|H<1>,5|B<6>}	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C){1|B<6>,1|C<3>,3|C<4>,5|H<1>}	115.7810	0.000	1	116.0030	0.099	2	116.3900	0.499	3	116.3900	0.499	3	116.4882	0.371	4	116.4882	0.371	4
762	490	778	0:SP2_SP3_SPD5	C[6]	C	C[3x3,4,3x5,15x6]	5:3:4:	3:4:1:1:	6:6:6:6:3:	C[3x3,4,3x5,15x6]-5:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,22x6]-6:B[4x3,4,5x5,21x6]-6:C[6]-3:	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6]C)(CCHH)	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C)	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6]C)(CCHH){1|C<3>,1|C<4>,1|C<5>,3|H<1>,5|B<6>}	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C){1|Si<4>,1|B<6>,1|C<3>,2|C<4>,5|H<1>}	116.2250	0.000	1	116.0030	0.099	2	116.3900	0.499	3	116.3900	0.499	3	116.4882	0.371	4	116.4882	0.371	4
762	490	778	0:SP2_SP3_SPD5	C[6]	C	C[3x3,4,3x5,15x6]	5:3:4:	3:4:1:1:	6:6:6:6:3:	C[3x3,4,3x5,15x6]-5:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,22x6]-6:B[4x3,4,5x5,21x6]-6:C[6]-3:	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6a]C[6])(CCHH)	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C)	C[6](C[3x3,4,3x5,15x6]B[4x3,4,5x5,21x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]2)(C[6]C[6a]C[6])(CCHH){1|C<5>,3|H<1>,4|C<3>,5|B<6>}	C(C[6]C[3x3,4,3x5,15x6]C[6])(CH3)(H)2	C[3x3,4,3x5,15x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[5x3,4x5,17x6]B[4x3,4,5x5,22x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)(B[4x3,4,5x5,22x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]C[6])(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)(C[6]C[6]C){1|B<6>,2|C<3>,2|C<4>,5|H<1>}	117.1640	0.000	1	117.1640	0.000	1	116.3900	0.499	3	116.3900	0.499	3	116.4882	0.371	4	116.4882	0.371	4
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:2:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:N[5a]-2:C[6]-3:	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]C)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]N[5a,6]N[6])(N[5a]C[5a,6])(C[6]C[6]C)	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]N[5a,6]N[6])(N[5a]C[5a,6])(C[6]C[6]C){1|C<3>,1|N<3>,2|C<4>}	116.9450	0.000	1	116.9450	0.000	1	116.9450	0.000	1	116.9450	0.000	1	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[5a,6]-3:C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]N[5a,6]N[6])(C[5a,6]N[5a]N[6])(C[6]C[6]C)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|N<2>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]N[5a,6]N[6])(C[5a,6]N[5a]N[6])(C[6]C[6]C){1|H<1>,3|C<3>}	121.1070	0.489	2	121.1070	0.239	2	121.1070	0.239	2	118.8670	4.147	6	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[5a]-3:C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]O[5a]C[6])(C[5a]C[5a]H)(C[6]C[6]C)	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>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]O[5a]C[6])(C[5a]C[5a]H)(C[6]C[6]C){1|C<2>,1|H<1>,2|C<3>}	116.8970	0.000	1	116.8970	0.000	1	117.3340	0.382	2	118.8670	4.147	6	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[5a]-3:C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]O[5a]N[6])(C[5a]C[5a]H)(C[6]C[6]C)	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>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6]O[5a]N[6])(C[5a]C[5a]H)(C[6]C[6]C){1|H<1>,2|C<3>}	117.7710	0.000	1	117.7710	0.000	1	117.3340	0.382	2	118.8670	4.147	6	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6a]-3:C[5a,6]-3:C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[5a,6]C)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(C[5a,6]C[5a,6]N[5a])(C[6]C[6]C)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[5a,6]C)(CH3){1|N<2>,4|C<3>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(C[5a,6]C[5a,6]N[5a])(C[6]C[6]C){1|H<1>,1|S<2>,4|C<3>}	116.6800	0.000	1	116.6800	0.000	1	118.1600	4.381	2	118.8670	4.147	6	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6a]-3:C[5a,6]-3:C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(C[5a,6]C[5a,6]N[5a])(C[6]C[6]C)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(CH3){1|N<2>,4|C<3>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(C[5a,6]C[5a,6]N[5a])(C[6]C[6]C){1|N<3>,2|H<1>,3|C<3>}	119.6400	0.000	1	119.6400	0.000	1	118.1600	4.381	2	118.8670	4.147	6	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:4:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6,6a]-3:B[5a]-4:C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6,6a]C[5a,6a]C[6,6a])(B[5a]C[6a]2O[5a])(C[6]C[6]C)	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>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6,6a]C[5a,6a]C[6,6a])(B[5a]C[6a]2O[5a])(C[6]C[6]C){1|H<1>,7|C<3>}	120.0960	0.000	1	120.0960	0.000	1	120.0960	0.000	1	121.0030	0.835	4	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:4:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6a]-3:B[5a,6]-4:C[6]-3:	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(B[5a,6]O[5a]N[6]F)(C[6]C[6]C)	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>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(B[5a,6]O[5a]N[6]F)(C[6]C[6]C){2|H<1>,4|C<3>}	120.3470	0.000	1	120.3470	0.000	1	121.3053	0.705	3	121.0030	0.835	4	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:1:1:1:	3:4:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6a]-3:B[5a,6]-4:C[6]-3:	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3)	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(B[5a,6]O[5a]N[6]O)(C[6]C[6]C)	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>}	C(C[6]N[5a,6]C[6])(H)3	N[5a,6](C[5a,6a]C[5a,6a]C[6a])(B[5a,6]O[5a]N[6]O)(C[6]C[6]C){2|H<1>,4|C<3>}	121.7845	0.177	2	121.7845	0.032	2	121.3053	0.705	3	121.0030	0.835	4	119.3777	3.845	12	119.3777	3.845	12
762	490	813	0:SP2_SP2_SP3	C[6]	C	N[5a,6]	3:3:4:	3:4:1:1:	3:3:3:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5a,6]-3:C[5a]-3:C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C)(CCHH)	C(C[6]N[5a,6]C[6])(CCHH)(H)2	N[5a,6](C[5a,6]O[5a]C[6])(C[5a]C[5a]H)(C[6]C[6]C)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C)(CCHH){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C(C[6]N[5a,6]C[6])(CCHH)(H)2	N[5a,6](C[5a,6]O[5a]C[6])(C[5a]C[5a]H)(C[6]C[6]C){1|C<4>,1|H<1>,2|C<3>}	118.3740	0.000	1	118.3740	0.000	1	118.3740	0.000	1	118.3740	0.000	1	119.3777	3.845	12	119.3777	3.845	12
762	490	818	0:SP2_SP2_SP3	C[6,6]	C	C[5,6,6]	3:4:4:	3:1:1:1:	4:3:4:	C[5,6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:H-1:H-1:H-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6](C[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]2H)(CH3)	C(C[6,6]C[5,6,6]C[3x6])(H)3	C[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[3x6]C)(C[5]N[5]HH)	C[6,6](C[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]2H)(CH3){1|N<3>,3|C<4>,6|H<1>}	C(C[6,6]C[5,6,6]C[3x6])(H)3	C[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[3x6]C)(C[5]N[5]HH){1|S<4>,2|C<4>,7|H<1>}	127.8990	0.000	1	127.8990	0.000	1	127.8990	0.000	1	127.8990	0.000	1	127.8990	0.000	1	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:1:1:1:	3:2:3:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(O[6]C[6])(CH3)	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[6]S[5])(O[5]Ga[3x5])(C[6]O[6]C)	C[6](C[5,6]C[5,6]O[5])(O[6]C[6])(CH3){1|Ga<6>,1|C<3>,1|H<1>,1|S<2>}	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[6]S[5])(O[5]Ga[3x5])(C[6]O[6]C){1|C<3>,1|H<1>,2|O<2>,2|S<2>}	125.5817	0.814	3	125.5817	0.663	3	125.7508	0.551	5	125.7508	0.551	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:1:1:1:	3:2:3:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(O[6]C[6])(CH3)	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[6]S[5])(O[5]Ga[5,5])(C[6]O[6]C)	C[6](C[5,6]C[5,6]O[5])(O[6]C[6])(CH3){1|Ga<5>,1|C<3>,1|H<1>,1|S<2>}	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[6]S[5])(O[5]Ga[5,5])(C[6]O[6]C){1|C<3>,1|H<1>,1|S<2>,2|O<2>}	126.0045	0.814	2	126.0045	0.662	2	125.7508	0.551	5	125.7508	0.551	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:1:1:1:	3:4:3:	C[5,6]-3:S[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(S[6]C[6])(CH3)	C(C[6]C[5,6]S[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[5]C[5]HH)(C[6]S[6]C)	C[6](C[5,6]C[5,6]C[5])(S[6]C[6])(CH3){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C(C[6]C[5,6]S[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[5]C[5]HH)(C[6]S[6]C){3|C<3>,3|H<1>}	125.4960	0.113	2	125.4960	0.013	2	125.4960	0.013	2	125.4960	0.013	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:1:1:1:	4:4:3:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(O[6]C[6])(CF3)	C(C[6]C[5,6]O[6])(F)3	C[5,6](C[5,6]C[5,6]O[5]H)(C[5]C[5]HH)(C[6]O[6]C)	C[6](C[5,6]C[5,6]C[5])(O[6]C[6])(CF3){2|O<2>,3|C<4>,3|H<1>}	C(C[6]C[5,6]O[6])(F)3	C[5,6](C[5,6]C[5,6]O[5]H)(C[5]C[5]HH)(C[6]O[6]C){2|H<1>,3|C<4>}	126.1670	0.000	1	126.1670	0.000	1	126.1670	0.000	1	127.7680	1.926	3	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:1:1:1:	4:4:3:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(O[6]C[6])(CH3)	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[5]C[6]H)(C[5]N[5]HH)(C[6]O[6]C)	C[6](C[5,6]C[5,6]C[5])(O[6]C[6])(CH3){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C(C[6]C[5,6]O[6])(H)3	C[5,6](C[5,6]C[5]C[6]H)(C[5]N[5]HH)(C[6]O[6]C){1|C<3>,1|S<4>,4|H<1>}	128.5685	0.083	2	128.5685	0.007	2	128.5685	0.007	2	127.7680	1.926	3	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:2:1:1:	4:3:2:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:O-2:H-1:H-1:	C[5,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6]O[5])(O[6]C[5,6])(CHHO)	C(C[6]C[5,6]O[6])(OP)(H)2	C[5,6](C[5,6]C[5,6]O[5]H)(C[6]O[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6]O[5])(O[6]C[5,6])(CHHO){2|C<4>,2|H<1>,2|O<2>}	C(C[6]C[5,6]O[6])(OP)(H)2	C[5,6](C[5,6]C[5,6]O[5]H)(C[6]O[6]C)(O[5]C[5]){1|H<1>,1|O<2>,3|C<4>}	111.5500	0.000	1	111.5500	0.000	1	111.5500	0.000	1	111.5500	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:2:4:	3:2:1:1:	4:4:3:	C[5,6]-3:O[6]-2:C-4:	C[6]-3:O-2:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(O[6]C[6,6])(CHHO)	C(C[6]C[5,6]O[6])(OH)(H)2	C[5,6](C[5,6]C[6,6]C[5]H)(C[5]C[5]HH)(C[6]O[6]C)	C[6](C[5,6]C[5,6]C[5])(O[6]C[6,6])(CHHO){1|O<2>,3|C<4>,4|H<1>}	C(C[6]C[5,6]O[6])(OH)(H)2	C[5,6](C[5,6]C[6,6]C[5]H)(C[5]C[5]HH)(C[6]O[6]C){1|C<3>,2|C<4>,4|H<1>}	127.5810	0.000	1	127.5810	0.000	1	127.5810	0.000	1	127.5810	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:S[5]-2:	C[6](C[5,6]C[5,6]S[5])2(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[6]N[5])(C[6]C[5,6]C)(S[5]S[5])	C[6](C[5,6]C[5,6]S[5])2(CH3){1|C<3>,2|N<2>,2|S<2>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[6]N[5])(C[6]C[5,6]C)(S[5]S[5]){1|C<3>,1|O<1>,1|S<2>}	121.6275	0.354	2	121.6275	0.126	2	121.4892	0.091	4	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:S[5]-2:	C[6](C[5,6]C[5,6]S[5])2(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]N[5]N[6])(C[6]C[5,6]C)(S[5]Se[5])	C[6](C[5,6]C[5,6]S[5])2(CH3){2|Se<2>,1|N<3>,2|N<2>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]N[5]N[6])(C[6]C[5,6]C)(S[5]Se[5]){1|C<3>,1|C<4>,1|S<2>}	121.3510	0.264	2	121.3510	0.070	2	121.4892	0.091	4	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]N[5,6]O[5])2(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5])	C[6](C[5,6]N[5,6]O[5])2(CH3){1|Ge<2>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5]){1|C<3>,1|N<3>,1|O<2>,3|H<1>}	121.1481	1.003	10	121.2193	0.982	14	121.2193	0.982	14	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]N[5,6]O[5])2(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5])	C[6](C[5,6]N[5,6]O[5])2(CH3){1|Ge<3>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5]){1|C<3>,1|N<3>,1|O<2>,1|O<3>,3|H<1>}	121.4825	1.808	2	121.2193	0.982	14	121.2193	0.982	14	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]N[5,6]O[5])2(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5])	C[6](C[5,6]N[5,6]O[5])2(CH3){1|Ge<3>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](N[5,6]Ge[6]C[5])(C[6]C[5,6]C)(O[5]C[5]){1|Cl<1>,1|C<3>,1|N<3>,1|O<2>,3|H<1>}	121.3120	0.484	2	121.2193	0.982	14	121.2193	0.982	14	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6a]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6a]O)(CH3){1|C<4>,3|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6]C)(O[5]C[5]){1|C<4>,1|O<2>,2|C<3>,2|O<1>}	123.1350	0.122	2	123.1350	0.015	2	123.3363	0.129	3	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3){1|C<4>,1|O<2>,2|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	123.7390	0.000	1	123.7390	0.000	1	123.3363	0.129	3	121.5731	1.220	21	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:3:	C[5,6]-3:C[6,6a]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6a]C[6,6a]C[6a])(CH3)	C(C[6]C[6,6a]C[5,6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]C[6,6a]C)	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6a]C[6,6a]C[6a])(CH3){1|C<4>,1|O<2>,5|C<3>}	C(C[6]C[6,6a]C[5,6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]C[6,6a]C){1|O<1>,2|H<1>,5|C<3>}	119.9555	0.182	2	119.9555	0.033	2	119.9555	0.033	2	122.5109	3.165	7	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:3:	C[5,6]-3:N[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	C[6](C[5,6]N[5,6]C[5])(N[5,6]C[5,6]B[5])(CH3)	C(C[6]C[5,6]N[5,6])(H)3	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]N[5,6]C)	C[6](C[5,6]N[5,6]C[5])(N[5,6]C[5,6]B[5])(CH3){1|Cl<1>,1|B<4>,6|C<3>}	C(C[6]C[5,6]N[5,6])(H)3	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]N[5,6]C){1|Cl<1>,1|B<4>,1|C<4>,5|C<3>}	123.5377	0.098	3	123.5377	0.010	3	123.5377	0.010	3	122.5109	3.165	7	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:3:	C[5,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6]C)(CH3)	C(C[6]C[5,6]N[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]N[6]C)	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6]C)(CH3){1|C<4>,1|O<1>,3|C<3>}	C(C[6]C[5,6]N[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]N[6]C){1|O<1>,2|C<4>,2|H<1>,3|C<3>}	122.9540	0.000	1	122.9540	0.000	1	123.5260	0.654	2	122.5109	3.165	7	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:3:3:	C[5,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6a]C[6])(CH3)	C(C[6]C[5,6]N[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]N[6]C)	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6a]C[6])(CH3){1|C<4>,1|O<1>,5|C<3>}	C(C[6]C[5,6]N[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]N[6]C){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	124.0980	0.000	1	124.0980	0.000	1	123.5260	0.654	2	122.5109	3.165	7	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]N[6])(C[5]C[5]HH)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]N[6])(C[5]C[5]HH)(C[6]C[6]C){1|Co<4>,1|C<3>,5|H<1>}	120.9305	1.129	2	121.2753	0.994	3	121.2753	0.994	3	121.8487	2.017	6	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]N[6])(C[5]C[5]HH)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]N[6])(C[5]C[5]HH)(C[6]C[6]C){1|Ir<8>,1|C<3>,5|H<1>}	121.9650	0.000	1	121.2753	0.994	3	121.2753	0.994	3	121.8487	2.017	6	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:P[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]P[6])(P[5]C[5]CS)(C[6]C[6]C)	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,1|P<2>,1|S<1>,2|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]P[6])(P[5]C[5]CS)(C[6]C[6]C){1|C<3>,3|C<4>}	120.4110	0.000	1	120.4110	0.000	1	120.4110	0.000	1	121.8487	2.017	6	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5,6]C[5]C)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5,6]C[5]C)(C[6]C[6]C){1|O<2>,3|H<1>,4|C<3>}	123.2590	0.000	1	123.2590	0.000	1	123.4275	0.057	2	121.8487	2.017	6	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5,6]C[5]H)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5,6]C[5]H)(C[6]C[6]C){1|O<2>,3|H<1>,4|C<3>}	123.5960	0.000	1	123.5960	0.000	1	123.4275	0.057	2	121.8487	2.017	6	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:2:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:N[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[4,6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[4,6]C)(N[5]C[5,6a])(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[4,6]C)(N[5]C[5,6a])(C[6]C[6]C){2|C<3>,2|C<4>,2|H<1>}	118.4235	0.281	4	118.4235	0.079	4	118.4235	0.079	4	121.1479	9.520	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:2:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,3|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	124.6775	0.951	2	123.8722	2.342	4	123.8722	2.342	4	121.1479	9.520	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:2:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,4|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C){1|O<1>,3|H<1>,4|C<4>}	121.7390	0.000	1	123.8722	2.342	4	123.8722	2.342	4	121.1479	9.520	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:2:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(CH3){2|C<3>,3|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(O[5]C[5,6])(C[6]C[6]C){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	124.3950	0.000	1	123.8722	2.342	4	123.8722	2.342	4	121.1479	9.520	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[6]-3:N[5]-2:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[6]C)(N[5]C[5])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){2|C<4>,3|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[6]C)(N[5]C[5]){1|N<2>,2|C<3>,2|H<1>}	118.6690	0.000	1	118.6690	0.000	1	118.6690	0.000	1	118.6690	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,5]-4:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C){1|Cl<1>,2|C<3>,2|C<4>,3|H<1>}	120.2975	0.120	2	120.2975	0.014	2	120.2975	0.014	2	122.3554	5.080	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[6]H)(C[5]C[5,6a]C)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[6]H)(C[5]C[5,6a]C)(C[6]C[6]C){2|H<1>,4|C<3>}	121.7840	0.000	1	121.7840	0.000	1	121.7840	0.000	1	122.3554	5.080	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(CH3){1|C<4>,5|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C){1|H<1>,2|O<1>,6|C<3>}	125.2120	0.000	1	125.2120	0.000	1	125.2120	0.000	1	122.3554	5.080	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:3:3:	C[5a,6]-3:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[6]-3:C[5]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5a,6]C[5,6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[5a,6]C)(C[5]O[5]O)	C[6](C[5a,6]C[5a,6]N[5a])(C[5,6]C[5,6]C[5])(CH3){1|N<2>,1|O<1>,1|O<2>,2|C<3>,3|C<4>}	C(C[6]C[5a,6]C[5,6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[5a,6]C)(C[5]O[5]O){1|N<3>,2|C<3>,3|H<1>}	124.1860	0.000	1	124.1860	0.000	1	124.1860	0.000	1	122.3554	5.080	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,5,6]C[5,6]C[5]2)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]O)(CH3){4|C<4>,4|H<1>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,5,6]C[5,6]C[5]2)(C[5]C[5]HH)(C[6]C[6]C){1|C<3>,1|O<1>,3|C<4>,6|H<1>}	123.7290	0.000	1	123.7290	0.000	1	123.7290	0.000	1	125.2025	4.342	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]O)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]O[5]O)(C[5]C[5]CH)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]O)(CH3){2|H<1>,2|O<2>,4|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]O[5]O)(C[5]C[5]CH)(C[6]C[6]C){1|H<1>,1|O<1>,2|C<4>,2|O<2>}	126.6760	0.000	1	126.6760	0.000	1	126.6760	0.000	1	125.2025	4.342	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:3:1:1:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-3:H-1:H-1:	C[5,6,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CCHH)	C(C[6]C[5,6]C[6])(CCH)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CCHH){2|C<3>,4|C<4>}	C(C[6]C[5,6]C[6])(CCH)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){1|O<2>,2|C<4>,2|O<1>,5|H<1>}	122.3570	0.000	1	122.5010	0.041	2	122.5010	0.041	2	122.5010	0.041	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:3:1:1:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-3:H-1:H-1:	C[5,6,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CCHH)	C(C[6]C[5,6]C[6])(CCH)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CCHH){2|C<3>,4|C<4>}	C(C[6]C[5,6]C[6])(CCH)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){2|O<1>,3|C<4>,5|H<1>}	122.6450	0.000	1	122.5010	0.041	2	122.5010	0.041	2	122.5010	0.041	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:1:1:	3:4:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6a]C[6])(CCHH)	C(C[6]C[5,6]C[6])(CCHH)(H)2	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]CC)(C[6]C[6]C)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6a]C[6])(CCHH){1|H<1>,3|C<4>,4|C<3>}	C(C[6]C[5,6]C[6])(CCHH)(H)2	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]CC)(C[6]C[6]C){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	120.9100	0.000	1	120.9100	0.000	1	120.9100	0.000	1	120.9100	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:1:1:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C[5]-4:H-1:H-1:	C[5,6,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CC[5]HH)	C(C[6]C[5,6]C[6])(C[5]C[5]O[5]H)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(CC[5]HH){2|C<3>,4|C<4>}	C(C[6]C[5,6]C[6])(C[5]C[5]O[5]H)(H)2	C[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){2|O<1>,3|C<4>,5|H<1>}	123.4430	0.004	2	123.4430	0.000	2	123.4430	0.000	2	123.4430	0.000	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:1:1:	4:3:3:	C[6,6a]-3:C[5,6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6]C[5])(CCHH)	C(C[6]C[6,6a]C[5,6])(CCHH)(H)2	C[5,6](C[5,6]C[5,6a]C[6a]O[6])(C[5]C[5,6a]O)(C[6]C[6,6a]C)	C[6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6]C[5])(CCHH){1|H<1>,1|O<1>,1|O<2>,5|C<3>}	C(C[6]C[6,6a]C[5,6])(CCHH)(H)2	C[5,6](C[5,6]C[5,6a]C[6a]O[6])(C[5]C[5,6a]O)(C[6]C[6,6a]C){6|C<3>}	121.5870	0.000	1	121.5870	0.000	1	121.5870	0.000	1	121.5870	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:1:	3:3:3:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,6]-3:C[6]-3:C[5]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[5,6]C[5,6]C[5])(CCCH)	C(C[6]C[5,6]2)(CH3)2(H)	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]O[5]O)	C[6](C[5,6]C[5,6a]C[5,6])(C[5,6]C[5,6]C[5])(CCCH){1|N<3>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	C(C[6]C[5,6]2)(CH3)2(H)	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]O[5]O){1|C<3>,2|O<2>,3|C<4>}	122.7070	0.000	1	122.7070	0.000	1	122.7070	0.000	1	122.7070	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:1:	3:4:3:	C[5,6]-3:C[5,6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[5,6]C[5,6]C[5])(CCCH)	C(C[6]C[5,6]2)(CH3)2(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]C)(C[6]C[5,6]C)	C[6](C[5,6]C[5,6a]C[5,6])(C[5,6]C[5,6]C[5])(CCCH){1|N<3>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	C(C[6]C[5,6]2)(CH3)2(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]C)(C[6]C[5,6]C){1|H<1>,3|C<4>,4|C<3>}	122.3080	0.000	1	122.3080	0.000	1	122.3080	0.000	1	122.3080	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:1:	3:5:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,6a]-3:C[5,6]-5:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(CCCH)	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]AlC)(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]AlC)(C[6]C[6]C){3|C<3>,3|H<1>}	124.4080	0.000	1	124.4080	0.000	1	124.4080	0.000	1	124.4080	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:1:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[3x5,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[3x5,6]O[5])(C[6]C[5,6]O)(CCCH)	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[3x5,6]C[3x5,6]C[5,5]O[5])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[3x5,6]O[5])(C[6]C[5,6]O)(CCCH){1|O<2>,5|C<4>}	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[3x5,6]C[3x5,6]C[5,5]O[5])(C[6]C[6]C)(O[5]C[5]){1|H<1>,1|O<1>,7|C<4>}	124.9040	0.000	1	124.9040	0.000	1	124.9040	0.000	1	124.9040	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:1:	4:3:3:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,3x6]-4:C[5,6a]-3:C[6]-3:	C[6](C[5,6]C[5,3x6]C[5,6a])(C[6]C[6]H)(CCCH)	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,3x6]Ge[5,3x6]C[3x6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C)	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>}	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,3x6]Ge[5,3x6]C[3x6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C){1|Ge<4>,3|H<1>,5|C<3>}	126.1270	0.000	1	126.1270	0.000	1	126.1270	0.000	1	126.1270	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:4:	3:3:4:	P[3x6]-3:C[5,6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	N[5,6]-3:C[6]-3:C[5]-4:	C[6](P[3x6]C[4x6]C[6,6])(C[5,6]N[5,6]C[5])(CC3)	C(C[6]C[5,6]P[3x6])(CH3)3	C[5,6](N[5,6]C[3x6]C[5])(C[6]P[3x6]C)(C[5]C[5]CC)	C[6](P[3x6]C[4x6]C[6,6])(C[5,6]N[5,6]C[5])(CC3){2|C<3>,2|H<1>,6|C<4>}	C(C[6]C[5,6]P[3x6])(CH3)3	C[5,6](N[5,6]C[3x6]C[5])(C[6]P[3x6]C)(C[5]C[5]CC){1|C<3>,2|H<1>,4|C<4>}	130.2160	0.000	1	130.2160	0.000	1	130.2160	0.000	1	130.2160	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:3:4:	3:4:4:4:	4:3:2:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[5,6]-4:C[6]-3:N[5]-2:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CC3)	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]O[5]C)(C[6]C[6]C)(N[5]P[5])	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>}	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]O[5]C)(C[6]C[6]C)(N[5]P[5]){1|Cl<1>,1|C<3>,1|O<1>,2|H<1>}	120.9180	0.000	1	120.9180	0.000	1	120.9180	0.000	1	120.9180	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:3:2:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CH3){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){1|C<3>,1|C<4>,1|O<1>,4|H<1>}	123.7550	0.000	1	123.7550	0.000	1	123.7550	0.000	1	123.7550	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:3:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6a]C[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]C)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6a]C[6]H)(CH3){1|H<1>,1|S<4>,5|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]C){1|C<4>,2|H<1>,2|O<1>,4|C<3>}	124.4070	0.000	1	124.4070	0.000	1	124.4070	0.000	1	124.4070	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:3:4:	C[5,6]-3:C[6,6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5])(C[6,6]C[6]3)(CH3)	C(C[6]C[5,6]C[6,6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6,6]C)(C[5]N[5]HH)	C[6](C[5,6]C[5,6]C[5])(C[6,6]C[6]3)(CH3){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,6|H<1>}	C(C[6]C[5,6]C[6,6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[6,6]C)(C[5]N[5]HH){1|C<3>,1|S<4>,2|H<1>,3|C<4>}	124.0360	0.000	1	124.0360	0.000	1	124.0360	0.000	1	124.0360	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[5]N[5]HH)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6]HH)(CH3){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6])(C[5]N[5]HH)(C[6]C[6]C){1|S<4>,2|C<4>,4|H<1>}	124.3930	0.000	1	124.3930	0.000	1	124.3930	0.000	1	124.9543	0.233	4	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]CH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]C)(C[6]C[6]C)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]CH)(CH3){2|C<4>,4|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]C)(C[6]C[6]C){1|O<1>,3|H<1>,4|C<3>}	125.3780	0.000	1	125.3780	0.000	1	125.1413	0.139	3	124.9543	0.233	4	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	3:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]C[5]H)(C[6]C[6]C)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(CH3){2|C<4>,2|H<1>,3|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]C[5]H)(C[6]C[6]C){1|C<4>,4|H<1>,5|C<3>}	125.0230	0.441	2	125.0230	0.195	2	125.1413	0.139	3	124.9543	0.233	4	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:2:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[6,6]H)(O[5]C[5,6a])(C[6]C[6]C)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CH3){1|C<4>,2|H<1>,3|C<3>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6a]C[6,6]H)(O[5]C[5,6a])(C[6]C[6]C){1|C<4>,2|H<1>,4|C<3>}	124.7120	0.000	1	124.7120	0.000	1	124.7120	0.000	1	124.7120	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[3x5,6]-4:C[5]-3:C[6]-3:	C[6](C[5,6]C[3x5,6]C[5])(C[6]C[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[3x5,6]C[5,5]2C[5,6])(C[5]C[5]O)(C[6]C[6]C)	C[6](C[5,6]C[3x5,6]C[5])(C[6]C[6]HH)(CH3){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[3x5,6]C[5,5]2C[5,6])(C[5]C[5]O)(C[6]C[6]C){1|Si<4>,1|O<2>,4|C<4>,4|H<1>}	125.4030	0.000	1	125.4030	0.000	1	125.4030	0.000	1	124.9365	1.665	10	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]HH)(CH3){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]C){1|C<3>,1|C<4>,5|H<1>}	124.5229	0.871	8	124.5229	0.759	8	124.8847	1.842	9	124.9365	1.665	10	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:3:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]O[6]CC)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]O[6]O)(C[5]O[5]O)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]O[6]CC)(CH3){1|C<4>,1|O<1>,3|O<2>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]O[6]O)(C[5]O[5]O)(C[6]C[6]C){1|O<2>,4|C<4>}	127.7790	0.000	1	127.7790	0.000	1	124.8847	1.842	9	124.9365	1.665	10	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:3:4:	C[5,6]-3:C[5,6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5])(C[5,6]C[5,6]2H)(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[5,6]C)(C[5]C[5]CH)	C[6](C[5,6]C[5,6]C[5])(C[5,6]C[5,6]2H)(CH3){2|C<3>,3|H<1>,6|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[6]C[5,6]C)(C[5]C[5]CH){1|C<3>,3|C<4>,3|H<1>}	124.4470	0.415	4	124.4470	0.172	4	124.4470	0.172	4	124.4470	0.172	4	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]2H)(CClHH)	C(C[6]C[5,6]C[6])(Cl)(H)2	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HO)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]2H)(CClHH){1|C<3>,2|H<1>,2|O<2>,6|C<4>}	C(C[6]C[5,6]C[6])(Cl)(H)2	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HO)(C[6]C[6]C){1|C<3>,1|O<2>,2|C<4>,5|H<1>}	121.6490	0.000	1	121.6490	0.000	1	121.6490	0.000	1	124.7314	2.701	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[3,5]-4:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[3,5]C[5,6])(C[6]N[6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[3,5]C[3]2C[5])(C[5,6]C[5]C[6]H)(C[6]C[6]C)	C[6](C[5,6]C[3,5]C[5,6])(C[6]N[6]HH)(CH3){1|C<3>,1|H<1>,1|S<4>,4|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[3,5]C[3]2C[5])(C[5,6]C[5]C[6]H)(C[6]C[6]C){10|H<1>,1|N<3>,1|O<1>}	126.0230	0.000	1	126.0230	0.000	1	126.0230	0.000	1	124.7314	2.701	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6]2)(C[6]C[5,6]HH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]C[5]H)(C[5,6]C[5,6]C[6]H)(C[6]C[6]C)	C[6](C[5,6]C[5,6]2)(C[6]C[5,6]HH)(CH3){1|C<3>,3|H<1>,4|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5,6]C[5]H)(C[5,6]C[5,6]C[6]H)(C[6]C[6]C){3|C<3>,3|C<4>,6|H<1>}	124.4020	0.970	2	124.4020	0.941	2	124.4020	0.941	2	124.7314	2.701	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,6]CH)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[5]N[5]HH)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,6]CH)(CH3){1|N<3>,2|H<1>,5|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]C)(C[5]N[5]HH)(C[6]C[6]C){1|C<3>,1|C<4>,1|S<4>,5|H<1>}	124.2315	0.306	2	124.2315	0.094	2	125.3438	1.693	4	124.7314	2.701	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:1:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]O[6]H)(CH3)	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]2)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]O[6]H)(CH3){2|H<1>,3|C<3>,4|C<4>}	C(C[6]C[5,6]C[6])(H)3	C[5,6](C[5,6]C[5]C[6]2)(C[5]C[5]HH)(C[6]C[6]C){1|C<3>,1|O<1>,2|C<4>,2|O<2>,5|H<1>}	126.4560	0.188	2	126.4560	0.035	2	125.3438	1.693	4	124.7314	2.701	8	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:2:1:1:	3:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:O-2:H-1:H-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(CHHO)	C(C[6]C[5,6]C[6])(OH)(H)2	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]C)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(CHHO){2|C<3>,2|C<4>,3|H<1>}	C(C[6]C[5,6]C[6])(OH)(H)2	C[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]C){2|C<3>,2|C<4>,6|H<1>}	122.8900	0.380	2	122.8900	0.145	2	122.8900	0.145	2	122.8900	0.145	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:2:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:O-2:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]CH)(CHHO)	C(C[6]C[5,6]C[6])(OC)(H)2	C[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CC)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]CH)(CHHO){1|C<3>,2|H<1>,4|C<4>}	C(C[6]C[5,6]C[6])(OC)(H)2	C[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CC)(C[6]C[6]C){1|C<3>,3|C<4>,4|H<1>}	123.5590	0.000	1	123.5590	0.000	1	123.5590	0.000	1	123.5590	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:3:1:1:	4:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:N-3:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]HH)(CHHN)	C(C[6]C[5,6]C[6])(NCS)(H)2	C[5,6](C[5,6]C[5]C[6]H)(C[5]N[5]HH)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]HH)(CHHN){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C(C[6]C[5,6]C[6])(NCS)(H)2	C[5,6](C[5,6]C[5]C[6]H)(C[5]N[5]HH)(C[6]C[6]C){1|C<3>,1|S<4>,5|H<1>}	122.9370	0.000	1	122.9370	0.000	1	122.9370	0.000	1	122.9370	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:4:1:1:	3:4:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:C-4:H-1:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]HH)(CCHH)	C(C[6]C[5,6]C[6])(CH3)(H)2	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CH)(C[6]C[6]C)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]HH)(CCHH){1|C<4>,3|C<3>,3|H<1>}	C(C[6]C[5,6]C[6])(CH3)(H)2	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CH)(C[6]C[6]C){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	122.4800	0.000	1	122.4800	0.000	1	122.4800	0.000	1	122.4800	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:4:4:1:	3:3:2:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CCCH)	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]HH)(CCCH){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(O[5]C[5]){1|O<1>,1|O<2>,2|C<4>,3|H<1>}	123.0375	0.122	2	123.0375	0.015	2	123.0375	0.015	2	123.0375	0.015	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:4:4:1:	4:3:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:C-4:C-4:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]N[6]HH)(CCCH)	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]C)(C[6]C[6]C)	C[6](C[5,6]C[5,6]C[5])(C[6]N[6]HH)(CCCH){1|C<3>,1|S<4>,4|C<4>}	C(C[6]C[5,6]C[6])(CH3)2(H)	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]C)(C[6]C[6]C){1|N<3>,8|H<1>}	125.0670	0.000	1	125.0670	0.000	1	125.0670	0.000	1	125.0670	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:4:4:4:	3:2:3:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:C-4:C-4:C-4:	C[5,6]-3:O[5]-2:C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]CH)(CC3)	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]N[5])(O[5]In[5,5])(C[6]C[6]C)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]CH)(CC3){1|In<5>,1|C<3>,1|C<4>,1|N<3>}	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]N[5])(O[5]In[5,5])(C[6]C[6]C){1|C<4>,1|I<1>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	120.3405	0.668	4	120.3405	0.446	4	120.3405	0.446	4	120.3405	0.446	4	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	3:4:4:	3:4:4:4:	3:3:2:	C[5,6]-3:C[6]-4:C-4:	C[6]-3:C-4:C-4:C-4:	C[5,6]-3:C[6]-3:S[5]-2:	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]DyO)(CC3)	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]S[5])(C[6]C[6]C)(S[5]C[5])	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]DyO)(CC3){1|O<2>,1|S<2>,2|C<3>}	C(C[6]C[5,6]C[6])(CH3)3	C[5,6](C[5,6]C[6]S[5])(C[6]C[6]C)(S[5]C[5]){1|Dy<16>,1|C<3>,1|O<2>,2|C<4>}	127.4430	2.198	2	127.4430	4.830	2	127.4430	4.830	2	127.4430	4.830	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	3:3:3:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C[5]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]C)	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3){2|C<3>,5|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]C){1|Ru<8>,1|H<1>,5|C<4>}	123.7090	0.000	1	123.7090	0.000	1	123.7090	0.000	1	123.7090	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	3:3:4:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5]Fe)(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]HH)	C[6](C[5,6]C[5,6]C[5]Fe)(C[5,6]C[5,6]C[5])(CH3){1|C<3>,3|H<1>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]HH){1|Fe<10>,3|C<4>,4|H<1>}	124.1160	0.025	2	124.1160	0.001	2	123.6878	0.928	5	123.6878	0.928	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	3:3:4:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]CH)	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3){1|H<1>,3|C<3>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]CH){1|Ru<8>,5|C<4>}	122.0610	0.000	1	122.0610	0.000	1	123.6878	0.928	5	123.6878	0.928	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	3:3:4:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]HH)	C[6](C[5,6]C[5,6]C[5]Ru)(C[5,6]C[5,6]C[5])(CH3){1|C<3>,3|H<1>,4|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,6]C[5]C[6])(C[6]C[5,6]C)(C[5]C[5]HH){1|Ru<10>,3|C<4>,4|H<1>}	124.0730	0.634	2	124.0730	0.401	2	123.6878	0.928	5	123.6878	0.928	5	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	4:3:2:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,5,6]-4:C[6]-3:O[5]-2:	C[6](C[5,6]C[5,5,6]C[5]H)(C[5,6]C[5,5,6]O[5])(CH3)	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,5,6]C[5,5,6]C[5]2)(C[6]C[5,6]C)(O[5]C[5])	C[6](C[5,6]C[5,5,6]C[5]H)(C[5,6]C[5,5,6]O[5])(CH3){1|C<3>,1|O<1>,6|C<4>}	C(C[6]C[5,6]2)(H)3	C[5,6](C[5,5,6]C[5,5,6]C[5]2)(C[6]C[5,6]C)(O[5]C[5]){1|C<3>,1|O<1>,4|C<4>,5|H<1>}	126.1980	0.000	1	126.1980	0.000	1	126.1980	0.000	1	126.1980	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	4:3:3:	C[6,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[6]-3:C[5]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6]C[6,6])(H)3	C[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]C)(C[5]C[5]H)	C[6](C[6,6]C[6,6]C[6]H)(C[5,6]C[5,6]C[5])(CH3){2|C<3>,3|C<4>,5|H<1>}	C(C[6]C[5,6]C[6,6])(H)3	C[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]C)(C[5]C[5]H){2|C<4>,6|H<1>}	122.3420	0.000	1	122.3420	0.000	1	122.3420	0.000	1	122.3420	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	4:3:4:	C[5,6,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,5,6]-4:C[6]-3:C[5]-4:	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[5,6]C[5,5,6]C[5])(CH3)	C(C[6]C[5,6,6]C[5,6])(H)3	C[5,6](C[5,5,6]O[5,6]C[5]2)(C[6]C[5,6,6]C)(C[5]C[5]HH)	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[5,6]C[5,5,6]C[5])(CH3){2|O<2>,5|H<1>,7|C<4>}	C(C[6]C[5,6,6]C[5,6])(H)3	C[5,6](C[5,5,6]O[5,6]C[5]2)(C[6]C[5,6,6]C)(C[5]C[5]HH){2|H<1>,2|O<2>,6|C<4>}	123.3610	0.000	1	123.3610	0.000	1	123.3610	0.000	1	123.3610	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:1:1:1:	4:4:3:	C[5,6,6]-4:C[5,6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[5,6]C[5,6]C[5])(CH3)	C(C[6]C[5,6,6]C[5,6])(H)3	C[5,6](C[5,6]C[5,6,6]C[5,6a]H)(C[5]C[5,6a]HH)(C[6]C[5,6,6]C)	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[5,6]C[5,6]C[5])(CH3){1|C<4>,6|C<3>,7|H<1>}	C(C[6]C[5,6,6]C[5,6])(H)3	C[5,6](C[5,6]C[5,6,6]C[5,6a]H)(C[5]C[5,6a]HH)(C[6]C[5,6,6]C){3|C<3>,4|C<4>}	120.4090	0.000	2	120.4090	0.000	2	120.4090	0.000	2	120.4090	0.000	2	123.2168	6.476	131	123.2523	6.593	132
762	490	818	0:SP2_SP2_SP3	C[6]	C	C[5,6]	4:3:4:	3:4:1:1:	4:3:3:	C[5,6]-4:C[5,6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5,6]-4:C[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,5]C[5]C[6])(C[5,6]C[5,6]2)(CCHH)	C(C[6]C[5,6]2)(CC[5]HH)(H)2	C[5,6](C[5,6]C[5,6]C[5]C[6])(C[5,6]C[5]C[6])(C[6]C[5,6]C)	C[6](C[5,6]C[5,5]C[5]C[6])(C[5,6]C[5,6]2)(CCHH){3|C<3>,4|H<1>,5|C<4>}	C(C[6]C[5,6]2)(CC[5]HH)(H)2	C[5,6](C[5,6]C[5,6]C[5]C[6])(C[5,6]C[5]C[6])(C[6]C[5,6]C){1|C<3>,1|O<1>,5|H<1>,6|C<4>}	122.7690	0.000	1	122.7690	0.000	1	122.7690	0.000	1	122.7690	0.000	1	123.2168	6.476	131	123.2523	6.593	132
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:3:4:	3:1:1:1:	4:4:3:	C[4,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]C[5,6]O)(CH3)	C(C[6]C[4,6]C[6])(H)3	C[4,6](C[4,6]C[5,6]C[4]C)(C[4]C[4]HH)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]C[5,6]O)(CH3){1|C<3>,2|H<1>,3|C<4>}	C(C[6]C[4,6]C[6])(H)3	C[4,6](C[4,6]C[5,6]C[4]C)(C[4]C[4]HH)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	125.0500	0.000	1	125.0500	0.000	1	125.0500	0.000	1	125.0500	0.000	1	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:4:4:	3:1:1:1:	4:4:3:	C[4,6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]C[5,6]HH)(CH3)	C(C[6]C[4,6]C[6])(H)3	C[4,6](C[4,6]C[5,6]N[4]C)(C[4]N[4]HH)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]C[5,6]HH)(CH3){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	C(C[6]C[4,6]C[6])(H)3	C[4,6](C[4,6]C[5,6]N[4]C)(C[4]N[4]HH)(C[6]C[6]C){1|C<4>,2|C<3>,3|H<1>}	125.4070	0.000	1	125.4070	0.000	1	125.4070	0.000	1	125.4070	0.000	1	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:4:4:	3:4:1:1:	4:4:3:	C[4,6]-3:C[6]-4:C-4:	C[6]-3:C-4:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH)	C(C[6]C[4,6]C[6])(CCHH)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[5a]C[4]O)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH){1|C<3>,1|H<1>,1|O<2>,1|S<4>,2|C<4>}	C(C[6]C[4,6]C[6])(CCHH)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[5a]C[4]O)(C[6]C[6]C){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	123.5930	0.000	1	123.5930	0.000	1	123.8740	0.282	8	123.8740	0.282	8	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:4:4:	3:4:1:1:	4:4:3:	C[4,6]-3:C[6]-4:C-4:	C[6]-3:C-4:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH)	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]H)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH){1|C<3>,1|S<4>,2|C<4>,2|H<1>}	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]H)(C[6]C[6]C){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	123.7060	0.000	1	123.7060	0.000	1	123.8740	0.282	8	123.8740	0.282	8	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:4:4:	3:4:1:1:	4:4:3:	C[4,6]-3:C[6]-4:C-4:	C[6]-3:C-4:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH)	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]O)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH){1|C<3>,1|H<1>,1|O<2>,1|S<4>,2|C<4>}	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]O)(C[6]C[6]C){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	124.1805	0.608	4	123.9488	0.367	6	123.8740	0.282	8	123.8740	0.282	8	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	3:4:4:	3:4:1:1:	4:4:3:	C[4,6]-3:C[6]-4:C-4:	C[6]-3:C-4:H-1:H-1:	C[4,6]-4:C[4]-4:C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH)	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]O)(C[6]C[6]C)	C[6](C[4,6]C[4,6]C[4])(C[6]N[6]CH)(CCHH){1|C<3>,1|H<1>,1|O<2>,1|S<4>,2|C<4>}	C(C[6]C[4,6]C[6])(CH3)(H)2	C[4,6](C[4,6]C[4]C[6]H)(C[4]C[6a]C[4]O)(C[6]C[6]C){1|C<4>,1|N<3>,3|C<3>,4|H<1>}	123.4855	0.286	2	123.9488	0.367	6	123.8740	0.282	8	123.8740	0.282	8	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	6:3:4:	3:3:1:1:	3:4:3:	C[5x3,5x5,21x6]-6:C[4,6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:C[4,6]-4:C[4,6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CC[6a]HH)	C(C[6]C[5x3,5x5,21x6]C[4,6])(C[6a]C[6a]2)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]C)(C[4,6]C[4,6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CC[6a]HH){1|C<3>,3|C<4>,4|H<1>,5|B<6>}	C(C[6]C[5x3,5x5,21x6]C[4,6])(C[6a]C[6a]2)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]C)(C[4,6]C[4,6]C[6]){2|C<6>,2|H<1>,3|C<4>,4|B<6>}	123.5970	0.000	1	123.5970	0.000	1	123.5970	0.000	1	123.5970	0.000	1	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	6:3:4:	3:4:1:1:	3:4:3:	C[5x3,5x5,21x6]-6:C[4,6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[4,6]-4:C[4,6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CCHH)	C(C[6]C[5x3,5x5,21x6]C[4,6])(CC[6a]HH)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]C)(C[4,6]C[4,6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CCHH){1|C<3>,3|C<4>,4|H<1>,5|B<6>}	C(C[6]C[5x3,5x5,21x6]C[4,6])(CC[6a]HH)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]C)(C[4,6]C[4,6]C[6]){2|C<6>,2|H<1>,3|C<4>,4|B<6>}	125.0905	0.322	2	125.0905	0.104	2	125.0905	0.104	2	125.5020	0.560	3	124.3966	0.849	14	124.3966	0.849	14
762	490	846	0:SP2_SP2_SP3	C[6]	C	C[4,6]	6:3:4:	3:4:1:1:	3:4:3:	C[5x3,5x5,21x6]-6:C[4,6]-3:C-4:	C[6]-3:C[6]-4:H-1:H-1:	C[6]-3:C[4,6]-4:C[4,6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CC[6]HH)	C(C[6]C[5x3,5x5,21x6]C[4,6])(C[6]C[6]2H)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]H)(C[4,6]C[4,6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[4,6]C[4,6]2)(CC[6]HH){1|C<3>,2|C<4>,5|B<6>,5|H<1>}	C(C[6]C[5x3,5x5,21x6]C[4,6])(C[6]C[6]2H)(H)2	C[4,6](C[6]C[5x3,5x5,21x6]C)(C[4,6]C[4,6]C[6]H)(C[4,6]C[4,6]C[6]){1|H<1>,2|C<6>,4|B<6>,4|C<4>}	126.3250	0.000	1	126.3250	0.000	1	126.3250	0.000	1	125.5020	0.560	3	124.3966	0.849	14	124.3966	0.849	14
762	490	849	0:SP2_SP3_SP3	C[6]	C	P[6]	4:3:4:	3:4:1:1:	3:3:3:1:	P[6]-4:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:O-1:	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(CCHH)	C(C[6]C[6]P[6])(CCHH)(H)2	P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]C)(O)	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(CCHH){2|C<4>,4|C<3>}	C(C[6]C[6]P[6])(CCHH)(H)2	P[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]C)(O){1|C<4>,4|C<3>,4|H<1>}	116.9640	0.000	1	116.9640	0.000	1	116.9640	0.000	1	116.9640	0.000	1	116.9640	0.000	1	116.9640	0.000	1
762	490	852	0:SP2_SP3_SP3	C[6,6]	C	P[3,6,6]	3:2:4:	3:4:4:4:	4:3:3:	P[3,6,6]-3:P[6,6]-2:C-4:	C[6,6]-3:C-4:C-4:C-4:	C[3,5,6,6]-4:P[3,5,6,6]-3:C[6,6]-3:	C[6,6](P[3,6,6]C[3,5,6,6]P[3,5,6,6])(P[6,6]C[5,5,6,6])(CC3)	C(C[6,6]P[3,6,6]P[6,6])(CH3)3	P[3,6,6](C[3,5,6,6]P[3,5,6,6]P[5,5,6,6]C)(P[3,5,6,6]C[3,5,6,6]C[5,5,6,6])(C[6,6]P[6,6]C)	C[6,6](P[3,6,6]C[3,5,6,6]P[3,5,6,6])(P[6,6]C[5,5,6,6])(CC3){1|P<4>,3|C<4>}	C(C[6,6]P[3,6,6]P[6,6])(CH3)3	P[3,6,6](C[3,5,6,6]P[3,5,6,6]P[5,5,6,6]C)(P[3,5,6,6]C[3,5,6,6]C[5,5,6,6])(C[6,6]P[6,6]C){1|C<3>,1|P<3>,1|W<6>,2|C<4>}	112.3860	0.000	1	112.3860	0.000	1	112.3860	0.000	1	112.3860	0.000	1	112.3860	0.000	1	112.3860	0.000	1
762	490	856	0:SP2_SP2_SP3	C[6,6]	C	N[6,6]	3:4:4:	3:1:1:1:	3:3:3:	N[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:H-1:H-1:H-1:	Ge[3x6]-3:C[6,6]-3:C[6a]-3:	C[6,6](N[6,6]Ge[3x6]C[6a])(C[3x6]C[6,6]2H)(CH3)	C(C[6,6]C[3x6]N[6,6])(H)3	N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2)	C[6,6](N[6,6]Ge[3x6]C[6a])(C[3x6]C[6,6]2H)(CH3){1|H<1>,1|N<3>,4|C<3>}	C(C[6,6]C[3x6]N[6,6])(H)3	N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>}	125.5870	0.000	1	125.1465	0.388	2	125.1465	0.388	2	125.1465	0.388	2	125.1465	0.388	2	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6,6]	C	N[6,6]	3:4:4:	3:1:1:1:	3:3:3:	N[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:H-1:H-1:H-1:	Ge[3x6]-3:C[6,6]-3:C[6a]-3:	C[6,6](N[6,6]Ge[3x6]C[6a])(C[3x6]C[6,6]2H)(CH3)	C(C[6,6]C[3x6]N[6,6])(H)3	N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2)	C[6,6](N[6,6]Ge[3x6]C[6a])(C[3x6]C[6,6]2H)(CH3){1|N<3>,5|C<3>}	C(C[6,6]C[3x6]N[6,6])(H)3	N[6,6](Ge[3x6]C[6,6]N[6,6])(C[6,6]C[3x6]C)(C[6a]C[6a]2){2|C<4>,2|H<1>,5|C<3>}	124.7060	0.000	1	125.1465	0.388	2	125.1465	0.388	2	125.1465	0.388	2	125.1465	0.388	2	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	3:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6,6a]-3:C[6]-4:C[6]-3:	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6,6a]C[6,6a,6a]C[6,6a])(C[6]C[6]HH)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6,6a]C[6,6a,6a]C[6,6a])(C[6]C[6]HH)(C[6]C[6]C){1|N<3>,3|C<3>,3|H<1>}	120.4440	0.000	1	120.4440	0.000	1	120.4440	0.000	1	120.4017	0.012	3	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	3:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:B[6]-4:C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[6,6a]C[6])(B[6]N[5a,6]FF)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[6,6a]C[6])(B[6]N[5a,6]FF)(C[6]C[6]C){2|H<1>,4|C<3>}	120.4850	0.000	1	120.4850	0.000	1	120.3805	0.022	2	120.4017	0.012	3	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	3:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:B[6]-4:C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[6,6a]C[6])(B[6]O[6]CF)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[6,6a]C[6])(B[6]O[6]CF)(C[6]C[6]C){2|H<1>,3|C<3>}	120.2760	0.000	1	120.2760	0.000	1	120.3805	0.022	2	120.4017	0.012	3	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	3:5:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:Nb[6,6]-5:C[6]-3:	C[6](N[6,6]C[6,6a]Nb[6,6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6a]C[6,6a]C[6a])(Nb[6,6]C[6]N[6]NO)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6a]C[6,6a]C[6a])(Nb[6,6]C[6]N[6]NO)(C[6]C[6]C){2|C<4>,3|H<1>,4|C<3>}	121.5600	1.266	2	121.5600	1.602	2	121.5600	1.602	2	121.5600	1.602	2	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	4:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]C)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(CH3){2|C<3>,2|C<4>,4|H<1>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]C){1|C<4>,1|N<2>,2|C<3>,4|H<1>}	114.3770	0.000	1	114.3770	0.000	1	114.3770	0.000	1	114.3770	0.000	1	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	5:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[3x6]-5:C[6]-4:C[6]-3:	C[6](N[6,6]Ga[3x6]C[6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](Ga[3x6]N[6,6]O[6]2Cl)(C[6]C[6]HH)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](Ga[3x6]N[6,6]O[6]2Cl)(C[6]C[6]HH)(C[6]C[6]C){1|C<4>,3|C<3>,3|H<1>}	120.9120	0.782	2	120.9120	0.612	2	120.9120	0.612	2	120.2042	0.472	6	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:1:1:1:	5:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[3x6]-5:C[6]-4:C[6]-3:	C[6](N[6,6]In[3x6]C[6])(C[6]C[6]H)(CH3)	C(C[6]N[6,6]C[6])(H)3	N[6,6](In[3x6]N[6,6]O[6]2Cl)(C[6]C[6]HH)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(H)3	N[6,6](In[3x6]N[6,6]O[6]2Cl)(C[6]C[6]HH)(C[6]C[6]C){1|C<4>,3|C<3>,3|H<1>}	119.8503	0.287	4	119.8503	0.082	4	119.8503	0.082	4	120.2042	0.472	6	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6,6]	3:3:4:	3:3:1:1:	3:4:3:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(CHHN)	C(C[6]N[6,6]C[6])(NCC)(H)2	N[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]HH)(C[6]C[6]C)	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>}	C(C[6]N[6,6]C[6])(NCC)(H)2	N[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]HH)(C[6]C[6]C){1|C<4>,2|C<3>,3|H<1>}	118.5650	0.000	1	118.5650	0.000	1	118.5650	0.000	1	118.5650	0.000	1	119.8840	3.591	13	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:1:	N[6]-2:N[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a])(N[6]C[6]O)(CClHH)	C(C[6]N[6]2)(Cl)(H)2	N[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(O)	C[6](N[6]C[6,6a])(N[6]C[6]O)(CClHH){3|C<3>}	C(C[6]N[6]2)(Cl)(H)2	N[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(O){4|C<3>}	116.2430	0.000	1	116.2430	0.000	1	116.2430	0.000	1	116.2430	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:4:	N[6]-2:N[6]-3:C-4:	C[6]-3:Br-1:F-1:F-1:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6,6a])(N[6]C[6]C)(CBrFF)	C(C[6]N[6]2)(Br)(F)2	N[6](C[6]C[6,6a]C)(C[6]N[6]C)(CC[6a]HH)	C[6](N[6]C[6,6a])(N[6]C[6]C)(CBrFF){3|C<3>}	C(C[6]N[6]2)(Br)(F)2	N[6](C[6]C[6,6a]C)(C[6]N[6]C)(CC[6a]HH){2|C<3>}	118.2280	0.000	1	118.2280	0.000	1	118.2280	0.000	1	118.2280	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	4:3:1:	N[6]-2:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6,6a])(N[6]C[6]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]C[6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a])(N[6]C[6]H)(CH3){1|H<1>,3|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]C[6a]H)(C[6]N[6]C)(H){4|C<3>}	115.3270	0.000	1	115.3270	0.000	1	115.3270	0.000	1	115.3270	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:1:1:	3:3:1:	N[6]-2:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a])(N[6]C[6]H)(CCHH)	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]C[6,6a]S)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a])(N[6]C[6]H)(CCHH){1|S<1>,2|C<3>}	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]C[6,6a]S)(C[6]N[6]C)(H){2|C<3>}	114.9350	0.000	1	114.9350	0.000	1	114.9350	0.000	1	114.9350	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:C-3:	C[6](N[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CNO)	C[6](N[6]N[6]C)(N[6]N[6])(CH3){1|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CNO){1|C<3>,1|N<2>}	112.8980	0.000	2	120.7407	13.589	12	120.4524	12.041	14	120.4524	12.041	14	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:C-3:	C[6](N[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CNO)	C[6](N[6]N[6]C)(N[6]N[6])(CH3){2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CNO){1|C<4>,1|N<3>}	122.3092	0.455	10	120.7407	13.589	12	120.4524	12.041	14	120.4524	12.041	14	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:C-3:	C[6](N[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CN[6]O)	C[6](N[6]N[6]C)(N[6]N[6])(CH3){2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])(CN[6]O){1|C<4>,1|N<3>}	118.7230	0.257	2	118.7230	0.066	2	120.4524	12.041	14	120.4524	12.041	14	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-2:C-4:	C[6](N[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]C[6])(CH3)	C[6](N[6]C[6]C)(N[6]C[6])(CH3){2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]C[6])(CH3){1|C<3>,1|O<2>}	118.5090	0.000	1	118.5090	0.000	1	118.5090	0.000	1	118.5090	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(C[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](N[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	117.9630	0.000	1	117.9630	0.000	1	117.9630	0.000	1	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cl<1>,1|C<3>}	117.8990	0.334	2	117.8990	0.111	2	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>}	117.7037	0.443	9	117.7037	0.197	9	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cl<1>,1|C<3>}	116.6405	0.293	2	116.4113	0.201	3	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	115.9530	0.000	1	116.4113	0.201	3	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|N<2>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H){1|C<3>}	116.8937	0.699	10	116.8494	0.430	12	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H){1|C<3>}	116.3020	0.000	1	116.8494	0.430	12	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){3|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)(H){1|C<3>}	116.9540	0.000	1	116.8494	0.430	12	117.1753	0.536	26	117.2045	0.538	27	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]N[6]C)	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CF3){5|C<3>}	C(C[6]N[6]2)(F)3	N[6](C[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]N[6]C){2|H<1>,4|C<3>}	117.7240	0.000	1	117.7240	0.000	1	117.7240	0.000	1	117.7228	0.403	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]N)(C[6a]C[6a]2)(C[6]N[6]C)	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CH3){1|N<2>,4|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]N)(C[6a]C[6a]2)(C[6]N[6]C){2|C<4>,4|C<3>}	117.0890	0.089	2	117.0890	0.008	2	117.0890	0.008	2	117.7228	0.403	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6a]-3:C[6]-3:	C[6](N[6]N[6a]C[6])(N[6]C[6,6a])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]S)(N[6a]C[6a]2)(C[6]N[6]C)	C[6](N[6]N[6a]C[6])(N[6]C[6,6a])(CH3){1|S<1>,4|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]S)(N[6a]C[6a]2)(C[6]N[6]C){1|C<4>,1|N<2>,1|O<1>,3|C<3>}	118.3560	0.000	2	118.3560	0.000	2	118.3560	0.000	2	117.7228	0.403	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]B[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]H)(CCCH)	C[6](N[6]C[6]C)(N[6]B[6])(CH3){1|H<1>,1|N<3>,2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]H)(CCCH){1|B<4>,1|C<4>}	116.0880	0.000	1	116.0880	0.000	1	118.7564	2.654	5	118.7564	2.654	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C)(CC[6]HH)	C[6](N[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C)(CC[6]HH){1|C<3>,1|C<4>}	119.4235	0.756	4	119.4235	0.572	4	118.7564	2.654	5	118.7564	2.654	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]CH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]CH)(C[6]N[6]C)(H){1|C<2>,1|C<3>}	117.4760	0.000	1	117.4760	0.000	1	117.4760	0.000	1	117.4760	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	P[6,6]-4:C[6]-3:C-4:	C[6](N[6]P[6,6]C)(N[6]P[6,6])(CH3)	C(C[6]N[6]2)(H)3	N[6](P[6,6]C[6,6a]S[6,6]S)(C[6]N[6]C)(CH3)	C[6](N[6]P[6,6]C)(N[6]P[6,6])(CH3){1|S<2>,2|C<3>,2|S<1>}	C(C[6]N[6]2)(H)3	N[6](P[6,6]C[6,6a]S[6,6]S)(C[6]N[6]C)(CH3){1|P<4>,2|C<3>}	117.5850	0.000	1	117.5850	0.000	1	117.5850	0.000	1	117.5850	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:2:1:1:	3:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:S-2:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(N[6]S[6])(CHHS)	C(C[6]N[6]2)(SC)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(N[6]S[6])(CHHS){2|C<3>,2|O<1>}	C(C[6]N[6]2)(SC)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|S<4>,2|C<3>}	117.0410	0.571	2	117.0410	0.326	2	117.0410	0.326	2	117.0410	0.326	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:Cl-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CClNN)	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CClNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)(H){1|C<4>,1|N<3>}	115.8870	0.000	1	115.8870	0.000	1	115.8870	0.000	1	115.8870	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:2:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:Cl-1:	C[6]-4:C[6]-3:N-2:	C[6](N[6]C[6]N)(N[6]C[6])(CClNN)	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NO)	C[6](N[6]C[6]N)(N[6]C[6])(CClNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NO){1|C<4>,1|N<3>}	116.3840	0.000	1	116.3840	0.000	1	116.3840	0.000	1	116.3840	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6](N[6]C[6]N)(N[6]C[6])(CHNN)	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NOO)	C[6](N[6]C[6]N)(N[6]C[6])(CHNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NOO){1|C<4>,1|N<3>}	117.0300	0.000	1	117.0300	0.000	1	117.0300	0.000	1	117.0300	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:3:	4:3:1:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:N-3:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)(N[6]C[6])(CN3)	C(C[6]N[6]2)(NOO)3	N[6](C[6]N[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)(N[6]C[6])(CN3){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)3	N[6](C[6]N[6]HH)(C[6]N[6]C)(H){1|C<4>,1|N<3>}	117.5005	0.422	2	117.5005	0.178	2	117.5005	0.178	2	117.5005	0.178	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:3:	4:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:N-3:	C[6]-4:C[6]-3:N-3:	C[6](N[6]C[6]N)(N[6]C[6])(CN3)	C(C[6]N[6]2)(NOO)3	N[6](C[6]C[6]HH)(C[6]N[6]C)(NOO)	C[6](N[6]C[6]N)(N[6]C[6])(CN3){1|C<4>,4|H<1>}	C(C[6]N[6]2)(NOO)3	N[6](C[6]C[6]HH)(C[6]N[6]C)(NOO){1|C<4>,2|H<1>}	122.0925	1.303	2	122.0925	1.698	2	122.0925	1.698	2	122.0925	1.698	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:4:1:	4:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:P-3:C-4:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6])(CCHP)	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6])(CCHP){1|C<4>,4|H<1>}	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,2|H<1>}	117.0530	0.000	1	117.0530	0.000	1	117.0530	0.000	1	117.0530	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:2:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:N[6]-2:C-3:	C[6](N[6]N[6]C)(N[6]N[6])(CCHH)	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(N[6]C[6])(CNO)	C[6](N[6]N[6]C)(N[6]N[6])(CCHH){2|C<3>}	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(N[6]C[6])(CNO){1|C<4>,1|N<3>}	121.5225	0.514	2	121.5225	0.264	2	121.5225	0.264	2	121.5225	0.264	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6])(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6])(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,2|H<1>}	119.0774	1.648	5	119.0774	2.716	5	119.0774	2.716	5	119.0774	2.716	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:2:1:	4:3:4:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:As-2:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6])(CAsCH)	C(C[6]N[6]2)(CCHH)(AsN)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6])(CAsCH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(AsN)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,2|H<1>}	125.7690	0.000	1	125.7690	0.000	1	125.7690	0.000	1	125.7690	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	4:3:1:1:	4:3:2:	N[6]-3:C[6]-2:C-4:	B[5]-4:C[6]-3:H-1:H-1:	B[5]-4:C[6]-3:C[6]-2:	C[6](N[6]B[5]C[6])(C[6]C[6])(CB[5]HH)	C(B[5]C[5,6a]C[5,6]N[6])(C[6]C[6]N[6])(H)2	N[6](B[5]C[5,6a]2C)(C[6]C[6]C)(C[6]C[6])	C[6](N[6]B[5]C[6])(C[6]C[6])(CB[5]HH){1|C<2>,1|C<4>,2|C<3>}	C(B[5]C[5,6a]C[5,6]N[6])(C[6]C[6]N[6])(H)2	N[6](B[5]C[5,6a]2C)(C[6]C[6]C)(C[6]C[6]){1|C<2>,4|C<3>}	121.3770	0.000	1	121.3770	0.000	1	121.3770	0.000	1	121.3770	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:2:1:	C[5a,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:H-1:	C[6](C[5a,6]C[5a,6]C[5a])(N[6]N[6]H)(CH3)	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(N[6]C[6])(H)	C[6](C[5a,6]C[5a,6]C[5a])(N[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(N[6]C[6])(H){1|C<4>,2|C<3>}	118.1440	0.000	1	118.1440	0.000	1	118.1440	0.000	1	118.1440	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[5a,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[5a,6]C[5a,6]O[5a])(N[6]C[6]O)(CH3)	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O)	C[6](C[5a,6]C[5a,6]O[5a])(N[6]C[6]O)(CH3){1|C<4>,3|C<3>}	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O){1|C<3>,1|O<2>,1|P<4>}	120.0320	0.000	1	120.0320	0.000	1	119.2025	1.376	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[5a,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[5a,6]N[5a,6]C[5a])(N[6]C[6]O)(CH3)	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O)	C[6](C[5a,6]N[5a,6]C[5a])(N[6]C[6]O)(CH3){1|C<4>,1|H<1>,3|C<3>}	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O){1|C<3>,1|H<1>,1|N<3>}	118.3730	0.000	1	118.3730	0.000	1	119.2025	1.376	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6,6]C[6,6]O[6])(N[6]C[6]H)(CH3)	C(C[6]C[6,6]N[6])(H)3	N[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]O[6])(N[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6,6]N[6])(H)3	N[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	119.5680	0.000	1	119.5680	0.000	1	119.5680	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3){1|C<4>,1|H<1>,3|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O){1|C<4>,2|C<3>}	115.4285	0.252	4	115.5302	0.099	5	115.4993	0.085	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3){1|H<1>,4|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O){1|C<4>,2|C<3>}	115.9370	0.000	1	115.5302	0.099	5	115.4993	0.085	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6,6a]C)(O)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3){1|H<1>,4|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6,6a]C)(O){1|C<4>,4|C<3>}	115.3450	0.000	1	115.3450	0.000	1	115.4993	0.085	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	116.9915	0.169	2	116.9915	0.029	2	116.9915	0.029	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CClHH)	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CClHH){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	112.2650	0.000	1	112.2650	0.000	1	115.9020	6.130	4	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH)	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.6870	0.000	1	117.6870	0.000	1	115.9020	6.130	4	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH)	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	116.8280	0.511	2	116.8280	0.261	2	115.9020	6.130	4	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CF3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	114.5530	0.351	3	114.5530	0.123	3	114.5530	0.123	3	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CFHH)	C(C[6]C[6]N[6])(F)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CFHH){1|N<2>,2|C<3>,2|N<3>}	C(C[6]C[6]N[6])(F)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H){2|C<3>}	114.2710	1.122	3	114.2710	1.258	3	114.2710	1.258	3	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:D-1:	C[6](C[6]C[6]H)(N[6]C[6]D)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(D)	C[6](C[6]C[6]H)(N[6]C[6]D)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(D){1|C<3>,2|H<1>}	117.8660	0.000	1	117.8660	0.000	1	117.8660	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[5,6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[5,6]C)(N[6]C[6]H)(CH3){1|N<3>,1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	112.9700	0.000	1	112.9700	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[5,6]O)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]O)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	118.7120	0.000	1	118.7120	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6,6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6,6]S)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6,6]S)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	113.6830	0.000	1	113.6830	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Br)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]Br)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){2|Br<1>,1|C<3>}	116.2915	0.305	2	116.2915	0.093	2	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Br)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(N[6]C[6]H)(CH3){1|O<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	114.7370	0.000	1	114.7370	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	113.1630	0.000	1	113.1630	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.3714	0.561	13	117.3714	0.315	13	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<2>,1|C<3>,1|C<4>}	111.9000	0.000	1	111.9000	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<2>,1|C<4>,2|H<1>}	114.5248	0.530	6	113.9154	1.632	8	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	112.8300	0.000	1	113.9154	1.632	8	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	111.3440	0.000	1	113.9154	1.632	8	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|S<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<2>,2|C<3>}	114.2200	0.000	1	114.2200	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	112.6767	0.349	3	112.6767	0.122	3	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	113.0113	0.551	33	113.0308	0.343	37	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,2|C<3>}	113.4455	1.016	2	113.0308	0.343	37	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	112.9390	1.112	2	113.0308	0.343	37	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|C<4>}	113.5880	0.000	1	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|C<4>}	113.4560	0.000	1	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	112.9677	0.479	40	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<4>,2|C<3>}	113.3600	0.000	1	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|H<1>,2|C<4>}	113.0930	0.000	1	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	112.6530	0.317	2	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|N<3>,1|O<1>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	114.9539	0.483	7	113.2488	0.670	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<2>,1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	112.9750	0.465	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>}	116.3350	0.286	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){3|C<3>}	115.4883	0.407	3	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.1115	0.186	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<2>,1|C<3>,1|C<4>}	114.6555	2.061	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|N<3>}	112.6290	0.000	1	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|P<4>}	113.5160	0.343	3	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<2>}	115.3236	0.226	7	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.2593	0.622	174	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){3|C<3>}	117.2840	0.062	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	114.1930	0.122	2	113.4557	0.840	200	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<4>,4|C<3>}	113.8160	0.000	1	113.8160	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]Cl)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cl<1>,1|C<3>}	117.1275	1.088	2	117.1275	1.184	2	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]C[6])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	118.2850	0.000	1	118.2850	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.0530	0.000	1	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.0374	0.740	15	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	118.8487	0.209	3	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.3417	0.624	7	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.0064	0.623	26	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	117.6350	0.000	1	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.0260	0.000	1	118.0811	0.444	54	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	116.8690	1.523	2	116.4928	1.031	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	116.9133	0.944	3	116.4928	1.031	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	116.4508	1.017	48	116.4928	1.031	53	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	117.1165	1.682	2	115.5420	4.266	4	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|O<1>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|H<1>,3|C<4>}	113.8050	0.000	1	115.5420	4.266	4	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|O<1>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<2>,1|C<4>,2|H<1>}	114.1300	0.000	1	115.5420	4.266	4	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,2|H<1>}	117.8770	0.000	1	117.8770	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,2|H<1>}	117.0015	0.416	2	117.0015	0.173	2	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[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){1|C<4>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	116.0413	0.047	3	116.0413	0.002	3	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	116.8836	0.632	33	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,2|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	117.4075	0.471	15	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	116.6707	0.585	3	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	117.3210	0.000	1	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<2>,1|N<3>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	116.5363	0.201	6	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|O<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	115.3524	0.573	5	116.8506	0.563	63	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	117.1417	0.742	7	117.1233	0.544	10	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|H<1>,2|C<3>}	117.0803	0.890	3	117.1233	0.544	10	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	116.0480	0.000	1	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	117.1750	0.000	1	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	116.9484	0.982	5	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	117.1846	0.441	5	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<2>,1|O<2>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	116.6960	0.000	1	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<3>,1|O<1>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	116.5353	0.442	6	116.8314	0.421	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|B<3>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.6595	0.012	2	117.7008	0.729	95	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>}	117.2360	0.165	2	117.7008	0.729	95	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	118.1053	0.515	9	117.7008	0.729	95	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.4971	0.562	58	117.7008	0.729	95	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	118.0838	1.327	24	117.7008	0.729	95	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Ir<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Ir)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	117.0010	0.000	1	117.0010	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	116.4830	0.000	1	116.4830	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Os<7>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Os)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	116.0540	0.000	1	117.1900	2.581	2	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Os<8>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]Os)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	118.3260	0.000	1	117.1900	2.581	2	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	118.9710	1.088	2	118.2293	0.466	9	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	118.0174	0.434	7	118.2293	0.466	9	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]Se)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Se<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]Se)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	116.7180	0.000	1	116.7180	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]N)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]N)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|N<3>}	113.9340	0.000	1	113.9340	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]O)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	118.8899	0.940	10	119.2917	0.665	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]O)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	119.7381	0.275	9	119.2917	0.665	19	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]P[6])(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]P[6])(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,2|C<3>,2|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|P<4>}	112.8720	0.201	3	112.8720	0.041	3	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	120.1550	0.000	1	119.5948	0.312	9	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	118.8340	0.310	2	119.5948	0.312	9	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<2>,2|C<4>}	119.7550	0.394	6	119.5948	0.312	9	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|N<3>,2|C<4>}	119.2279	0.910	24	119.0437	0.748	32	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|N<2>,2|C<4>}	118.4911	0.357	8	119.0437	0.748	32	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	119.7420	0.000	1	122.4090	7.078	3	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	123.7425	1.867	2	122.4090	7.078	3	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]S[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]S[6]H)(N[6]C[6]H)(CH3){2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|S<4>,2|H<1>}	115.6950	0.000	1	115.6950	0.000	1	115.7535	5.695	713	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[5a,6]P)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O)	C[6](C[6]C[5a,6]P)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O){1|C<3>,1|O<2>,1|P<4>}	113.2820	0.000	1	113.2820	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6a]H)(C[6]C[6]C)(O)	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6a]H)(C[6]C[6]C)(O){1|H<1>,2|C<3>}	116.9690	0.000	1	116.9690	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]2)(C[6]C[6]C)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]2)(C[6]C[6]C)(O){1|C<3>,2|C<4>,3|H<1>}	116.0843	0.273	3	116.0018	0.077	4	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]2)(C[6]C[6]C)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]2)(C[6]C[6]C)(O){1|N<3>,2|C<3>,2|H<1>}	115.7540	0.000	1	116.0018	0.077	4	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.1530	0.000	1	117.2711	0.418	14	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|Br<1>,1|C<3>,1|H<1>}	117.0620	0.000	1	117.2711	0.418	14	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	117.3817	0.603	12	117.2711	0.418	14	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	117.2590	0.000	1	117.2590	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	116.8580	0.765	3	116.8580	0.585	3	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]O)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]O)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	118.2130	0.000	1	118.2130	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[5a,6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O)	C[6](C[6]N[5a,6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]C)(O){1|C<3>,1|H<1>,1|N<3>}	115.9140	0.000	1	115.9140	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|N<3>,2|C<4>}	116.9530	0.000	1	116.9030	0.005	2	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>}	116.8530	0.000	1	116.9030	0.005	2	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O){1|C<4>,1|H<1>,1|N<3>}	117.4040	0.000	1	116.1479	0.466	32	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O){1|N<3>,2|C<4>}	116.0274	0.661	27	116.1479	0.466	32	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O){1|N<2>,2|C<4>}	116.6475	0.194	4	116.1479	0.466	32	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>}	118.6957	0.378	6	118.3819	0.312	11	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|N<3>,2|H<1>}	117.7840	0.203	4	118.3819	0.312	11	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>}	118.8910	0.000	1	118.3819	0.312	11	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(O){1|C<4>,1|H<1>,1|N<3>}	118.2850	0.000	1	118.2850	0.000	1	116.7922	1.251	72	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[5,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a]H)(CH3)	C(C[6]N[5,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a]H)(CH3){1|S<2>,4|C<3>}	C(C[6]N[5,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	120.3030	0.000	1	120.3030	0.000	1	120.3030	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CBrHH){2|C<3>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	117.1090	0.000	1	117.1090	0.000	1	117.1090	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O)	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	116.2125	0.306	2	116.4727	0.537	6	116.4727	0.537	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O)	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH){2|C<3>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	116.6028	0.892	4	116.4727	0.537	6	116.4727	0.537	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CClHH)	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CClHH){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(Cl)(H)2	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<4>,1|N<2>,2|C<3>}	112.9380	0.000	1	112.9380	0.000	1	112.9380	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CF3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(F)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|N<2>}	111.9390	0.000	1	111.9390	0.000	1	111.9390	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	111.8930	0.000	1	112.0650	0.059	2	113.0127	7.050	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3){1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<4>,1|N<2>,1|N<3>,2|C<3>}	112.2370	0.000	1	112.0650	0.059	2	113.0127	7.050	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3){1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H){1|C<4>,4|C<3>}	112.3690	0.000	1	112.3690	0.000	1	113.0127	7.050	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	109.3420	0.000	1	109.3420	0.000	1	113.0127	7.050	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6](N[6]C[5,6]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(CH3){1|O<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	116.1175	0.474	2	116.1175	0.225	2	113.0127	7.050	6	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]C[5a,6]S[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|H<1>,1|S<2>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]C[5a,6]S[5a])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	111.9610	0.000	1	111.9610	0.000	1	112.4913	0.323	7	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|N<2>}	112.9590	0.635	2	112.5797	0.321	6	112.4913	0.323	7	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<4>,1|N<2>,2|C<3>}	111.6990	0.000	1	112.5797	0.321	6	112.4913	0.323	7	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>}	112.7840	0.000	1	112.5797	0.321	6	112.4913	0.323	7	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	112.5385	0.309	2	112.5797	0.321	6	112.4913	0.323	7	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]C)(O)	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]C)(O){1|H<1>,1|O<2>,2|C<3>}	115.9670	0.000	1	115.9670	0.000	1	115.9670	0.000	1	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|S<2>,2|C<3>,2|H<1>}	113.6800	0.000	1	113.1756	0.283	18	113.5531	1.654	22	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	113.1459	0.532	17	113.1756	0.283	18	113.5531	1.654	22	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3){1|H<1>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]C)(H){2|C<4>,3|C<3>}	113.2830	0.390	2	113.2830	0.152	2	113.5531	1.654	22	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<5>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|Y<14>,1|H<1>,1|O<3>,3|C<3>}	117.5150	0.000	1	117.2205	0.173	2	113.5531	1.654	22	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<5>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|Yb<14>,1|H<1>,1|O<3>,3|C<3>}	116.9260	0.000	1	117.2205	0.173	2	113.5531	1.654	22	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,4|C<3>}	118.3680	0.000	1	118.2740	0.121	4	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3){3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,4|C<3>}	118.2427	0.419	3	118.2740	0.121	4	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	112.6610	0.000	1	112.6610	0.000	1	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	117.7130	0.179	6	118.4459	0.683	32	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<3>}	118.8780	0.566	21	118.4459	0.683	32	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	118.4405	0.149	2	118.4459	0.683	32	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	116.8900	0.304	3	118.4459	0.683	32	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	118.4120	0.460	2	118.4373	0.108	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	118.4880	0.000	1	118.4373	0.108	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,3|C<3>}	118.6784	0.405	11	118.6784	0.164	11	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	118.5060	0.000	1	118.7660	0.064	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	118.8960	0.164	2	118.7660	0.064	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]S[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]S[6]C)(CH3){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|S<3>,3|C<3>}	113.8665	0.221	2	113.3857	0.718	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]S[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]S[6]C)(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|S<2>,3|C<3>}	112.4240	0.000	1	113.3857	0.718	3	118.1273	2.330	57	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(CH3){3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O){2|H<1>,3|C<3>}	117.1160	0.000	1	117.1160	0.000	1	116.8595	0.132	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O)	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CH3){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	116.6030	0.000	1	116.6030	0.000	1	116.8595	0.132	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]B[5a,6]H)(N[6]C[6,6a]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]B[5a,6]H)(N[6]C[6,6a]H)(CH3){2|C<3>,2|O<2>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|B<4>,2|C<3>,2|H<1>}	117.7740	0.000	1	117.7740	0.000	1	118.2637	1.179	3	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CH3){2|C<3>,2|O<2>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|B<4>,2|C<3>,2|H<1>}	117.5090	0.000	1	117.5090	0.000	1	118.2637	1.179	3	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(N[6]C[6]N)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(N[6]C[6]N)(CH3){1|O<1>,2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	119.5080	0.000	1	119.5080	0.000	1	118.2637	1.179	3	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	120.4850	0.000	1	120.4850	0.000	1	120.6030	0.028	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	120.7210	0.000	1	120.7210	0.000	1	120.6030	0.028	2	115.9192	5.620	917	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:N-2:	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(NW)	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(NW){1|C<3>,2|H<1>}	119.0215	0.740	4	119.0215	0.547	4	119.0215	0.547	4	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-2:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(OB)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(OB){1|C<3>,2|H<1>}	119.3325	0.078	2	119.3325	0.006	2	118.5920	0.666	5	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-2:	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn){1|C<4>,1|H<1>,1|N<3>}	117.3600	0.000	1	117.3600	0.000	1	118.5920	0.666	5	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-2:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn){1|C<4>,1|H<1>,1|N<3>}	118.3860	0.000	1	118.4675	0.013	2	118.5920	0.666	5	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-2:	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn){1|C<4>,1|H<1>,1|N<3>}	118.5490	0.000	1	118.4675	0.013	2	118.5920	0.666	5	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:Ga[6]-2:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ga[6]N[6])	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ga[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	119.4650	0.231	2	119.4650	0.053	2	119.4650	0.053	2	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:Ge[6]-2:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6])	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	118.9573	0.489	3	118.2225	2.319	4	118.2225	2.319	4	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:Ge[6]-2:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6])	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	116.0180	0.000	1	118.2225	2.319	4	118.2225	2.319	4	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:In[6]-2:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(In[6]N[6])	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(In[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	119.2998	0.294	4	119.2998	0.086	4	119.2998	0.086	4	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6])	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|H<1>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6]){1|C<4>,3|C<3>,3|H<1>}	116.2410	0.000	1	116.2410	0.000	1	116.2410	0.000	1	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:Si[6]-2:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Si[6]N[6])	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Si[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	119.8870	0.000	1	119.8870	0.000	1	119.8870	0.000	1	118.7711	1.146	21	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[5,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6a]C[6])(CH3)	C(C[6]C[5,6]N[6])(H)3	N[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]O)	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6a]C[6])(CH3){1|C<4>,1|O<1>,5|C<3>}	C(C[6]C[5,6]N[6])(H)3	N[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]O){1|H<1>,1|N<3>,3|C<3>,3|C<4>}	117.1190	0.000	1	117.1190	0.000	1	117.1190	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]C[6])(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]C[6])(CH3){2|H<1>,5|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	120.2730	0.000	1	120.2730	0.000	1	120.2730	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]O)(COO)	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>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]O)(COO){2|C<4>,2|H<1>}	116.9660	0.000	1	116.9660	0.000	1	116.9660	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:B-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(BCl2)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(BCl2){1|C<3>,2|H<1>}	117.8390	0.006	2	117.8390	0.000	2	117.8390	0.000	2	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCC)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCC){1|C<3>,2|H<1>}	119.7325	0.192	2	119.7325	0.037	2	118.9054	2.367	8	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCO)	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCO){1|C<4>,1|H<1>,1|N<3>}	117.6128	0.869	4	117.6128	0.755	4	118.9054	2.367	8	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCO)	C[6](C[6]N[6]H)(N[6]C[6]C)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCO){1|C<4>,1|H<1>,1|N<3>}	120.6635	0.177	2	120.6635	0.032	2	118.9054	2.367	8	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:N-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]S)	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]S){1|C<3>,2|H<1>}	119.1590	0.000	1	119.1590	0.000	1	119.1590	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn2)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(OMn2){1|C<3>,2|H<1>}	118.4500	0.000	1	118.4500	0.000	1	118.4500	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-3:C[6]-3:C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6]2)(C[6]C[6]C)2	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6]2)(C[6]C[6]C)2{3|C<3>,4|H<1>}	118.5520	0.000	1	118.5520	0.000	1	118.5520	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	121.0007	0.408	3	121.0007	0.166	3	121.0007	0.166	3	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6a]O[6a]2)(C[6]C[6]C)2	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[6a]O[6a]2)(C[6]C[6]C)2{1|B<3>,1|B<4>,1|C<3>,2|H<1>}	117.3425	0.174	4	117.3425	0.030	4	117.3425	0.030	4	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:B[6]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]O)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]O)(C[6]C[6]C){1|H<1>,2|F<1>,4|C<3>}	120.1540	0.737	2	120.1540	0.543	2	120.1540	0.543	2	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3){2|H<1>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	115.9430	0.000	1	115.9430	0.000	1	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]O)	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]O){2|C<4>,2|H<1>,4|C<3>}	114.1755	0.121	2	114.1755	0.015	2	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,1|N<3>,1|S<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|Cl<1>,1|C<4>,2|H<1>,3|C<3>}	114.9360	0.000	1	114.9360	0.000	1	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)2	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)2{1|C<4>,2|H<1>,4|C<3>}	116.0195	0.279	2	116.0195	0.078	2	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]C)(C[6]N[6]S){2|H<1>,4|C<3>}	118.8470	0.000	1	118.8470	0.000	1	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|H<1>}	C(C[6]C[6]N[6])(H)3	N[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>}	121.7390	0.000	1	121.7390	0.000	1	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]O)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]O){3|C<3>,4|H<1>}	118.8767	0.903	3	118.8767	0.815	3	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|Br<1>,1|C<4>,2|C<3>,3|H<1>}	116.4130	0.000	1	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|C<4>,1|F<1>,2|C<3>,3|H<1>}	117.9150	0.000	1	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	116.2580	0.000	1	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|C<4>,2|C<3>,4|H<1>}	116.8019	0.369	9	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){1|Cl<1>,1|C<4>,2|C<3>,3|H<1>}	117.4260	0.567	4	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){2|C<3>,2|C<4>,3|H<1>}	116.4650	0.000	1	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]S){2|Cl<1>,1|C<4>,2|C<3>,2|H<1>}	116.4850	0.000	1	116.9143	0.311	18	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]N[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]O)	C[6](N[6]C[6a]C[6])(C[6]N[6]H)(CH3){1|C<4>,1|O<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]O){1|N<3>,2|C<3>,2|H<1>,3|C<4>}	117.6760	0.000	1	117.6760	0.000	1	117.0206	2.320	30	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Al)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Al)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.1380	0.154	2	120.1380	0.024	2	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]B)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]B)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.7527	0.914	4	120.7527	0.836	4	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Co)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Co)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4843	0.249	4	119.4843	0.062	4	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ga)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ga)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.9925	0.127	2	119.9925	0.016	2	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ni)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ni)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.7730	0.371	2	119.7417	0.627	8	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ni)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ni)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0647	0.592	6	119.7417	0.627	8	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Rh)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Rh)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.6690	0.334	2	119.6690	0.111	2	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]W)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]W)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5035	0.947	2	119.5035	0.896	2	119.8953	0.543	24	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4740	0.000	1	119.4755	0.244	13	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]C)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4757	0.516	12	119.4755	0.244	13	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.3353	0.764	4	119.3353	0.583	4	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]H)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.3245	0.053	2	119.3245	0.003	2	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.6056	0.370	5	119.7870	0.256	15	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]N)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8777	0.557	10	119.7870	0.256	15	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7496	0.715	19	119.7496	0.511	19	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4055	0.136	2	120.2237	0.761	12	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]P)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.3874	0.866	10	120.2237	0.761	12	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.3227	0.370	6	120.3227	0.137	6	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Te)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]Te)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7245	0.005	2	119.7245	0.000	2	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]O[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,3|C<3>}	119.4120	0.000	1	119.4120	0.000	1	119.7933	0.455	74	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6](N[6]C[6a]P[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(P[6]N[6]Br)(C[6]C[6]C)	C[6](N[6]C[6a]P[6])(C[6]C[6]C)(CH3){1|Br<1>,1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(P[6]N[6]Br)(C[6]C[6]C){3|C<4>,4|C<3>}	118.2225	1.101	2	118.2225	1.212	2	118.0403	0.706	3	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6](N[6]C[6a]P[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(P[6]C[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(P[6]C[6]Cl)(C[6]C[6]C){2|C<4>,3|C<3>,3|H<1>}	117.6760	0.000	1	117.6760	0.000	1	118.0403	0.706	3	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Si[6]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Si[6]N[6]Ni)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Si[6]N[6]Ni)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.6180	0.782	2	119.6180	0.612	2	119.6180	0.612	2	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,2|H<1>,6|C<3>}	119.9180	1.329	2	119.9180	1.767	2	120.5090	1.270	4	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]Ge[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<3>,2|C<4>,5|C<3>}	121.1000	0.803	2	121.1000	0.645	2	120.5090	1.270	4	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:3:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:N-3:	C[6](N[6]C[6,6a]H)(N[6]C[6]N)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]O)(C[6]N[6]C)(NHH)	C[6](N[6]C[6,6a]H)(N[6]C[6]N)(CH3){1|O<1>,2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6,6a]O)(C[6]N[6]C)(NHH){1|H<1>,2|C<3>}	120.7240	0.000	1	120.7240	0.000	1	120.7240	0.000	1	119.1352	2.287	163	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[5,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6]C)(CH3)	C(C[6]C[5,6]N[6])(H)3	N[6](C[6]C[5,6]C)(C[6]C[6]O)(CC[6a]HH)	C[6](C[5,6]C[5,6a]N[5,6])(N[6]C[6]C)(CH3){1|C<4>,1|O<1>,3|C<3>}	C(C[6]C[5,6]N[6])(H)3	N[6](C[6]C[5,6]C)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	117.8570	0.000	1	117.8570	0.000	1	117.8570	0.000	1	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6,6a]C)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C)(CH3)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6,6a]C)(CH3){1|H<1>,4|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C)(CH3){1|H<1>,4|C<3>}	119.6200	0.000	1	119.6200	0.000	1	119.6200	0.000	1	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<4>,2|H<1>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|Mo<7>,1|C<4>,2|H<1>}	117.3440	0.000	1	117.3440	0.000	1	117.3440	0.000	1	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:B-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(BC[6a]3)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(BC[6a]3){1|C<3>,2|H<1>}	123.8220	1.242	6	123.8220	1.543	6	123.8220	1.543	6	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6,6a]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(CCHH)	C[6](C[6]C[6,6a]C)(N[6]C[6]C)(CH3){3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(CCHH){5|C<3>}	117.8950	0.000	1	117.8950	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH){1|C<3>,1|C<4>,1|H<1>}	113.6950	0.000	1	113.6950	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	118.1510	0.000	1	118.1510	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(CCHH)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(CCHH){1|C<3>,1|C<4>,1|H<1>}	115.1860	0.069	2	115.1860	0.005	2	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(CH3)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)(CH3){1|C<3>,1|C<4>,1|H<1>}	114.8755	0.931	2	114.8755	0.867	2	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CH3)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CH3){1|C<4>,4|C<3>}	115.4310	0.000	1	115.4310	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|N<2>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH){4|C<3>}	119.1105	0.170	2	119.1105	0.029	2	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	120.4315	0.013	2	119.9994	0.345	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	119.8266	0.622	5	119.9994	0.345	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[5]HH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	119.9680	0.000	1	119.9680	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|H<1>}	119.9718	1.168	6	120.0320	1.163	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH){1|H<1>,2|C<3>}	120.3930	0.000	1	120.0320	1.163	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	119.6730	0.349	2	119.1240	0.787	5	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	118.1985	0.380	2	119.1240	0.787	5	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	119.8770	0.000	1	119.1240	0.787	5	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]N)(CCHH){1|C<2>,1|C<3>,1|H<1>}	118.2380	0.000	1	118.2380	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH){1|C<3>,2|H<1>}	120.2743	0.246	15	119.6284	0.268	51	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH){1|C<3>,2|H<1>}	119.4329	0.410	10	119.6284	0.268	51	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CCHH){1|C<3>,2|H<1>}	119.3309	0.289	26	119.6284	0.268	51	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CC[6a]CH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CC[6a]CH){1|C<3>,2|H<1>}	120.6880	1.154	2	120.6880	1.332	2	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CC[6a]HH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CC[6a]HH){1|C<3>,2|H<1>}	119.1623	0.471	6	119.1623	0.221	6	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,2|H<1>}	120.1516	0.586	8	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,1|H<1>,1|O<2>}	119.0180	0.000	1	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,2|H<1>}	119.5175	0.298	4	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,2|H<1>}	119.2179	0.755	8	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,2|H<1>}	115.5200	0.836	2	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,1|H<1>,1|O<2>}	119.0823	0.249	3	119.2435	1.690	26	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CCHH){2|H<1>,3|C<3>}	119.5685	0.083	2	119.5017	0.017	3	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)(CCHH){2|H<1>,3|C<3>}	119.3680	0.000	1	119.5017	0.017	3	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|O<2>}	120.5320	0.529	3	120.5320	0.280	3	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH)	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH){1|C<3>,1|H<1>,1|O<2>}	119.6736	0.300	5	120.1797	1.036	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH)	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|S<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]HH){1|C<3>,1|H<1>,1|O<2>}	121.4450	1.171	2	120.1797	1.036	7	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	119.0590	0.000	1	119.3527	0.625	9	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]O)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	119.3894	0.837	8	119.3527	0.625	9	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>}	120.3780	0.000	1	120.3780	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|N<2>,2|C<4>}	119.8810	0.041	2	119.8810	0.002	2	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]S[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(CC[6a]HH)	C[6](C[6]S[6]H)(N[6]C[6]C)(CH3){1|C<4>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|S<2>,2|H<1>}	117.2180	0.000	1	117.2180	0.000	1	119.3534	1.703	142	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3){1|C<4>,1|O<1>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]OO){1|C<4>,3|H<1>}	117.9720	0.000	1	117.9720	0.000	1	117.9720	0.000	1	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6](N[6]C[6,6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(CH3)	C[6](N[6]C[6,6]C)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(CH3){1|O<2>,2|C<3>,2|H<1>}	119.4265	0.943	4	119.4265	0.888	4	119.4265	0.888	4	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CC[6a]HH)	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(CH3){1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CC[6a]HH){1|C<4>,1|H<1>,3|C<3>}	115.2360	0.000	1	115.2360	0.000	1	118.3150	7.120	3	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CH3)	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CH3){1|H<1>,4|C<3>}	119.9550	0.000	1	119.9550	0.000	1	118.3150	7.120	3	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CH3)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CH3){2|H<1>,3|C<3>}	119.7540	0.000	1	119.7540	0.000	1	118.3150	7.120	3	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:Ga-4:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(GaC3)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3){1|C<2>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(GaC3){1|C<3>,2|H<1>}	118.9480	0.201	2	118.9480	0.040	2	118.9480	0.040	2	119.4687	2.464	161	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:5:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:B-5:	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(BCuH3)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)(BCuH3){1|C<3>,2|H<1>}	118.8983	0.358	3	118.8983	0.128	3	118.8983	0.128	3	119.1472	0.333	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:5:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:B-5:	C[6](N[6]C[6,6]B)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(BRhH3)	C[6](N[6]C[6,6]B)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(BRhH3){1|H<1>,3|C<3>}	119.8940	0.000	1	119.8940	0.000	1	119.8940	0.000	1	119.1472	0.333	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:1:	C[5a,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-4:H-1:	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6]H)(CH3)	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]HH)(H)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	119.7145	0.333	2	119.7145	0.111	2	119.7145	0.111	2	118.2497	6.493	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:1:	C[6,6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-4:H-1:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6]H)(CH3)	C(C[6]C[6,6]N[6])(H)3	N[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>,1|S<4>,2|H<1>}	C(C[6]C[6,6]N[6])(H)3	N[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	115.3200	0.000	1	115.3200	0.000	1	115.3200	0.000	1	118.2497	6.493	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:B[6]-4:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C){1|O<2>,2|H<1>,4|C<3>}	119.9265	0.070	2	120.3367	0.507	3	120.2184	0.286	5	119.6202	2.376	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:B[6]-4:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|N<3>,2|F<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C){3|H<1>,4|C<3>}	121.1570	0.000	1	120.3367	0.507	3	120.2184	0.286	5	119.6202	2.376	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:B[6]-4:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]II)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(B[6]N[6]II)(C[6]C[6]C){1|H<1>,2|F<1>,4|C<3>}	120.0410	0.157	2	120.0410	0.025	2	120.2184	0.286	5	119.6202	2.376	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:S[6]-4:C[6]-3:	C[6](N[6]C[6a]S[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(S[6]C[6]OO)(C[6]C[6]C)	C[6](N[6]C[6a]S[6])(C[6]C[6]H)(CH3){1|C<4>,2|O<1>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(S[6]C[6]OO)(C[6]C[6]C){3|C<3>,4|H<1>}	116.6290	0.000	1	116.6290	0.000	1	116.6290	0.000	1	119.6202	2.376	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:4:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-4:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]CC)(CH3)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CH3){1|H<1>,2|C<3>,3|C<4>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]CC)(CH3){2|C<3>,2|H<1>}	121.2450	0.000	1	121.2450	0.000	1	121.2450	0.000	1	120.9520	0.172	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:4:4:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-4:C[6]-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]2)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]2H)(C[6]N[6]CH)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]2)(CH3){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6,6a]C)(C[6]C[6]2H)(C[6]N[6]CH){2|C<3>,2|C<4>,5|H<1>}	120.6590	0.000	1	120.6590	0.000	1	120.6590	0.000	1	120.9520	0.172	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:O-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(O)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3){1|N<3>,2|H<1>,3|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(O){1|C<4>,4|C<3>}	118.3210	0.000	1	118.5965	0.152	2	118.5965	0.152	2	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:O-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(O)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]O)(CH3){1|N<3>,2|H<1>,3|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(O){1|H<1>,4|C<3>}	118.8720	0.000	1	118.5965	0.152	2	118.5965	0.152	2	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6,6]-4:C[6]-3:H-1:	C[6](C[6]C[6,6]C)(N[6]C[6,6]H)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]C)(N[6]C[6,6]H)(CF3){2|H<1>,3|C<4>}	C(C[6]C[6]N[6])(F)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	112.0180	0.000	1	112.0180	0.000	1	112.0180	0.000	1	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:H-1:	C[6](C[6]C[6,6]H)(N[6]B[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6,6]C[6a]2)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(N[6]B[6]H)(CH3){1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6,6]C[6a]2)(C[6]C[6]C)(H){1|H<1>,6|C<3>}	118.6180	0.000	1	118.6180	0.000	1	119.3390	1.032	3	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]B[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6]C[6]C)(H)	C[6](C[6]N[6]C)(N[6]B[6]H)(CH3){1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6]C[6]C)(H){1|N<2>,6|C<3>}	119.6995	1.133	2	119.6995	1.285	2	119.3390	1.032	3	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CeO)(C[6]C[6]C)(H)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CeO)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	116.0800	0.000	1	116.1850	0.022	2	117.0750	1.100	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CeO)(C[6]C[6]C)(H)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CeO)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	116.2900	0.000	1	116.1850	0.022	2	117.0750	1.100	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6]C)(H)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6]H)(C[6]C[6]C)(H){2|H<1>,3|C<3>}	117.9650	0.332	2	117.9650	0.110	2	117.0750	1.100	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	S[6]-4:C[6]-3:H-1:	C[6](C[6]C[6a]C[6])(N[6]S[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(N[6]S[6]H)(CH3){1|C<4>,1|N<2>,2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)(H){2|C<3>}	114.3800	0.000	1	114.3800	0.000	1	114.3800	0.000	1	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H)	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	112.8150	0.000	1	113.3372	0.146	4	113.3372	0.146	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H)	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H){3|C<3>,3|C<4>}	113.2990	0.000	1	113.3372	0.146	4	113.3372	0.146	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H)	C[6](N[6]C[4,6]H)(C[6]C[6]C)(CH3){2|H<1>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	113.6175	0.083	2	113.3372	0.146	4	113.3372	0.146	4	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[5a,6]-4:C[6]-3:H-1:	C[6](N[6]B[5a,6]H)(N[6]C[6,6a]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](B[5a,6]C[6,6a]O[5a]2)(C[6]N[6]C)(H)	C[6](N[6]B[5a,6]H)(N[6]C[6,6a]H)(CH3){2|C<3>,2|O<2>}	C(C[6]N[6]2)(H)3	N[6](B[5a,6]C[6,6a]O[5a]2)(C[6]N[6]C)(H){1|H<1>,4|C<3>}	121.1520	0.000	1	121.1520	0.000	1	121.1520	0.000	1	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6,6a]-4:C[6]-3:H-1:	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](B[6,6a]C[6,6a]O[6a]2)(C[6]N[6]C)(H)	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CH3){2|C<3>,2|O<2>}	C(C[6]N[6]2)(H)3	N[6](B[6,6a]C[6,6a]O[6a]2)(C[6]N[6]C)(H){1|H<1>,4|C<3>}	121.5320	0.000	1	121.5320	0.000	1	121.5320	0.000	1	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]CH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CH3){1|C<3>,1|C<4>,3|H<1>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]CH)(C[6]N[6]C)(H){1|C<4>,3|H<1>}	118.9617	0.348	3	118.9617	0.121	3	119.1895	0.156	6	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CH3){1|C<3>,1|C<4>,3|H<1>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<4>,3|H<1>}	119.4173	0.339	3	119.4173	0.115	3	119.1895	0.156	6	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6,6]-4:C[6]-3:H-1:	C[6](N[6]Ga[6,6]C[6a])(N[6]Ga[6,6]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](Ga[6,6]N[6,6]N[6]C)(C[6]N[6]C)(H)	C[6](N[6]Ga[6,6]C[6a])(N[6]Ga[6,6]H)(CH3){2|C<3>,2|C<4>,3|N<3>}	C(C[6]N[6]2)(H)3	N[6](Ga[6,6]N[6,6]N[6]C)(C[6]N[6]C)(H){1|Ga<4>,4|C<3>}	117.1360	0.416	2	117.1360	0.173	2	117.1360	0.173	2	117.4140	7.337	25	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:S-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HO)(C[6]C[6]C)(SCO)	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>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HO)(C[6]C[6]C)(SCO){1|C<4>,3|H<1>}	115.8880	0.000	1	115.8880	0.000	1	115.8880	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(COO)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,3|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(COO){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	120.2535	0.248	2	120.2535	0.062	2	120.2535	0.062	2	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:F-1:F-1:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CFFH)	C(C[6]C[6]N[6])(F)2(H)	N[6](C[6]C[6a]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CFFH){1|H<1>,1|N<2>,4|C<3>}	C(C[6]C[6]N[6])(F)2(H)	N[6](C[6]C[6a]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C){3|H<1>,5|C<3>}	118.8820	0.000	1	118.8820	0.000	1	118.8820	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[5a,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[5a,6]N[5a,6]O[5a]F)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[5a,6]N[5a,6]O[5a]F)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,5|C<3>}	120.2370	0.000	1	120.2370	0.000	1	120.3603	0.021	3	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[5a,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[5a,6]N[5a,6]O[5a]O)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[5a,6]N[5a,6]O[5a]O)(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,2|H<1>,5|C<3>}	120.4220	0.136	2	120.4220	0.018	2	120.3603	0.021	3	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]C)(CH3){1|C<4>,1|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,9|C<3>}	119.9400	0.000	1	120.4575	0.536	2	120.1894	0.583	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]C)(CH3){1|C<4>,1|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|H<1>,9|C<3>}	120.9750	0.000	1	120.4575	0.536	2	120.1894	0.583	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|F<1>,4|C<3>}	119.4110	0.000	1	119.4110	0.000	1	120.1894	0.583	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|F<1>,4|C<3>}	119.5970	0.000	1	119.5970	0.000	1	120.1894	0.583	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]N)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]N)(CH3){1|C<4>,1|O<2>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,1|O<2>,7|C<3>}	121.0240	0.000	1	121.0240	0.000	1	120.1894	0.583	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[3]-4:C[6]-3:C[6]-3:	C[6](N[6]C[3]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[3]C[3]2H)(C[6]C[6]C)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>}	C(C[6]C[6]N[6])(H)3	N[6](C[3]C[3]2H)(C[6]C[6]C)2{1|C<3>,1|O<2>,5|H<1>}	119.8283	0.393	3	119.8283	0.154	3	119.8283	0.154	3	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5]C[5]O[5]H)(C[6]C[6]C)(C[6]C[6]H)	C[6](N[6]C[5]C[6])(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<2>,1|S<1>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[5]C[5]O[5]H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	120.6100	0.000	1	120.6100	0.000	1	120.6100	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,4|H<1>,5|C<3>}	118.0280	0.000	1	118.0280	0.000	1	119.1770	2.640	2	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C){1|Cr<6>,1|H<1>,1|N<3>,2|C<4>,4|C<3>}	120.3260	0.000	1	120.3260	0.000	1	119.1770	2.640	2	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga-4:C[6]-3:C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](GaC[6a]Cl2)(C[6]C[6]C)(C[6]C[6]H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](GaC[6a]Cl2)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,2|H<1>}	118.5140	0.000	1	118.5140	0.000	1	118.5140	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[4,4,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[4,4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,4,6]P[4x4]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,4,6]P[4x4]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|P<3>,4|C<3>}	119.9417	0.748	8	119.9417	0.560	8	119.9417	0.560	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[4,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,6]As[4]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,6]As[4]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|As<3>,1|H<1>,2|C<4>,4|C<3>}	120.1730	0.614	2	120.1730	0.377	2	120.4560	0.251	4	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[4,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,6]N[6]S[4]2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[4,6]N[6]S[4]2)(C[6a]C[6a]2)(C[6]C[6]C){1|Ga<4>,1|H<1>,2|C<4>,4|C<3>}	120.7390	0.235	2	120.7390	0.055	2	120.4560	0.251	4	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[5,5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[5,5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,5,6]P[3,5,5]P[3x5,6]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,5,6]P[3,5,5]P[3x5,6]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>,4|P<3>}	120.4802	0.122	4	120.4802	0.015	4	120.5135	0.371	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[5,5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[5,5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,5,6]P[3,5,5]P[3x5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,5,6]P[3,5,5]P[3x5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>,4|P<3>}	120.5468	0.921	4	120.5468	0.848	4	120.5135	0.371	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[5]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[5]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|Si<4>,1|H<1>,2|C<4>,2|N<2>,4|C<3>}	120.1280	0.779	2	120.1280	0.607	2	120.1579	0.205	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[6]P[5]2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[6]P[5]2)(C[6a]C[6a]2)(C[6]C[6]C){1|Co<6>,1|H<1>,2|C<4>,3|P<3>,4|C<3>}	120.1107	0.407	4	120.1678	0.165	6	120.1579	0.205	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[6]P[5]2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[5,6]N[6]P[5]2)(C[6a]C[6a]2)(C[6]C[6]C){1|Co<6>,1|H<1>,2|C<4>,2|P<3>,4|C<3>}	120.2820	0.537	2	120.1678	0.165	6	120.1579	0.205	8	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]As[4]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]As[4]C[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|As<2>,1|H<1>,3|C<4>,6|C<3>}	120.8275	0.059	2	120.8275	0.003	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]C[6a]N[6]C)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]C[6a]N[6]C)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.0190	1.237	2	120.0190	1.531	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]2P)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]2P)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	119.8910	0.240	2	119.8910	0.058	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]BiC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]BiC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.4360	0.037	2	120.4360	0.001	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]CC)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]CC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7054	0.908	8	119.7054	0.824	8	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.2860	0.966	2	119.2860	0.933	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.5545	0.612	2	120.5545	0.374	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClCo)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClCo)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.2770	0.062	2	120.2770	0.004	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.9395	0.674	2	118.9395	0.454	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClRh)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClRh)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5215	0.764	2	119.5215	0.584	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSb)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSb)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5743	0.444	6	119.5743	0.197	6	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSi)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSi)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5500	0.000	1	119.5500	0.000	1	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSn)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ClSn)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.8582	0.580	4	118.8582	0.337	4	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]HO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]HO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.6063	0.602	6	119.6063	0.363	6	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0300	0.629	2	120.0300	0.396	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]InC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]InC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8503	0.968	4	120.0605	0.731	6	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]InC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]InC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.4810	0.563	2	120.0605	0.731	6	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0360	0.822	2	120.0360	0.675	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]NO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]NO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8590	0.038	2	119.8590	0.001	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4125	0.596	2	119.4125	0.355	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]OO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]OO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.0280	0.390	2	119.0280	0.152	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]P[6]I)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]P[6]I)(C[6a]C[6a]2)(C[6]C[6]C){1|Fe<11>,1|H<1>,4|C<3>,4|C<4>}	120.1485	0.248	2	120.1485	0.062	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]RhO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]RhO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8755	1.466	2	119.8755	2.149	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Te2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Te2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0085	1.087	2	120.5125	0.741	4	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Te2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]Te2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.0165	0.158	2	120.5125	0.741	4	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]TeC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]TeC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.5720	0.000	1	120.5720	0.000	1	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ZnC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]N[6]ZnC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.4982	0.586	4	120.4982	0.344	4	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]P[5,5]N[6]Cl)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]P[5,5]N[6]Cl)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|P<3>,4|C<3>}	119.8830	0.890	2	119.8830	0.791	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]P[5,5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]P[5,5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|P<3>,4|C<3>}	119.7580	0.236	2	119.7580	0.056	2	119.8454	0.572	76	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[4,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[4,6]N[6]P[4]2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[4,6]N[6]P[4]2)(C[6a]C[6a]2)(C[6]C[6]C){1|Ge<4>,1|H<1>,2|C<4>,4|C<3>}	121.3590	0.000	1	121.3590	0.000	1	121.3590	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,1|O<1>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]C[5]N[6]O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>}	115.6230	0.356	2	115.6230	0.127	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]AgC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]AgC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.3595	0.018	2	119.3595	0.000	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7610	0.275	4	119.7610	0.076	4	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.3675	1.309	4	119.3675	1.713	4	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClSe)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5030	0.638	2	119.5030	0.407	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClW)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClW)(C[6a]C[6a]2)(C[6]C[6]C){3|H<1>,4|C<3>}	119.4855	0.134	2	119.4855	0.018	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]FS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.9300	0.216	4	118.9300	0.047	4	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]FeO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]FeO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8255	1.473	2	119.8255	2.169	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]MnO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]MnO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4535	0.568	2	119.4535	0.322	2	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<2>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.7860	0.000	1	116.7860	0.000	1	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7450	0.601	4	119.7450	0.361	4	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]SeP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0443	0.906	6	120.0443	0.822	6	119.2790	1.570	35	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]In[6]N[6]Br)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]In[6]N[6]Br)(C[6a]C[6a]2)(C[6]C[6]C){1|Br<1>,1|H<1>,2|C<4>,2|N<3>,4|C<3>}	118.5730	0.228	2	118.5730	0.052	2	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]BiC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]BiC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.3285	0.351	2	119.3285	0.124	2	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]BrC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]BrC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7995	0.227	2	119.7995	0.052	2	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]CC)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]CC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.0900	1.126	2	120.0900	1.267	2	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]CI)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]CI)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.5460	0.000	1	119.5460	0.000	1	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]FeI)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]FeI)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.4572	0.439	6	119.4572	0.193	6	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.2885	0.846	2	119.2250	0.526	4	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]II)(C[6a]C[6a]2)(C[6]C[6]C){3|H<1>,4|C<3>}	119.1615	0.920	2	119.2250	0.526	4	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]SS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,3|C<3>,3|C<4>}	119.7640	1.006	2	119.7640	1.011	2	119.4428	0.404	21	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.6870	1.438	2	119.9754	0.717	7	119.9754	0.717	7	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.7982	0.442	4	119.9754	0.717	7	119.9754	0.717	7	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,3|C<3>,3|C<4>}	119.2610	0.000	1	119.9754	0.717	7	119.9754	0.717	7	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5,6]N[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5,6]N[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|N<3>,2|C<4>,2|H<1>,7|C<3>}	116.9970	0.000	1	116.9970	0.000	1	117.3692	0.440	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5,6a]N[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){2|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5,6a]N[5]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<3>,2|C<4>,7|C<3>}	117.5540	0.000	1	117.5540	0.000	1	117.3692	0.440	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]C[5]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,5|H<1>,6|C<3>}	118.2540	0.000	1	118.2540	0.000	1	117.3692	0.440	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5,6]N[6]O[5])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|O<2>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5,6]N[6]O[5])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,7|C<3>}	117.5500	0.000	1	117.5500	0.000	1	117.3692	0.440	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5]N[6]O[5])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|O<2>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5]N[6]O[5])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,2|C<4>,6|C<3>}	116.4910	0.000	1	116.4910	0.000	1	117.3692	0.440	5	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]C[6]2N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]C[6]2N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|N<3>,3|H<1>,4|C<4>,5|C<3>}	118.5950	0.000	1	118.5950	0.000	1	118.5950	0.000	1	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Br<1>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,2|H<1>,3|C<3>}	116.8880	0.293	2	116.8880	0.086	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]F)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|F<1>,1|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]F)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	116.1300	0.000	1	116.1300	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]H)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	116.3890	0.000	1	116.3890	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]N)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]C[6a]N[6]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,2|C<4>,5|C<3>}	117.1390	0.311	2	117.1390	0.097	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2O)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|O<1>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.2870	0.000	1	119.3110	1.905	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2O)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|O<2>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2O)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	118.3350	0.000	1	119.3110	1.905	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2P)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|P<3>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]2P)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	118.3010	0.000	1	118.3010	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Br<1>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]Br2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.0680	0.528	2	116.0680	0.278	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.5970	0.000	1	118.5970	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrN)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Br<1>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.7040	0.206	2	116.7040	0.043	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]CH)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]CH)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.0500	0.068	2	118.0500	0.005	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Cl<1>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.5430	0.000	1	116.5430	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClC)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClC)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	117.3240	0.000	1	117.3240	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClP)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.3500	0.000	1	116.3500	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClSi)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]ClSi)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	118.1020	0.000	1	118.1020	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,2|N<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.8580	0.175	2	119.8580	0.031	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]HO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]HO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.9723	0.150	3	116.9723	0.022	3	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){3|C<3>,3|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.9210	0.000	1	116.9210	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.4503	0.159	3	120.4503	0.025	3	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.1815	0.124	2	120.1815	0.015	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiS)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]NiS)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.1455	0.486	2	120.1455	0.236	2	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]PP)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|N<3>,2|P<3>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]PP)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	116.7520	0.000	1	116.7520	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SeO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SeO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.2155	0.274	2	120.4507	0.236	4	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SeO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SeO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.6860	0.641	2	120.4507	0.236	4	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SiO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]SiO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	117.5450	0.000	1	117.5450	0.000	1	118.2491	2.761	39	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:3:	N[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6,6]-4:C[6a]-3:C[6]-3:	C[6](N[6]Ga[6,6]C[6a])(N[6]Ga[6,6]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](Ga[6,6]N[6,6]N[6]C)(C[6a]C[6a]2)(C[6]N[6]C)	C[6](N[6]Ga[6,6]C[6a])(N[6]Ga[6,6]H)(CH3){2|C<3>,2|C<4>,3|N<3>}	C(C[6]N[6]2)(H)3	N[6](Ga[6,6]N[6,6]N[6]C)(C[6a]C[6a]2)(C[6]N[6]C){1|Ga<4>,2|C<4>,2|H<1>,4|C<3>}	121.2185	0.172	2	121.2185	0.030	2	121.2185	0.030	2	119.4577	1.606	234	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]B[6]C)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](B[6]C[6a]O[6]O)(C[6]C[6,6a]C)(CCHH)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]B[6]C)(CH3){1|H<1>,2|O<2>,3|C<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](B[6]C[6a]O[6]O)(C[6]C[6,6a]C)(CCHH){4|C<3>}	121.5128	0.273	4	121.5128	0.075	4	121.5128	0.075	4	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]CH)(C[6]C[6]C)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,2|C<4>,2|H<1>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]CH)(C[6]C[6]C)(CH3){1|Mo<7>,1|C<4>,2|H<1>}	118.0770	0.471	4	118.0770	0.222	4	118.2787	0.298	6	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<4>,3|H<1>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3){1|Mo<7>,1|C<4>,2|H<1>}	118.6820	0.581	2	118.6820	0.338	2	118.2787	0.298	6	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]FF)(C[6]C[6]C)(CCCH)	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3){1|C<4>,1|N<3>,2|F<1>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]FF)(C[6]C[6]C)(CCCH){1|C<3>,1|C<4>,1|H<1>}	120.7510	0.000	1	120.7510	0.000	1	121.0126	0.127	5	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]FF)(C[6]C[6]C)(CH3)	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3){1|C<4>,1|N<3>,2|F<1>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]N[6]FF)(C[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	120.6520	0.000	1	120.6520	0.000	1	121.0126	0.127	5	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6]C[6]C)(CH3)	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3){1|C<4>,1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6]C[6]C)(CH3){1|N<2>,5|C<3>}	121.3345	0.316	2	121.2200	0.089	3	121.0126	0.127	5	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6]C[6]C)(CH3)	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3){1|O<2>,3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](B[6]C[6a]2O[6])(C[6]C[6]C)(CH3){1|N<2>,5|C<3>}	120.9910	0.000	1	121.2200	0.089	3	121.0126	0.127	5	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3)	C[6](C[6]C[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,3|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,2|C<3>}	115.4557	0.425	3	115.4557	0.181	3	115.4557	0.181	3	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CH)(C[6]C[6]C)(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CH)(C[6]C[6]C)(SC[6a]OO){1|C<3>,1|C<4>,1|H<1>}	118.4210	0.000	1	118.4210	0.000	1	118.8180	0.315	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:S-4:	C[6](C[6]O[6]H)(N[6]C[6]S)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(SC[6a]OO)	C[6](C[6]O[6]H)(N[6]C[6]S)(CH3){1|C<4>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(SC[6a]OO){1|C<3>,1|O<2>,2|H<1>}	119.2150	0.000	1	119.2150	0.000	1	118.8180	0.315	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	S[6]-4:C[6]-3:C-4:	C[6](C[6]C[6a]C[6])(N[6]S[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)(CH3)	C[6](C[6]C[6a]C[6])(N[6]S[6]C)(CH3){1|C<4>,1|N<2>,2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)(CH3){2|C<3>}	115.4240	0.646	2	115.4240	0.418	2	115.4240	0.418	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6]-3:C-4:	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]O[6]Cl2)(C[6]C[6]C)(CCCH)	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3){2|Cl<1>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]O[6]Cl2)(C[6]C[6]C)(CCCH){1|C<3>,1|H<1>}	120.2250	0.000	1	120.2250	0.000	1	121.0085	1.228	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6]-4:C[6]-3:C-4:	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]O[6]NN)(C[6]C[6]C)(CCCH)	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6]O[6]NN)(C[6]C[6]C)(CCCH){1|C<3>,1|H<1>}	121.7920	0.000	1	121.7920	0.000	1	121.0085	1.228	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6]-3:C-4:	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClCu)(C[6]C[6]C)(CCCH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]ClCu)(C[6]C[6]C)(CCCH){1|C<3>,1|C<4>,1|H<1>}	121.2990	0.953	2	121.2990	0.909	2	120.8277	0.317	10	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6]-3:C-4:	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CuC)(C[6]C[6]C)(CCCH)	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3){1|Cu<3>,1|N<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CuC)(C[6]C[6]C)(CCCH){1|C<3>,1|C<4>,1|H<1>}	120.6030	0.468	6	120.6030	0.219	6	120.8277	0.317	10	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ge[6]-4:C[6]-3:C-4:	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CuH)(C[6]C[6]C)(CCCH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ge[6]N[6]CuH)(C[6]C[6]C)(CCCH){1|C<3>,1|C<4>,1|H<1>}	121.0305	0.131	2	121.0305	0.017	2	120.8277	0.317	10	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6]-3:C-4:	C[6](N[6]In[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]SS)(C[6]C[6]C)(CCHH)	C[6](N[6]In[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]N[6]SS)(C[6]C[6]C)(CCHH){1|H<1>,2|C<3>}	119.4225	0.479	2	119.4225	0.229	2	119.4225	0.229	2	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-4:C[6]-3:C-4:	C[6](N[6]Nb[6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6]C[6]C)(CC3)	C[6](N[6]Nb[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NN)(C[6]C[6]C)(CC3){1|H<1>,2|C<3>}	126.4100	0.000	1	126.4100	0.000	1	126.4100	0.000	1	119.7618	5.412	37	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[3,3,5,3x6]-5:C[6]-3:C[6]-3:	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[3,3,5,3x6]B[3x3,5,5,4x6]B[4x3,5,5,4x6]B[5x3,5,5,6]H)(C[6]C[6]C)(C[6]C[6]H)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[3,3,5,3x6]B[3x3,5,5,4x6]B[4x3,5,5,4x6]B[5x3,5,5,6]H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<2>,1|S<4>,3|B<6>,5|H<1>}	120.3940	0.000	1	120.3940	0.000	1	120.3940	0.000	1	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	B[3,3,5,4x6]-5:C[6]-3:C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](B[3,3,5,4x6]B[3x3,5,5,7x6]2B[5x3,5,5,4x6]Rh)(C[6]C[6]C)(C[6]C[6]H)	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>}	C(C[6]C[6]N[6])(H)3	N[6](B[3,3,5,4x6]B[3x3,5,5,7x6]2B[5x3,5,5,4x6]Rh)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,4|B<6>,5|H<1>}	120.4270	0.000	1	120.4270	0.000	1	120.4270	0.000	1	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[3,3,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Ga[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[3,3,6]Ga[3,3,6]N[6]O[3]2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[3,3,6]Ga[3,3,6]N[6]O[3]2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>}	120.5405	0.258	2	120.5405	0.067	2	120.5405	0.067	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,4|C<4>,5|C<3>}	120.6730	0.430	2	120.6730	0.185	2	120.6730	0.185	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[4,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[4,6]N[4,6]C[4]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[4,6]N[4,6]C[4]NN)(C[6a]C[6a]2)(C[6]C[6]C){3|C<3>,3|C<4>,3|H<1>}	119.0490	0.000	1	119.0035	0.004	2	119.0035	0.004	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[4,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[4,6]N[4,6]C[4]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[4,6]N[4,6]C[4]NN)(C[6a]C[6a]2)(C[6]C[6]C){3|C<3>,3|C<4>,3|H<1>}	118.9580	0.000	1	119.0035	0.004	2	119.0035	0.004	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Nb[6,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6,6]N[6,6]C[6]NO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6,6]N[6,6]C[6]NO)(C[6a]C[6a]2)(C[6]C[6]C){3|C<4>,3|H<1>,4|C<3>}	119.4320	1.775	2	119.4320	3.150	2	119.4320	3.150	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]C[6a]N[6]FN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]C[6a]N[6]FN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.5448	1.561	6	120.5448	2.436	6	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]C[6a]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]C[6a]N[6]NN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.3160	1.521	4	120.3160	2.312	4	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]2NO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]2NO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.6030	1.105	2	120.6030	1.220	2	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CCN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CCN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.1123	1.238	4	120.1123	1.532	4	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CNN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CNN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.0520	1.266	2	120.6320	0.484	6	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CNN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]CNN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.4220	0.310	4	120.6320	0.484	6	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]Cl2N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]Cl2N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.3450	0.150	2	120.3450	0.022	2	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]HNN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]HNN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.0735	1.172	2	121.0735	1.373	2	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NNO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NNO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.4774	0.762	5	121.4774	0.581	5	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NOO)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]NOO)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.2365	0.631	2	120.2365	0.399	2	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]O[5]2N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]O[5]2N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,4|C<3>,6|C<4>}	121.0340	0.939	2	121.0340	0.882	2	120.6499	1.136	35	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[3,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[3,6]C[5]N[6]O[3]2)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|O<2>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](Si[3,6]C[5]N[6]O[3]2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,2|N<3>,4|C<3>}	117.3610	0.000	1	117.3610	0.000	1	117.3610	0.000	1	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[5,6]-5:C[6a]-3:C[6]-3:	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5]N[6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[5,6]N[5]N[6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,2|C<4>,6|C<3>}	120.2580	1.370	2	120.2580	1.878	2	120.2580	1.878	2	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6]-5:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrLiN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6]N[6]BrLiN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.1930	0.000	1	119.1930	0.000	1	119.1930	0.000	1	120.4068	1.308	49	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6,6]-5:C[6]-3:C-4:	C[6](N[6]Ga[6,6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6,6]N[6]O[6]2Cl)(C[6]C[6]C)(CCCH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6,6]N[6]O[6]2Cl)(C[6]C[6]C)(CCCH){1|C<4>,1|H<1>,3|C<3>}	123.9920	0.000	1	123.9920	0.000	1	123.3445	0.839	2	123.3445	0.839	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	5:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[6,6]-5:C[6]-3:C-4:	C[6](N[6]Ga[6,6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[6,6]N[6]O[6]2Cl)(C[6]C[6]C)(CCHH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[6,6]N[6]O[6]2Cl)(C[6]C[6]C)(CCHH){1|C<4>,1|H<1>,3|C<3>}	122.6970	0.000	1	122.6970	0.000	1	123.3445	0.839	2	123.3445	0.839	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|O<1>,3|C<4>,4|C<3>}	120.0225	0.518	2	120.0630	0.509	10	120.1767	0.426	14	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|O<2>,3|C<4>,4|C<3>}	120.2668	0.514	4	120.0630	0.509	10	120.1767	0.426	14	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]C[3,3]N[3]N[6]O[3]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,3|C<4>,5|C<3>}	119.8795	1.036	4	120.0630	0.509	10	120.1767	0.426	14	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]Nb[3,3,6]N[6]S[3]2N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]Nb[3,3,6]N[6]S[3]2N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,2|C<4>,2|N<3>,4|C<3>}	120.5160	0.703	2	120.5160	0.494	2	120.1767	0.426	14	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]Nb[3,3]N[6]O[3]2N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6]Nb[3,3]N[6]O[3]2N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|N<2>,2|C<4>,2|N<3>,4|C<3>}	120.4060	0.011	2	120.4060	0.000	2	120.1767	0.426	14	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]B[3,5]N[3]N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]B[3,5]N[3]N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|O<2>,3|C<4>,4|C<3>}	121.4370	1.540	2	121.4370	2.372	2	120.8193	0.760	10	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]2N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]2N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.6425	0.149	2	120.7258	0.155	4	120.8193	0.760	10	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]2N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]2N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,3|C<4>,5|C<3>}	120.8090	0.643	2	120.7258	0.155	4	120.8193	0.760	10	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]CN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,4|C<3>,4|C<4>}	120.6040	1.003	4	120.6040	1.007	4	120.8193	0.760	10	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-6:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]2CCN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]2CCN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	121.0065	0.218	2	121.0065	0.048	2	120.9215	0.169	6	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-6:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]C3N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]C3N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.6745	0.548	2	120.6745	0.300	2	120.9215	0.169	6	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[6]-6:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]LiCCN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[6]N[6]LiCCN)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.0835	0.555	2	121.0835	0.308	2	120.9215	0.169	6	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6,6]-6:C[6a]-3:C[6]-3:	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6a]C[6a]2)(C[6]C[6]C){3|H<1>,6|C<3>}	121.4285	0.238	2	121.4285	0.057	2	121.4285	0.057	2	120.5954	0.589	32	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:4:	C[6,6a]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6,6]-6:C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]Si[6,6]C)(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](Si[6,6]C[6a]N[6]O[6]2O)(C[6]C[6,6a]C)(CH3)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]Si[6,6]C)(CH3){1|H<1>,1|N<3>,3|C<3>,3|O<2>}	C(C[6]C[6,6a]N[6])(H)3	N[6](Si[6,6]C[6a]N[6]O[6]2O)(C[6]C[6,6a]C)(CH3){1|C<4>,6|C<3>}	120.9120	0.783	2	120.9120	0.614	2	120.9120	0.614	2	122.0991	1.816	8	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Ga[3x6]-6:C[6]-3:C-4:	C[6](N[6]Ga[3x6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Ga[3x6]N[6]2O[6]3)(C[6]C[6]C)(CCHH)	C[6](N[6]Ga[3x6]C)(C[6]C[6]H)(CH3){1|C<4>,2|N<3>,3|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](Ga[3x6]N[6]2O[6]3)(C[6]C[6]C)(CCHH){1|H<1>,2|C<4>,5|C<3>}	121.8770	0.391	3	121.8770	0.153	3	121.8770	0.153	3	122.0991	1.816	8	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6,6]-6:C[6]-3:C-4:	C[6](N[6]Si[6,6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6]C[6]C)(CCCH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6]C[6]C)(CCCH){1|C<4>,1|H<1>,3|C<3>}	124.9780	0.000	1	124.9780	0.000	1	123.1127	2.872	3	122.0991	1.816	8	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	6:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Si[6,6]-6:C[6]-3:C-4:	C[6](N[6]Si[6,6]C)(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6]C[6]C)(CC[6a]HH)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Si[6,6]N[6]O[6]2NN)(C[6]C[6]C)(CC[6a]HH){1|C<4>,1|H<1>,3|C<3>}	122.1800	0.724	2	122.1800	0.524	2	123.1127	2.872	3	122.0991	1.816	8	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	7:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,3,6,6]-7:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,3,6,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6,6]C[3,3,6]N[6]O[3]2O[6]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,3,6,6]C[3,3,6]N[6]O[3]2O[6]N)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,1|O<2>,3|C<4>,4|C<3>}	120.9125	0.593	4	120.9125	0.352	4	120.9125	0.352	4	120.8844	0.865	10	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	7:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3,6]-7:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]F3)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3,6]C[3]N[3]N[6]F3)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,3|C<4>,5|C<3>}	121.0037	1.471	4	121.0037	2.163	4	121.0037	2.163	4	120.8844	0.865	10	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	7:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[3x3,5,6]-7:C[6a]-3:C[6]-3:	C[6](N[6]Nb[3x3,5,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[3x3,5,6]C[3,3,6]2C[3,5,6]2N[6]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[3x3,5,6]C[3,3,6]2C[3,5,6]2N[6]N)(C[6a]C[6a]2)(C[6]C[6]C){4|C<3>,4|C<4>,5|H<1>}	120.5895	0.084	2	120.5895	0.007	2	120.5895	0.007	2	120.8844	0.865	10	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	8:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[5x3,6]-8:C[6a]-3:C[6]-3:	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[5x3,6]C[3,3,5]5N[6]N)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[5x3,6]C[3,3,5]5N[6]N)(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,4|C<3>,6|H<1>}	120.1530	0.869	4	120.1530	0.756	4	120.1530	0.756	4	120.1530	0.756	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	9:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	Nb[5x3,6]-9:C[6a]-3:C[6]-3:	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](Nb[5x3,6]C[3,3,5]5N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(H)3	N[6](Nb[5x3,6]C[3,3,5]5N[6]HN)(C[6a]C[6a]2)(C[6]C[6]C){2|C<4>,4|C<3>,6|H<1>}	120.4488	0.400	4	120.4488	0.160	4	120.4488	0.160	4	120.4488	0.160	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CHHO){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	114.5725	0.182	2	114.5725	0.033	2	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|N<3>,1|O<1>,1|S<1>}	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	115.0063	0.767	3	115.0063	0.588	3	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	116.4093	0.075	4	116.4093	0.006	4	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.1840	0.604	2	118.1840	0.365	2	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]O)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(N[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	118.9940	0.000	1	118.9940	0.000	1	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]O)(N[6]C[6]H)(CHHO)	C(C[6]C[6]N[6])(OP)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]O)(N[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(OP)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	118.3150	0.000	1	118.3150	0.000	1	116.4214	2.571	13	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHO)	C(C[6]C[6]N[6])(OC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(OC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	114.2528	1.299	9	114.2528	1.686	9	114.2528	1.686	9	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:S-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	C(C[6]C[6]N[6])(SC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.0250	2.443	3	118.4520	2.542	7	118.6541	2.071	9	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:S-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	C(C[6]C[6]N[6])(SC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.0222	0.728	4	118.4520	2.542	7	118.6541	2.071	9	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:S-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	C(C[6]C[6]N[6])(SC[5a])(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(SC[5a])(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	119.3615	0.163	2	119.3615	0.027	2	118.6541	2.071	9	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:S-2:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHS)	C(C[6]C[6]N[6])(SC[5])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHS){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SC[5])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.1615	1.809	2	116.1615	3.274	2	116.1615	3.274	2	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Se-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH)	C(C[6]C[6]N[6])(SeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.9470	0.000	1	118.9470	0.000	1	118.9985	0.005	2	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:Se-2:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH)	C(C[6]C[6]N[6])(SeC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SeC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	119.0500	0.000	1	119.0500	0.000	1	118.9985	0.005	2	116.5703	4.824	35	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:Se-2:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH)	C(C[6]C[6]N[6])(SeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	119.5730	0.000	1	119.5730	0.000	1	120.3515	1.212	2	120.3515	1.212	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:Se-2:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH)	C(C[6]C[6]N[6])(SeC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SeC[6a])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	121.1300	0.000	1	121.1300	0.000	1	120.3515	1.212	2	120.3515	1.212	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6a]-3:S[6]-4:C[6]-3:	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHO)	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6a]C[6a,6a]C[6a])(S[6]C[6,6a]OO)(C[6]C[6]C)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHO){2|O<1>,4|C<3>}	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6a]C[6a,6a]C[6a])(S[6]C[6,6a]OO)(C[6]C[6]C){1|N<2>,2|H<1>,4|C<3>}	115.3895	0.459	2	115.3895	0.211	2	115.3895	0.211	2	115.3895	0.211	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]S)(N[6]C[6]C)(CHHO)	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]CH)(C[6]C[6]C)(CC[6a]HH)	C[6](C[6]C[6]S)(N[6]C[6]C)(CHHO){2|C<4>,3|H<1>}	C(C[6]C[6]N[6])(OH)(H)2	N[6](C[6]C[6]CH)(C[6]C[6]C)(CC[6a]HH){1|C<4>,1|H<1>,1|O<2>,1|S<4>}	115.8920	0.000	1	115.8920	0.000	1	115.8920	0.000	1	115.8920	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:2:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:O-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO)	C(C[6]C[6]N[6])(OC)2(H)	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(OC)2(H)	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	116.6875	0.832	4	116.6875	0.693	4	116.6724	0.521	5	116.6724	0.521	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:2:2:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:O-2:O-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO)	C(C[6]C[6]N[6])(OH)2(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(OH)2(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	116.6120	0.000	1	116.6120	0.000	1	116.6724	0.521	5	116.6724	0.521	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[5a,6]-3:N[6]-3:C-4:	N[5a]-3:C[6]-3:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6,6a]H)(CN[5a]HH)	C(N[5a]C[5a,6]C[5a])(C[6]C[5a,6]N[6])(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C)(H)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6,6a]H)(CN[5a]HH){1|H<1>,4|C<3>}	C(N[5a]C[5a,6]C[5a])(C[6]C[5a,6]N[6])(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C)(H){1|H<1>,1|N<3>,3|C<3>}	118.0260	0.000	1	118.0260	0.000	1	118.0260	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:Br-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrCH)	C(C[6]C[6]N[6])(CC[6a]O)(Br)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrCH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CC[6a]O)(Br)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	120.1400	0.000	1	120.1400	0.000	1	120.1400	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(COO)(H)2	N[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(COO)(H)2	N[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	112.8165	0.059	2	112.8165	0.003	2	112.8165	0.003	2	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH)	C(C[6]C[6]N[6])(CNO)(H)2	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CNO)(H)2	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	116.5680	0.055	2	116.5680	0.003	2	116.5680	0.003	2	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]HH)	C(C[6]C[6,6a]N[6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]HH){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6,6a]N[6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	120.3520	0.000	1	120.3520	0.000	1	120.3520	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	116.8850	0.044	2	116.8850	0.002	2	116.8850	0.002	2	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6,6a]C)(N[6]C[6]O)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O)	C[6](C[6]C[6,6a]C)(N[6]C[6]O)(CC[6a]HH){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6,6a]C)(C[6]C[6]C)(O){1|C<4>,2|C<3>}	115.0463	0.287	4	115.0463	0.082	4	115.2072	0.191	5	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]HH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	115.8510	0.000	1	115.8510	0.000	1	115.2072	0.191	5	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.2274	1.330	30	118.2274	1.770	30	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.3504	1.493	5	118.3504	2.229	5	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCH)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(NCH)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.8485	1.320	6	117.8485	1.742	6	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCS)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NCS)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	116.6845	0.640	2	116.6845	0.410	2	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC[6]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC[6]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	119.6205	0.261	2	119.6205	0.068	2	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC[6]H)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC[6]H)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	120.3673	0.685	3	120.3673	0.469	3	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.5614	0.972	5	117.5614	0.945	5	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC[6a]H)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC[6a]H)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.8200	0.502	2	118.8200	0.252	2	118.2695	1.862	55	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N[5]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH)	C(C[6]C[6]N[6])(N[5]C[5]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(N[5]C[5]2)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.1150	0.000	1	118.1150	0.000	1	118.1150	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CN[6]HH)	C(C[6]C[6]N[6])(N[6]C[6]2)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CN[6]HH){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(N[6]C[6]2)(H)2	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.0475	0.697	2	113.0475	0.485	2	113.0475	0.485	2	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6a]-3:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH)	C(C[6a]C[6a]N[6a])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH){1|C<3>,1|C<4>,1|H<1>}	C(C[6a]C[6a]N[6a])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.5575	0.391	4	117.5575	0.153	4	117.5575	0.153	4	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	N[5]-3:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH)	C(N[5]C[5,6]C[5])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	C(N[5]C[5,6]C[5])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.4820	0.000	1	118.4820	0.000	1	118.4820	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	N[5a]-3:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5a]HH)	C(N[5a]C[5a]N[5a])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	C(N[5a]C[5a]N[5a])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	115.7920	0.000	1	115.7920	0.000	1	115.7920	0.000	1	117.7004	3.424	78	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:2:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:C[6]-3:N-2:	C[6](C[6]C[5a,6]C[6a])(N[6]C[6]N)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[5a,6]H)(C[6]C[6]C)(NS)	C[6](C[6]C[5a,6]C[6a])(N[6]C[6]N)(CC[6a]HH){1|H<1>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[5a,6]H)(C[6]C[6]C)(NS){3|C<3>}	117.7080	0.000	1	117.7080	0.000	1	117.7080	0.000	1	117.7080	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:Ge[4]-3:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CGe[4]HH)	C(C[6]C[6]N[6])(Ge[4]N[4]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(Ge[4]N[4]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.9890	0.000	1	120.9890	0.000	1	120.9890	0.000	1	120.9733	0.732	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:P-3:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHHP)	C(C[6]C[6]N[6])(PC[6a]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(PC[6a]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.9320	1.479	2	120.9320	2.188	2	120.9320	2.188	2	120.9733	0.732	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:Si[4]-3:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CSi[4]HH)	C(C[6]C[6]N[6])(Si[4]N[4]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(Si[4]N[4]2)(H)2	N[6](C[6a]C[6a]2)(Ge[6]N[6]Cl)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	121.0400	0.000	1	121.0400	0.000	1	121.0400	0.000	1	120.9733	0.732	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:B-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(CC[6]HH)	C(C[6]C[6]N[6])2(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BCl3)	C[6](C[6]C[6]H)(N[6]C[6]B)(CC[6]HH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])2(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BCl3){1|C<3>,2|H<1>}	121.2970	1.431	2	121.2970	2.048	2	121.2970	2.048	2	119.5614	4.645	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]Fe)(N[6]C[6]C)(CHHN)	C(C[6]C[6]N[6])(NFeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]Fe)(N[6]C[6]C)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NFeC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	117.5910	0.000	1	117.5910	0.000	1	119.0300	4.141	2	119.5614	4.645	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]O)(N[6]C[6]C)(CHHN)	C(C[6]C[6]N[6])(NHS)(H)2	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]O)(N[6]C[6]C)(CHHN){1|C<3>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(NHS)(H)2	N[6](C[6]C[6]C)2(CH3){1|C<3>,1|H<1>,1|O<2>}	120.4690	0.000	1	120.4690	0.000	1	119.0300	4.141	2	119.5614	4.645	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:In-4:	C[6](N[6]C[6]In)(C[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(InN3)	C[6](N[6]C[6]In)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(InN3){1|C<3>,2|H<1>}	117.1530	0.000	1	117.1530	0.000	1	117.1530	0.000	1	119.5614	4.645	5	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	113.5230	0.000	1	113.5230	0.000	1	113.1560	0.269	2	113.1560	0.269	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CC[6a]HH)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CC[6a]HH){1|C<3>,1|C<4>,3|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	112.7890	0.000	1	112.7890	0.000	1	113.1560	0.269	2	113.1560	0.269	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	5:3:3:	N[6]-3:C[6]-3:C-4:	C[6a]-3:C[6]-3:H-1:H-1:	Ga[6]-5:C[6]-3:C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(CC[6a]HH)	C(C[6a]C[6a]N[6a])(C[6]C[6]N[6])(H)2	N[6](Ga[6]N[6,6]2Cl2)(C[6]C[6]C)(C[6]C[6]H)	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>}	C(C[6a]C[6a]N[6a])(C[6]C[6]N[6])(H)2	N[6](Ga[6]N[6,6]2Cl2)(C[6]C[6]C)(C[6]C[6]H){2|H<1>,5|C<3>}	117.7660	0.000	1	117.7660	0.000	1	117.7660	0.000	1	117.7660	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:2:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:O-2:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO)	C(C[6]C[6]N[6])(CNO)(OH)(H)	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CNO)(OH)(H)	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	116.4210	1.621	2	116.4210	2.627	2	116.4210	2.627	2	116.8187	1.788	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:2:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:O-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HO)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(OC)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(OC)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.6140	0.000	1	117.6140	0.000	1	117.6140	0.000	1	116.8187	1.788	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:2:2:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:O-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]OO)	C(C[6]C[6]N[6])2(OFe)(OC)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])2(OFe)(OC)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	113.7040	0.000	1	113.7040	0.000	1	113.7040	0.000	1	113.7040	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:3:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:C-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH)	C(C[6]C[6]N[6])(CNO)2(H)	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(CNO)2(H)	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	116.9625	0.633	2	116.9625	0.401	2	116.9625	0.401	2	116.3260	1.416	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:3:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-3:C-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCCH)	C(C[6]C[6]N[6])(CNO)2(H)	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCCH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CNO)2(H)	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	115.0530	0.000	1	115.0530	0.000	1	115.0530	0.000	1	116.3260	1.416	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:3:2:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:N-3:C-2:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CN)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(NCN)(CN)	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(NCN)(CN)	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.4610	0.000	1	116.4610	0.000	1	116.4610	0.000	1	116.4610	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:3:3:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6]3)	C(C[6]C[6]N[6])4	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6]3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])4	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	117.2880	0.000	1	117.2880	0.000	1	117.2880	0.000	1	117.2880	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:4:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:P-3:C-4:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP)	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP){1|C<4>,4|H<1>}	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){2|C<4>,2|H<1>}	115.6200	0.000	1	115.6200	0.000	1	115.6200	0.000	1	115.6200	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:4:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:P-3:C-4:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP)	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP){1|C<4>,4|H<1>}	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,3|H<1>}	123.3020	0.000	1	123.3020	0.000	1	123.3020	0.000	1	123.3020	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:4:2:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:C-4:C-2:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CC)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CCHH)(CN)	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CC){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CCHH)(CN)	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.1020	0.000	1	116.1020	0.000	1	116.1020	0.000	1	117.7467	3.186	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:3:4:2:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6a]-3:C-4:O-2:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]CO)	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CH3)(OC)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]CO){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CH3)(OC)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.5690	1.522	2	118.5690	2.316	2	118.5690	2.316	2	117.7467	3.186	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CBHH)	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	118.2600	0.000	1	118.2600	0.000	1	118.2600	0.000	1	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCCH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH){1|N<3>,1|O<1>,1|S<1>}	C(C[6]C[6]N[6])(CCCH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<2>,1|C<3>,1|H<1>}	116.8660	0.000	1	116.8660	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CCHH){1|C<3>,1|H<1>,2|C<4>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.5280	0.361	2	113.5280	0.130	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.7360	0.000	1	117.7360	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<3>,1|O<1>,1|S<1>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	114.7876	0.666	11	115.0507	0.565	15	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<3>,1|O<1>,1|S<2>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	115.7742	0.459	4	115.0507	0.565	15	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]N[6]Se)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Se<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]N[6]Se)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	114.2290	0.000	1	114.2290	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CCHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.1120	0.000	1	118.1120	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	116.8790	0.000	1	116.8790	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	118.7195	0.112	2	118.7195	0.013	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CC[6a]HH)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CC[6a]HH)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	119.3245	0.151	2	119.3245	0.023	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	119.9580	0.000	1	119.9580	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Os<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]Os)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	114.7040	0.000	1	116.0800	3.787	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Os<7>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]Os)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	117.4560	0.000	1	116.0800	3.787	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]N[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<2>,1|N<3>,1|O<2>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]N[5a]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<3>}	115.8940	0.047	2	115.8940	0.002	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]N[6]Se)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Se<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]N[6]Se)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	114.9643	1.217	3	114.9643	1.480	3	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CHHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CHHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.1042	1.288	10	118.1042	1.658	10	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CHHO)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CHHO)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.1280	0.000	1	117.1280	0.000	1	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]O)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]O)(N[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	118.8054	0.525	8	118.8054	0.276	8	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CCHH){1|N<2>,2|C<3>,2|N<3>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H){2|C<3>}	115.2305	0.615	27	115.2008	0.368	29	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CCHH){2|C<3>,3|N<3>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	114.7990	0.321	2	115.2008	0.368	29	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]C)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]N[6]C)(N[6]C[6]H)(CCHH){1|C<3>,1|S<2>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|N<2>,1|S<2>}	115.8305	0.371	2	115.8305	0.138	2	116.2217	3.118	84	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH)	C(C[6]C[6]N[6])(CCHP)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CCHP)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	117.1365	0.015	2	117.1365	0.000	2	117.0252	1.559	4	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH)	C(C[6]C[6]N[6])(CHHP)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CHHP)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.9140	2.151	2	116.9140	4.627	2	117.0252	1.559	4	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.5360	0.000	1	118.5360	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	119.6470	0.000	1	119.6470	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	114.9190	0.000	1	114.9190	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.8350	0.000	1	117.8350	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NCoCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(NCoCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	116.4440	0.000	1	116.4440	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.6340	1.191	23	117.6340	1.418	23	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	C(C[6]C[6]N[6])(NRuCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NRuCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.6020	0.000	1	118.6020	0.000	1	117.6402	1.637	29	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN)	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	116.8200	0.000	1	116.8200	0.000	1	117.1485	0.216	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN)	C(C[6]C[6]N[6])(NRuCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NRuCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	117.4770	0.000	1	117.4770	0.000	1	117.1485	0.216	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP)	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.7210	0.000	1	117.7210	0.000	1	117.7425	0.001	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP)	C(C[6]C[6]N[6])(PO3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PO3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	117.7640	0.000	1	117.7640	0.000	1	117.7425	0.001	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP)	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	117.6840	0.000	1	117.6840	0.000	1	117.4630	1.084	4	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP)	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	116.6685	0.261	2	116.6685	0.068	2	117.4630	1.084	4	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP)	C(C[6]C[6]N[6])(PO3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PO3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	118.8310	0.000	1	118.8310	0.000	1	117.4630	1.084	4	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[6]C[5a,6]H)(C[6]C[6]N)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]N)(CCHH){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	112.9290	0.000	1	112.9290	0.000	1	112.9290	0.000	1	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH){1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	117.3870	0.000	1	117.3870	0.000	1	117.2435	0.041	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,3|C<3>}	117.1000	0.000	1	117.1000	0.000	1	117.2435	0.041	2	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CCHH)	C(C[6]N[6]2)(CHHO)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CCHH){2|C<3>,2|O<2>}	C(C[6]N[6]2)(CHHO)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|B<4>,2|C<3>,2|H<1>}	118.1750	0.000	1	118.1750	0.000	1	118.1750	0.000	1	116.6598	2.963	130	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	C[6a]-3:C[6]-3:Ge[6]-2:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CBHH)	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6])	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CBHH){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	119.3010	0.000	1	119.3010	0.000	1	119.3010	0.000	1	119.3010	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	B[6]-3:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CBHH)	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](B[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CBHH){1|C<4>,1|N<3>,3|C<3>}	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](B[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,6|C<3>}	120.5210	0.000	1	120.5210	0.000	1	120.5210	0.000	1	119.6143	0.855	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	C[6a]-3:Si[6]-3:C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CBHH)	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6a]C[6a]2)(Si[6]N[6]Ni)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(BC[6a]3)(H)2	N[6](C[6a]C[6a]2)(Si[6]N[6]Ni)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	119.1610	0.690	2	119.1610	0.476	2	119.1610	0.476	2	119.6143	0.855	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	C[6]-3:C[6]-3:B-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH)	C(C[6]C[6]N[6])(BC[6a]2N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC[6a]2C)	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(BC[6a]2N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC[6a]2C){1|C<3>,2|H<1>}	120.2750	0.000	1	120.2750	0.000	1	120.9023	0.297	3	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:B-4:H-1:H-1:	C[6]-3:C[6]-3:B-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH)	C(C[6]C[6]N[6])(BN[6]CC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC3)	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(BN[6]CC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC3){1|C<3>,2|H<1>}	121.2160	0.062	2	121.2160	0.004	2	120.9023	0.297	3	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:B-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC[6a]3)	C[6](C[6]C[6]H)(N[6]C[6]B)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(BC[6a]3){1|C<3>,2|H<1>}	122.6230	0.000	1	122.6230	0.000	1	122.6230	0.000	1	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]Br)(N[6]C[6]C)(CCHH)	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]Br)(N[6]C[6]C)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CC[6]HH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|Br<1>,2|C<3>}	120.0740	0.033	2	120.0740	0.001	2	118.8959	3.518	10	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(N[6]C[6]C)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]N)(CC[6a]HH)	C[6](C[6]C[6]C)(N[6]C[6]C)(CCHH){1|N<2>,2|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]N)(CC[6a]HH){1|C<2>,1|C<3>,1|C<4>}	117.0162	0.133	4	117.0162	0.018	4	118.8959	3.518	10	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH)	C(C[6]C[6]N[6])(CCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	121.6170	0.000	1	121.6170	0.000	1	118.8959	3.518	10	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	119.7097	1.629	3	119.7097	2.654	3	118.8959	3.518	10	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:Ge-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CGeHH)	C(C[6]C[6]N[6])(GeC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CGeHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(GeC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	120.4870	0.000	1	120.4870	0.000	1	120.4870	0.000	1	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:Si-4:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CSiHH)	C(C[6]C[6]N[6])(SiC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CSiHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SiC3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	120.9150	0.000	1	120.9150	0.000	1	120.9150	0.000	1	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:In-4:	C[6](N[6]C[6]In)(C[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CHHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(InCCO)	C[6](N[6]C[6]In)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CHHN)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(InCCO){1|C<3>,2|H<1>}	117.9150	0.000	1	117.9150	0.000	1	117.9150	0.000	1	119.6239	3.549	17	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:P-4:H-1:H-1:	C[6a]-3:S[6]-4:C[6]-3:	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHP)	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6a]C[6,6a]C[6a])(S[6]C[6,6a]OO)(C[6]C[6]C)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHP){2|O<1>,4|C<3>}	C(C[6]C[6]N[6])(PC[6a]2O)(H)2	N[6](C[6a]C[6,6a]C[6a])(S[6]C[6,6a]OO)(C[6]C[6]C){1|N<3>,2|H<1>,4|C<3>}	115.0975	0.282	2	115.0975	0.080	2	115.0975	0.080	2	115.0975	0.080	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6a]O[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|O<1>,1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6a]O[6]C)(C[6]C[6]C)(H){1|H<1>,3|C<3>}	117.1900	0.000	1	117.1900	0.000	1	117.1900	0.000	1	116.2652	29.862	34	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6](N[6]C[5,6]O)(C[6]C[6]O)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(O)	C[6](N[6]C[5,6]O)(C[6]C[6]O)(CCHH){1|C<4>,1|H<1>,3|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(O){1|H<1>,1|O<2>,2|C<4>,2|O<1>}	117.7440	0.000	1	117.7440	0.000	1	117.7440	0.000	1	116.2652	29.862	34	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	B[6,6a]-4:C[6]-3:H-1:	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CCHH)	C(C[6]N[6]2)(CHHO)(H)2	N[6](B[6,6a]C[6,6a]O[6a]2)(C[6]N[6]C)(H)	C[6](N[6]B[6,6a]H)(N[6]C[6,6a]H)(CCHH){2|C<3>,2|O<2>}	C(C[6]N[6]2)(CHHO)(H)2	N[6](B[6,6a]C[6,6a]O[6a]2)(C[6]N[6]C)(H){1|H<1>,4|C<3>}	120.4170	0.000	1	120.4170	0.000	1	120.4170	0.000	1	116.2652	29.862	34	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){2|C<4>,2|H<1>}	115.3135	6.080	25	115.3135	36.970	25	116.0537	32.126	31	116.2652	29.862	34	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CCHH)	C(C[6]N[6]2)(CC[6]HH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CC[6]HH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<4>,3|H<1>}	119.1380	1.070	6	119.1380	1.146	6	116.0537	32.126	31	116.2652	29.862	34	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:3:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-3:	C[6](N[6]C[6]C)2(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(COO)	C[6](N[6]C[6]C)2(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(COO){2|C<4>,2|H<1>}	120.4040	1.351	2	120.4040	1.824	2	120.4040	1.824	2	120.4040	1.824	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	S[6]-4:C[6]-3:C-4:	C[6](C[6]C[6,6a]H)(N[6]S[6]C)(CCHH)	C(C[6]C[6]N[6])(CC[6a]HH)(H)2	N[6](S[6]C[6,6a]OO)(C[6]C[6]C)(CH3)	C[6](C[6]C[6,6a]H)(N[6]S[6]C)(CCHH){2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(CC[6a]HH)(H)2	N[6](S[6]C[6,6a]OO)(C[6]C[6]C)(CH3){1|H<1>,2|C<3>}	115.5880	0.000	1	115.5880	0.000	1	115.5880	0.000	1	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:S-4:H-1:H-1:	C[6]-4:C[6]-3:S-4:	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(CHHS)	C(C[6]C[6]N[6])(SC[6a]OO)(H)2	N[6](C[6]C[6,6a]HH)(C[6]C[6]C)(SCOO)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(CHHS){2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(SC[6a]OO)(H)2	N[6](C[6]C[6,6a]HH)(C[6]C[6]C)(SCOO){1|H<1>,2|C<3>}	117.4930	0.000	1	117.4930	0.000	1	117.4930	0.000	1	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,3|H<1>}	122.8182	4.998	24	122.8182	24.981	24	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)2(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)2(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<3>,1|C<4>,2|H<1>}	119.3675	0.899	2	119.1580	0.536	3	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)2(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)2(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){2|C<4>,2|H<1>}	118.7390	0.000	1	119.1580	0.536	3	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)2(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CC[6a]HH)	C[6](N[6]C[6]C)2(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CC[6a]HH){2|C<4>,2|H<1>}	120.4140	0.000	1	120.4140	0.000	1	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Cr)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Cr)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Cr<7>,1|C<4>,2|H<1>}	117.5120	0.000	1	116.7620	1.125	2	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Cr)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Cr)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Cr<8>,1|C<4>,2|H<1>}	116.0120	0.000	1	116.7620	1.125	2	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Ir)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Ir)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Ir<4>,1|C<4>,2|H<1>}	117.7900	0.000	1	117.7900	0.000	1	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Ni)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Ni)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Ni<5>,1|C<4>,2|H<1>}	117.4580	0.000	2	117.4580	0.000	2	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Zn)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Zn)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Zn<3>,1|C<4>,2|H<1>}	116.0590	0.000	1	116.6413	0.255	3	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Zn)(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Zn)(N[6]C[6]C)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Zn<4>,1|C<4>,2|H<1>}	116.9325	0.023	2	116.6413	0.255	3	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]Ga[5]C[6])(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]Ga[5]C[6])(N[6]C[6]C)(CCHH){1|C<4>,1|P<3>,2|N<3>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Ga<4>,1|C<4>,2|H<1>}	114.8110	0.000	1	114.8110	0.000	1	120.9862	23.160	37	120.7583	22.975	39	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:4:3:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	Ga[5]-4:C[6]-4:C[6]-3:	C[6](N[6]Ga[5]C[6])(N[6]C[6]C)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](Ga[5]N[5]2P)(C[6]C[6]HH)(C[6]N[6]C)	C[6](N[6]Ga[5]C[6])(N[6]C[6]C)(CCHH){1|C<4>,1|P<3>,2|N<3>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](Ga[5]N[5]2P)(C[6]C[6]HH)(C[6]N[6]C){2|C<4>,2|H<1>,4|C<3>}	121.0040	0.000	1	121.0040	0.000	1	121.0040	0.000	1	121.0040	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:2:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:O-2:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO)	C(C[6]C[6]N[6])(CCCH)(OH)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO){1|C<3>,1|H<1>,1|O<2>}	C(C[6]C[6]N[6])(CCCH)(OH)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	117.4760	0.000	1	117.4760	0.000	1	117.4760	0.000	1	117.4760	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:2:2:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:O-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCOO)	C(C[6]C[6]N[6])(CH3)(OC)2	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCOO){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CH3)(OC)2	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.8925	0.926	2	117.8925	0.857	2	117.8925	0.857	2	117.8925	0.857	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:3:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:P-4:C-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHP)	C(C[6]C[6]N[6])(PC[6a]2O)(CNO)(H)	N[6](C[6]C[6]C)2(O)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHP){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(PC[6a]2O)(CNO)(H)	N[6](C[6]C[6]C)2(O){1|C<3>,2|H<1>}	116.3350	0.107	2	116.3350	0.012	2	116.3350	0.012	2	116.3350	0.012	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:3:2:	4:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-3:O-2:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CCCO)	C(C[6]N[6]2)(CH3)(CNS)(OH)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CCCO){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CH3)(CNS)(OH)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<4>,3|H<1>}	119.7435	0.718	2	119.7435	0.515	2	119.7435	0.515	2	119.7435	0.515	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	C[6,6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6,6]N[6,6]N[6])(N[6]C[6]H)(CCCH)	C(C[6]C[6,6]N[6])(CCHH)(CH3)(H)	N[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]N[6,6]N[6])(N[6]C[6]H)(CCCH){1|C<3>,1|O<1>,2|C<4>}	C(C[6]C[6,6]N[6])(CCHH)(CH3)(H)	N[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>}	118.1350	0.000	1	118.1350	0.000	1	118.1350	0.000	1	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CCCH){1|C<3>,1|C<4>,2|H<1>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.8470	0.171	2	113.8470	0.029	2	114.9234	0.649	7	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]N[6]Se)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH){1|Se<1>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]N[6]Se)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	115.3540	0.394	5	115.3540	0.155	5	114.9234	0.649	7	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O)	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CCCH){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	119.0930	0.000	1	119.0930	0.000	1	119.0930	0.000	1	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CCCH)	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CCCH){1|C<3>,1|C<4>,1|O<1>}	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	120.3350	0.167	2	120.3350	0.028	2	120.5282	0.061	4	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:1:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]H)2(CCCH)	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]H)2(CCCH){1|C<3>,1|C<4>,1|O<1>}	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	120.7215	0.074	2	120.7215	0.006	2	120.5282	0.061	4	117.2158	7.427	13	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCCH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]C)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	120.2550	0.000	1	120.2550	0.000	1	120.2550	0.000	1	120.2550	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	119.1435	0.206	2	117.4542	2.526	11	117.5213	2.350	12	117.5213	2.350	12	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	117.6665	1.442	6	117.4542	2.526	11	117.5213	2.350	12	117.5213	2.350	12	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	115.9033	0.902	3	117.4542	2.526	11	117.5213	2.350	12	117.5213	2.350	12	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CHHS)2(CH3)	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CHHS)2(CH3)	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.2590	0.000	1	118.2590	0.000	1	117.5213	2.350	12	117.5213	2.350	12	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:C[6]-3:Ga[6]-2:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ga[6]N[6])	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ga[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	125.7255	1.890	2	125.7255	3.572	2	125.7255	3.572	2	124.5602	7.115	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:C[6]-3:Ge[6]-2:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6])	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6]){1|H<1>,3|C<3>,3|C<4>}	120.9110	0.000	1	123.3950	12.341	2	123.3950	12.341	2	124.5602	7.115	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:2:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:C[6]-3:Ge[6]-2:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6])	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3){1|C<4>,1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(C[6]C[6]C)(Ge[6]N[6]){1|H<1>,2|C<4>,4|C<3>}	125.8790	0.000	1	123.3950	12.341	2	123.3950	12.341	2	124.5602	7.115	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:B[6]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]F)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]F)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	120.8450	0.092	2	120.8450	0.008	2	120.8450	0.008	2	122.6210	4.708	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:Ga[6]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ga)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(Ga[6]N[6]Ga)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	124.3970	1.225	2	124.3970	1.500	2	124.3970	1.500	2	122.6210	4.708	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:B[6]-4:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]FF)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	127.5890	0.033	2	127.5890	0.001	2	127.0265	1.269	6	127.0265	1.269	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	3:4:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	C[6a]-3:B[6]-4:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]FO)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6a]C[6a]2)(B[6]N[6]FO)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	126.7452	1.341	4	126.7452	1.798	4	127.0265	1.269	6	127.0265	1.269	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	B[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](B[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](B[6]N[6]Cl2)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	126.0165	1.794	2	126.0165	3.218	2	126.0165	3.218	2	124.6360	4.510	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Ga[6]N[6]GaI)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](Ga[6]N[6]GaI)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	124.2080	1.725	2	123.9458	4.539	4	123.9458	4.539	4	124.6360	4.510	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	Ga[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Ga[6]N[6]GaI)(C[6a]C[6a]2)(C[6]C[6]C)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](Ga[6]N[6]GaI)(C[6a]C[6a]2)(C[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	123.6835	3.219	2	123.9458	4.539	4	123.9458	4.539	4	124.6360	4.510	6	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	3:4:4:4:	7:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	Nb[3,3,6]-7:C[6]-3:H-1:	C[6](N[6]Nb[3,3,6]H)(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C)(H)	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>}	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C)(H){1|H<1>,5|C<3>}	120.0680	0.000	1	120.0680	0.000	1	120.0680	0.000	1	120.0680	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	4:3:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	B[5]-4:C[6]-3:H-1:H-1:	B[5]-4:C[6]-3:C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(CB[5]HH)	C(B[5]C[5,6a]2N[6])(C[6]C[6]N[6])(H)2	N[6](B[5]C[5,6a]C[5,6]C)(C[6]C[6]C)(C[6]C[6]H)	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>}	C(B[5]C[5,6a]2N[6])(C[6]C[6]N[6])(H)2	N[6](B[5]C[5,6a]C[5,6]C)(C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>,4|C<3>}	121.0620	0.000	1	121.0620	0.000	1	121.0620	0.000	1	121.0620	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	4:3:4:1:	4:3:1:	N[6]-3:N[6]-3:C-4:	P-4:C[6]-3:C-4:H-1:	C[6]-4:C[6]-3:H-1:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP)	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP){1|C<4>,4|H<1>}	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(H){2|C<4>,2|H<1>}	119.1130	0.000	1	119.1130	0.000	1	119.1130	0.000	1	119.1130	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	4:3:4:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	P-4:C[6]-3:C-4:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP)	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHP){1|C<4>,4|H<1>}	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,3|H<1>}	124.3090	0.000	1	124.3090	0.000	1	118.3942	15.999	4	118.3942	15.999	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	4:3:4:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	P-4:C[6]-3:C-4:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Ni)(N[6]C[6]C)(CCHP)	C(PC[6a]2Ni)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Ni)(N[6]C[6]C)(CCHP){1|C<4>,4|H<1>}	C(PC[6a]2Ni)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Ni<6>,1|C<4>,2|H<1>}	116.8970	0.000	2	116.8970	0.000	2	118.3942	15.999	4	118.3942	15.999	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:3:4:	4:3:4:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	P-4:C[6]-3:C-4:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]Re)(N[6]C[6]C)(CCHP)	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]Re)(N[6]C[6]C)(CCHP){1|C<4>,4|H<1>}	C(PC[6a]2Re)(C[6]N[6]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|Re<6>,1|C<4>,2|H<1>}	115.4740	0.000	1	115.4740	0.000	1	118.3942	15.999	4	118.3942	15.999	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:4:3:	4:3:1:1:	4:3:3:	N[6]-3:C-4:C[6]-3:	B[6,6]-4:C[6]-3:H-1:H-1:	B[6,6]-4:C[6]-3:C[6]-3:	C[6](N[6]B[6,6]C[6])(CB[6,6]HH)(C[6]C[6]H)	C(B[6,6]C[6,6]2N[6])(C[6]C[6]N[6])(H)2	N[6](B[6,6]C[6,6]2C)(C[6]C[6]C)(C[6]C[6]H)	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>}	C(B[6,6]C[6,6]2N[6])(C[6]C[6]N[6])(H)2	N[6](B[6,6]C[6,6]2C)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,4|C<4>,4|H<1>}	121.1320	0.363	2	121.1320	0.132	2	121.1320	0.132	2	121.1320	0.132	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:4:4:	3:1:1:1:	3:3:3:	N[6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[6a]-3:Ge[6]-3:C[6]-3:	C[6](N[6]C[6a]Ge[6])(C[6]C[6]HH)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]HH)(CH3){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6a]C[6a]2)(Ge[6]N[6]O)(C[6]C[6]C){2|C<4>,2|H<1>,4|C<3>}	120.2080	1.072	4	120.2080	1.149	4	120.2080	1.149	4	120.2080	1.149	4	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	3:4:4:	3:1:1:1:	4:4:3:	N[6]-3:C[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	In[6]-4:C[6]-4:C[6]-3:	C[6](N[6]In[6]C[6])(C[6]C[6]HH)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](In[6]O[6]CO)(C[6]C[6]2H)(C[6]C[6]C)	C[6](N[6]In[6]C[6])(C[6]C[6]HH)(CH3){1|H<1>,2|O<2>,5|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](In[6]O[6]CO)(C[6]C[6]2H)(C[6]C[6]C){1|N<2>,3|C<4>,5|H<1>}	128.5570	0.000	1	128.5570	0.000	1	128.5570	0.000	1	128.5570	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:3:	6:3:1:1:	3:3:1:	C-4:C[6]-3:N[6]-3:	C[5x3,3x5,11x6]-6:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]H)	C(C[5x3,3x5,11x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2B[5x3,5x5,5x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	C(C[5x3,3x5,11x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2B[5x3,5x5,5x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.7360	0.000	1	118.7360	0.000	1	118.7360	0.000	1	118.7360	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:3:	6:3:1:1:	3:3:4:	C-4:C[6]-3:N[6]-3:	C[5x3,3x5,11x6]-6:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]C)	C(C[5x3,3x5,11x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2B[5x3,5x5,5x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	C(C[5x3,3x5,11x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2B[5x3,5x5,5x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	120.5150	0.000	1	120.5150	0.000	1	120.5150	0.000	1	120.9565	0.390	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:3:	6:3:1:1:	3:3:4:	C-4:C[6]-3:N[6]-3:	C[5x3,5x5,20x6]-6:C[6]-3:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)(N[6]C[6]C)	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]N[6])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	121.3980	0.000	1	121.3980	0.000	1	121.3980	0.000	1	120.9565	0.390	2	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:1:1:1:	3:2:1:	C[6]-4:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:O[6]-2:O-1:	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(O[6]C[6])(O)	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CH3){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(O[6]C[6])(O){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	116.1150	0.000	1	116.4303	0.075	3	116.4303	0.075	3	116.4303	0.075	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:1:1:1:	3:2:1:	C[6]-4:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:O[6]-2:O-1:	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(O[6]C[6])(O)	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CH3){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(O[6]C[6])(O){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	116.5880	0.000	2	116.4303	0.075	3	116.4303	0.075	3	116.4303	0.075	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:1:1:1:	3:4:4:	C[4,6]-4:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:B[6]-4:C-4:	C[6](C[4,6]C[4,6]2H)(N[6]B[6]C)(CH3)	C(C[6]C[4,6]N[6])(H)3	N[6](C[6]C[4,6]C)(B[6]O[6]FF)(CH3)	C[6](C[4,6]C[4,6]2H)(N[6]B[6]C)(CH3){1|C<4>,2|C<3>,2|F<1>,2|O<2>}	C(C[6]C[4,6]N[6])(H)3	N[6](C[6]C[4,6]C)(B[6]O[6]FF)(CH3){1|H<1>,2|C<4>}	123.4977	0.741	3	123.4977	0.549	3	123.4977	0.549	3	123.4977	0.549	3	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:1:1:1:	4:3:1:	C[6]-4:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:O-1:	C[6](C[6]C[6]HH)(N[6]C[6]O)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CC)(C[6]C[6]C)(O)	C[6](C[6]C[6]HH)(N[6]C[6]O)(CH3){1|H<1>,1|O<2>,3|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]CC)(C[6]C[6]C)(O){1|C<4>,4|H<1>}	111.2150	0.000	1	111.2150	0.000	1	111.2150	0.000	1	111.2150	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:2:1:1:	4:3:1:	C[6]-4:N[6]-3:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-4:C[6]-3:O-1:	C[6](C[6]C[6]HO)(N[6]C[6]O)(CHHO)	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]HH)(C[6]C[6]C)(O)	C[6](C[6]C[6]HO)(N[6]C[6]O)(CHHO){1|C<4>,1|O<2>,3|H<1>}	C(C[6]C[6]N[6])(OC)(H)2	N[6](C[6]C[6]HH)(C[6]C[6]C)(O){1|C<4>,2|H<1>,2|O<2>}	114.6860	0.000	1	114.6860	0.000	1	114.6860	0.000	1	114.6860	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	4:3:4:	3:4:1:1:	3:2:1:	C[6]-4:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:O[6]-2:O-1:	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(O[6]C[6])(O)	C[6](C[6]C[6a]C[6]H)(N[6]O[6]O)(CCHH){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[6]C[6]C)(O[6]C[6])(O){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	115.9270	0.000	1	115.9270	0.000	1	115.9270	0.000	1	115.9270	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP2_SP3	C[6]	C	N[6]	5:3:4:	3:1:1:1:	3:3:4:	C[6]-5:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]N[6]Ru3)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]N[6]Ru3)(N[6]C[6]C)(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){3|Ru<5>,1|C<4>,1|N<3>}	118.4260	0.000	1	118.4260	0.000	1	118.4260	0.000	1	118.4260	0.000	1	117.6635	8.309	2219	117.6832	8.351	2234
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6,6]	3:2:4:	3:1:1:1:	3:4:3:	N[6,6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6](N[6,6]C[6,6a]C[6,6])(N[6]C[6,6a])(CH3)	C(C[6]N[6,6]N[6])(H)3	N[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]N[6]H)(C[6]N[6]C)	C[6](N[6,6]C[6,6a]C[6,6])(N[6]C[6,6a])(CH3){1|H<1>,1|N<3>,4|C<3>}	C(C[6]N[6,6]N[6])(H)3	N[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]N[6]H)(C[6]N[6]C){2|H<1>,5|C<3>}	118.9520	0.000	1	118.9520	0.000	1	118.9520	0.000	1	118.9520	0.000	1	118.9520	0.000	1	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6](N[6]C[6]N)(N[6]C[6])(CHNN)	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NOO)	C[6](N[6]C[6]N)(N[6]C[6])(CHNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C)(NOO){1|C<4>,1|N<3>}	116.7620	0.000	1	116.7620	0.000	1	116.7620	0.000	1	116.7620	0.000	1	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CFHH)	C(C[6]C[6]N[6])(F)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(CFHH){1|N<2>,2|C<3>,2|N<3>}	C(C[6]C[6]N[6])(F)(H)2	N[6](C[6]C[6]C)(C[6]N[6]N)(H){2|C<3>}	112.2510	0.000	1	112.2510	0.000	1	112.2510	0.000	1	113.0464	0.835	5	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(N[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(H){1|C<4>,2|C<3>}	113.9925	0.562	2	113.9925	0.316	2	113.9925	0.316	2	113.0464	0.835	5	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:1:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]C)(CH3){1|C<4>,1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	112.4980	0.025	2	112.4980	0.001	2	112.4980	0.001	2	113.0464	0.835	5	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2(CH3){1|C<3>,2|H<1>}	114.9890	0.767	2	114.9890	0.588	2	114.9890	0.588	2	114.9680	0.295	3	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	3:3:4:	N[6]-3:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6](N[6]C[5,6]C)(C[6]N[6]S)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(CC[6a]HH)	C[6](N[6]C[5,6]C)(C[6]N[6]S)(CH3){3|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(CC[6a]HH){1|Se<2>,1|N<3>,1|S<2>,2|C<3>}	114.9260	0.000	1	114.9260	0.000	1	114.9260	0.000	1	114.9680	0.295	3	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<4>,3|H<1>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]HH)(C[6]C[6]C)(CH3){1|Mo<7>,1|C<4>,2|H<1>}	118.2660	0.000	1	118.2660	0.000	1	117.9385	0.215	2	117.9385	0.215	2	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:1:1:1:	4:3:4:	C[6]-3:N[6]-3:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(CH3)	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>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(CH3){1|Mo<7>,1|C<4>,2|C<3>,2|H<1>}	117.6110	0.000	1	117.6110	0.000	1	117.9385	0.215	2	117.9385	0.215	2	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:3:1:1:	3:3:1:	C[6]-3:N[6]-3:C-4:	C[6]-3:N[5]-3:H-1:H-1:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH)	C(C[6]C[6]N[6])(N[5]C[5]N[5])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(N[5]C[5]N[5])(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	118.1740	0.000	1	118.1740	0.000	1	118.1740	0.000	1	118.1740	0.000	1	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:3:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	S[6]-4:C[6a]-3:C[6]-3:	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](S[6]C[6,6a]OO)(C[6a]C[6a]2)(C[6]C[6]C)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CCHH){2|O<1>,4|C<3>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](S[6]C[6,6a]OO)(C[6a]C[6a]2)(C[6]C[6]C){3|H<1>,4|C<3>}	115.0070	0.000	1	115.0070	0.000	1	115.0070	0.000	1	115.0070	0.000	1	116.6314	38.099	14	116.7861	35.737	15
762	490	856	0:SP2_SP3_SP3	C[6]	C	N[6]	3:3:4:	3:4:1:1:	4:3:4:	N[6]-3:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:C-4:	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH)	C[6](N[6]C[6]C)(N[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)(CCHH){1|C<4>,3|H<1>}	136.8830	0.000	1	136.8830	0.000	1	136.8830	0.000	1	136.8830	0.000	1	116.6314	38.099	14	116.7861	35.737	15
762	490	882	0:SP2_SP3_SP3	C[6,6]	C	P[4,3x6]	3:2:4:	3:4:4:4:	4:4:3:	P[4,3x6]-3:P[6,6]-2:C-4:	C[6,6]-3:C-4:C-4:C-4:	C[3,4,6,6]-4:C[4,5,6,6]-4:C[6,6]-3:	C[6,6](P[4,3x6]C[3,4,6,6]C[4,5,6,6])(P[6,6]C[5,3x6])(CC3)	C(C[6,6]P[4,3x6]P[6,6])(CH3)3	P[4,3x6](C[3,4,6,6]P[3,5,6,6]P[3,4,5]C)(C[4,5,6,6]P[3,4,5]P[5,6,6]C)(C[6,6]P[6,6]C)	C[6,6](P[4,3x6]C[3,4,6,6]C[4,5,6,6])(P[6,6]C[5,3x6])(CC3){1|P<4>,2|P<3>,3|C<4>}	C(C[6,6]P[4,3x6]P[6,6])(CH3)3	P[4,3x6](C[3,4,6,6]P[3,5,6,6]P[3,4,5]C)(C[4,5,6,6]P[3,4,5]P[5,6,6]C)(C[6,6]P[6,6]C){1|Cl<1>,1|C<4>,1|O<1>}	117.3910	0.000	1	117.3910	0.000	1	117.3910	0.000	1	117.3910	0.000	1	117.3910	0.000	1	117.3910	0.000	1
762	490	904	0:SP2_SP-NON_SP3	C[6,6]	C	P[6,6]	3:2:4:	3:4:4:4:	4:3:	P[3,6,6]-3:P[6,6]-2:C-4:	C[6,6]-3:C-4:C-4:C-4:	C[5,5,6,6]-4:C[6,6]-3:	C[6,6](P[3,6,6]C[3,5,6,6]P[3,5,6,6])(P[6,6]C[5,5,6,6])(CC3)	C(C[6,6]P[3,6,6]P[6,6])(CH3)3	P[6,6](C[5,5,6,6]C[5,5,6,6]P[5,5,6,6]C)(C[6,6]P[3,6,6]C)	C[6,6](P[3,6,6]C[3,5,6,6]P[3,5,6,6])(P[6,6]C[5,5,6,6])(CC3){1|P<4>,3|C<4>}	C(C[6,6]P[3,6,6]P[6,6])(CH3)3	P[6,6](C[5,5,6,6]C[5,5,6,6]P[5,5,6,6]C)(C[6,6]P[3,6,6]C){1|C<3>,1|W<6>,2|C<4>,2|P<3>}	120.2630	0.000	1	120.2630	0.000	1	120.2630	0.000	1	119.2350	2.114	2	119.2350	2.114	2	116.6398	5.790	6
762	490	904	0:SP2_SP-NON_SP3	C[6,6]	C	P[6,6]	3:2:4:	3:4:4:4:	4:3:	P[4,3x6]-3:P[6,6]-2:C-4:	C[6,6]-3:C-4:C-4:C-4:	C[5,3x6]-4:C[6,6]-3:	C[6,6](P[4,3x6]C[3,4,6,6]C[4,5,6,6])(P[6,6]C[5,3x6])(CC3)	C(C[6,6]P[4,3x6]P[6,6])(CH3)3	P[6,6](C[5,3x6]P[3,5,6,6]P[5,6,6]C)(C[6,6]P[4,3x6]C)	C[6,6](P[4,3x6]C[3,4,6,6]C[4,5,6,6])(P[6,6]C[5,3x6])(CC3){1|P<4>,2|P<3>,3|C<4>}	C(C[6,6]P[4,3x6]P[6,6])(CH3)3	P[6,6](C[5,3x6]P[3,5,6,6]P[5,6,6]C)(C[6,6]P[4,3x6]C){1|Cl<1>,1|O<1>,1|P<3>,2|C<4>}	118.2070	0.000	1	118.2070	0.000	1	118.2070	0.000	1	119.2350	2.114	2	119.2350	2.114	2	116.6398	5.790	6
762	490	904	0:SP2_SP-NON_SP3	C[6]	C	P[6]	2:2:4:	3:4:4:4:	3:3:	P[6]-2:P[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:	C[6](P[6]C[6])2(CC3)	C(C[6]P[6]2)(CH3)3	P[6](C[6]P[6]C)2	C[6](P[6]C[6])2(CC3){1|P<3>,2|C<4>}	C(C[6]P[6]2)(CH3)3	P[6](C[6]P[6]C)2{1|Au<2>,1|C<3>}	114.3675	1.616	2	114.3675	2.611	2	114.3675	2.611	2	114.3675	2.611	2	115.3423	2.210	4	116.6398	5.790	6
762	490	904	0:SP2_SP-NON_SP3	C[6]	C	P[6]	3:2:4:	3:4:4:4:	3:3:	P[6]-3:P[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:	C[6](P[6]C[6]Au)(P[6]C[6])(CC3)	C(C[6]P[6]2)(CH3)3	P[6](C[6]P[6]C)2	C[6](P[6]C[6]Au)(P[6]C[6])(CC3){1|P<2>,2|C<4>}	C(C[6]P[6]2)(CH3)3	P[6](C[6]P[6]C)2{1|Au<2>,1|C<3>}	116.3170	0.468	2	116.3170	0.219	2	116.3170	0.219	2	116.3170	0.219	2	115.3423	2.210	4	116.6398	5.790	6
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:2:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:S[6]-2:	C[6](N[6]C[6])(N[6]S[6])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]C)(S[6]N[6])	C[6](N[6]C[6])(N[6]S[6])(CF3){1|C<3>,1|N<2>}	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]C)(S[6]N[6]){1|C<3>}	114.1526	1.238	8	114.1526	1.533	8	114.1526	1.533	8	114.1526	1.533	8	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]C[6])(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C){1|N<2>,3|C<3>}	117.7560	0.612	2	117.7560	0.375	2	117.7560	0.375	2	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]N[6])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]N[6])(CF3){3|C<3>}	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]N[6]C){1|N<2>,1|N<3>,2|C<3>}	113.7400	0.000	1	113.7400	0.000	1	115.4282	1.063	5	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]N[6])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]N[6])(CF3){3|C<3>}	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,1|N<3>,2|C<3>}	115.8503	0.479	4	115.8503	0.229	4	115.4282	1.063	5	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6])(N[6]S[6])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6]C[6a]N[6])(C[6]N[6]C)	C[6](N[6]C[6])(N[6]S[6])(CF3){1|C<3>,1|N<2>}	C(C[6]N[6]2)(F)3	N[6](C[6]C[6a]N[6])(C[6]N[6]C){1|S<2>,2|C<3>}	114.0359	1.298	8	114.0359	1.685	8	113.8373	1.829	9	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6])2(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]C)(C[6]N[6]F)	C[6](N[6]C[6])2(CF3){1|F<1>,1|N<2>,2|C<4>}	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]C)(C[6]N[6]F){1|C<4>}	112.2490	0.000	1	112.2490	0.000	1	113.8373	1.829	9	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	N[6]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]N[6])(CF3)	C(C[6]N[6]2)(F)3	N[6](N[6]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]N[6])(CF3){3|C<3>}	C(C[6]N[6]2)(F)3	N[6](N[6]C[6,6a]C[6a])(C[6]N[6]C){4|C<3>}	114.3960	2.443	5	114.3960	5.968	5	114.3960	5.968	5	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6])2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6])2(CH3){1|N<2>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N){1|Ni<4>,1|C<3>}	116.7150	1.300	4	116.6448	0.947	8	116.6448	0.947	8	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6])2(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6])2(CH3){1|N<3>,2|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N){1|Co<5>,1|C<3>}	116.5745	0.712	4	116.6448	0.947	8	116.6448	0.947	8	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(O[6]B[6])(CH3)	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)	C[6](N[6]C[6,6])(O[6]B[6])(CH3){1|C<3>,1|N<3>,2|F<1>}	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C){1|B<4>,1|H<1>,2|C<3>}	120.3190	0.319	5	120.3190	0.102	5	120.3190	0.102	5	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(O[6]C[6,6])(CH3)	C(C[6]N[6]O[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)	C[6](N[6]C[6,6a])(O[6]C[6,6])(CH3){1|O<2>,3|C<3>}	C(C[6]N[6]O[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C){1|C<4>,1|H<1>,2|C<3>}	122.3470	0.000	1	122.3470	0.000	1	122.7915	0.395	2	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(O[6]C[6])(CH3)	C(C[6]N[6]O[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)	C[6](N[6]C[6,6a])(O[6]C[6])(CH3){1|C<4>,3|C<3>}	C(C[6]N[6]O[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C){1|C<4>,1|H<1>,2|C<3>}	123.2360	0.000	1	123.2360	0.000	1	122.7915	0.395	2	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	3:3:	N[6]-2:S[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(S[6]C[6])(CH3)	C(C[6]N[6]S[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]C)	C[6](N[6]C[6,6a])(S[6]C[6])(CH3){3|C<3>}	C(C[6]N[6]S[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]C){1|H<1>,3|C<3>}	121.0580	0.000	1	121.0580	0.000	1	121.0580	0.000	1	116.5017	8.845	37	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6])2(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]CC)(C[6]N[6]C)	C[6](N[6]C[6])2(CF3){1|F<1>,1|N<2>,2|C<4>}	C(C[6]N[6]2)(F)3	N[6](C[6]N[6]CC)(C[6]N[6]C){1|C<3>}	116.3620	0.000	1	116.3620	0.000	1	116.3620	0.000	1	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:Cl-1:Cl-1:Cl-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6])(O[6]C[6])(CCl3)	C(C[6]N[6]O[6])(Cl)3	N[6](C[6]C[6]CH)(C[6]O[6]C)	C[6](N[6]C[6])(O[6]C[6])(CCl3){1|C<4>,2|C<3>,2|H<1>}	C(C[6]N[6]O[6])(Cl)3	N[6](C[6]C[6]CH)(C[6]O[6]C){1|C<4>,2|H<1>}	120.6040	0.000	1	120.6040	0.000	1	120.4073	0.329	3	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:Cl-1:Cl-1:Cl-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6])(O[6]C[6])(CCl3)	C(C[6]N[6]O[6])(Cl)3	N[6](C[6]C[6a]C[6]C)(C[6]O[6]C)	C[6](N[6]C[6])(O[6]C[6])(CCl3){1|C<3>,2|C<4>,2|H<1>}	C(C[6]N[6]O[6])(Cl)3	N[6](C[6]C[6a]C[6]C)(C[6]O[6]C){1|C<4>,2|C<3>,2|H<1>}	120.3090	0.775	2	120.3090	0.601	2	120.4073	0.329	3	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-4:C[6]-3:	C[6](N[6]C[6,6])(O[6]C[6])(CH3)	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C)	C[6](N[6]C[6,6])(O[6]C[6])(CH3){1|C<3>,2|C<4>,2|H<1>}	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C){1|N<2>,1|O<2>,2|C<4>,2|H<1>}	122.4140	0.000	1	122.0615	0.249	2	122.0615	0.249	2	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-4:C[6]-3:	C[6](N[6]C[6,6])(O[6]C[6])(CH3)	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C)	C[6](N[6]C[6,6])(O[6]C[6])(CH3){2|H<1>,3|C<4>}	C(C[6]N[6]O[6])(H)3	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C){1|C<3>,1|C<4>,1|N<2>,1|O<2>,2|H<1>}	121.7090	0.000	1	122.0615	0.249	2	122.0615	0.249	2	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	O[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	N[6]-4:C[6]-3:	C[6](O[6]Si[6,6])(N[6]N[6])(CF3)	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C)	C[6](O[6]Si[6,6])(N[6]N[6])(CF3){1|Cl<1>,1|O<2>,4|C<4>}	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C){1|Si<5>,2|H<1>}	115.1930	0.000	1	114.7994	0.659	7	114.7905	0.566	8	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	O[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	N[6]-4:C[6]-3:	C[6](O[6]Si[6,6])(N[6]N[6])(CF3)	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C)	C[6](O[6]Si[6,6])(N[6]N[6])(CF3){2|Cl<1>,1|O<2>,4|C<4>}	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C){1|Si<6>,2|H<1>}	114.0115	0.313	2	114.7994	0.659	7	114.7905	0.566	8	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	O[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	N[6]-4:C[6]-3:	C[6](O[6]Si[6,6])(N[6]N[6])(CF3)	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C)	C[6](O[6]Si[6,6])(N[6]N[6])(CF3){2|O<2>,4|C<4>}	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C){1|Si<5>,2|H<1>}	115.0950	0.839	4	114.7994	0.659	7	114.7905	0.566	8	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:1:1:1:	4:3:	O[6]-2:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	N[6]-4:C[6]-3:	C[6](O[6]Si[6])(N[6]N[6])(CF3)	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C)	C[6](O[6]Si[6])(N[6]N[6])(CF3){1|Cl<1>,4|C<4>}	C(C[6]N[6]O[6])(F)3	N[6](N[6]C[6]CC)(C[6]O[6]C){1|Si<4>,2|H<1>}	114.7280	0.000	1	114.7280	0.000	1	114.7905	0.566	8	117.1451	10.008	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:2:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:S-2:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]S[6])(CHHS)	C(C[6]N[6]2)(SC)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]S[6])(CHHS){2|C<3>,2|O<1>}	C(C[6]N[6]2)(SC)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,1|S<4>,2|C<3>}	116.4140	0.000	1	116.4140	0.000	1	116.4140	0.000	1	116.4140	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:2:1:1:	4:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:S-2:H-1:H-1:	S[6]-4:C[6]-3:	C[6](N[6]C[6,6a])(N[6]S[6])(CHHS)	C(C[6]N[6]2)(SC)(H)2	N[6](S[6]C[6,6a]OO)(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]S[6])(CHHS){2|C<3>,2|O<1>}	C(C[6]N[6]2)(SC)(H)2	N[6](S[6]C[6,6a]OO)(C[6]N[6]C){2|C<3>}	117.2990	0.000	1	117.2990	0.000	1	117.2990	0.000	1	117.2990	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:3:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:H-1:	C[6]-3:N[6]-3:	C[6](N[6]N[6])2(CC[6]HH)	C(C[6]N[6]2)2(H)2	N[6](C[6]N[6]C)(N[6]C[6]C)	C[6](N[6]N[6])2(CC[6]HH){1|C<3>,2|C<4>}	C(C[6]N[6]2)2(H)2	N[6](C[6]N[6]C)(N[6]C[6]C){1|N<3>,1|O<1>}	116.2925	0.170	2	116.2925	0.029	2	116.2925	0.029	2	116.2925	0.029	2	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:1:1:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6])2(CCHH)	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6])2(CCHH){1|N<2>,2|N<3>}	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(C[6]N[6]N){2|C<3>}	116.2190	0.931	2	116.2190	0.866	2	116.2190	0.866	2	116.2190	0.866	2	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:3:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:C-4:N-3:H-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6])(O[6]C[6])(CCHN)	C(C[6]N[6]O[6])(CCHH)(NCH)(H)	N[6](C[6]C[6]CH)(C[6]O[6]C)	C[6](N[6]C[6])(O[6]C[6])(CCHN){1|C<3>,2|C<4>,2|H<1>}	C(C[6]N[6]O[6])(CCHH)(NCH)(H)	N[6](C[6]C[6]CH)(C[6]O[6]C){1|C<4>,2|H<1>}	125.4530	0.000	1	125.4530	0.000	1	125.4530	0.000	1	125.4530	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:1:	3:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:C-4:C-4:Br-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(O[6]C[6])(CBrCC)	C(C[6]N[6]O[6])(CHHN)(CH3)(Br)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)	C[6](N[6]C[6,6a])(O[6]C[6])(CBrCC){1|C<4>,3|C<3>}	C(C[6]N[6]O[6])(CHHN)(CH3)(Br)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C){1|C<4>,1|H<1>,2|C<3>}	120.1500	0.000	1	120.1500	0.000	1	120.1500	0.000	1	120.1500	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:1:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:C-4:C-4:H-1:	C[6,6]-4:C[6]-3:	C[6](N[6]C[6,6])(O[6]C[6])(CCCH)	C(C[6]N[6]O[6])(CH3)2(H)	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C)	C[6](N[6]C[6,6])(O[6]C[6])(CCCH){2|C<4>,3|H<1>}	C(C[6]N[6]O[6])(CH3)2(H)	N[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]C){1|C<3>,2|H<1>,3|C<4>}	123.1770	0.000	1	123.1770	0.000	1	123.1770	0.000	1	123.1770	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:3:	4:3:	N[6]-2:O[6]-2:C-4:	C[6]-3:C-4:C-4:N-3:	C[6]-4:C[6]-3:	C[6](N[6]C[6])(O[6]C[6])(CCCN)	C(C[6]N[6]O[6])(CH3)2(NCH)	N[6](C[6]C[6]HH)(C[6]O[6]C)	C[6](N[6]C[6])(O[6]C[6])(CCCN){1|C<4>,4|H<1>}	C(C[6]N[6]O[6])(CH3)2(NCH)	N[6](C[6]C[6]HH)(C[6]O[6]C){1|C<4>,2|H<1>}	122.2740	0.000	1	122.2740	0.000	1	122.2740	0.000	1	122.2740	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:4:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]N[6])(CC3)	C(C[6]N[6]2)(CH3)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]N[6])(CC3){3|C<3>}	C(C[6]N[6]2)(CH3)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,1|N<3>,2|C<3>}	117.2097	0.741	3	117.2097	0.549	3	117.2097	0.549	3	116.1742	1.679	6	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:4:	3:3:	N[6]-2:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	N[6]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]N[6])(CC3)	C(C[6]N[6]2)(CH3)3	N[6](N[6]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]N[6])(CC3){3|C<3>}	C(C[6]N[6]2)(CH3)3	N[6](N[6]C[6,6a]C[6a])(C[6]N[6]C){4|C<3>}	115.1387	0.656	3	115.1387	0.430	3	115.1387	0.430	3	116.1742	1.679	6	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:2:4:	3:4:4:4:	4:3:	O[6]-2:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	N[6]-4:C[6]-3:	C[6](O[6]Si[6,6])(N[6]N[6])(CC3)	C(C[6]N[6]O[6])(CH3)3	N[6](N[6]C[6]CC)(C[6]O[6]C)	C[6](O[6]Si[6,6])(N[6]N[6])(CC3){1|Cl<1>,1|O<2>,4|C<4>}	C(C[6]N[6]O[6])(CH3)3	N[6](N[6]C[6]CC)(C[6]O[6]C){1|Si<5>,2|H<1>}	117.4730	0.000	1	117.4730	0.000	1	117.4730	0.000	1	117.4730	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	116.5980	0.000	1	115.2650	3.250	5	115.2650	3.250	5	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:Br-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH)	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(Br)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	114.9318	1.895	4	115.2650	3.250	5	115.2650	3.250	5	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ru<9>,1|C<4>,1|N<2>,2|C<3>}	116.2050	0.000	1	116.2050	0.000	1	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){1|C<4>,3|C<3>}	112.0098	0.517	5	111.9252	0.257	6	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){2|C<3>,2|C<4>}	111.5020	0.000	1	111.9252	0.257	6	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	117.2130	0.000	1	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	117.0770	0.360	5	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	117.0610	0.000	1	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	117.2130	0.000	1	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	117.2230	0.000	1	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	117.5982	1.517	4	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	116.6040	0.304	2	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	117.4930	0.000	1	117.1993	0.603	16	115.7802	5.995	23	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]2)(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]2)(C[6]C[6]C){1|N<2>,2|C<3>,2|C<4>}	114.9840	0.000	1	114.9840	0.000	1	112.0252	2.412	26	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C){1|C<4>,3|C<3>}	111.3635	0.460	21	111.3635	0.212	21	112.0252	2.412	26	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C){1|H<1>,1|N<3>,2|C<3>}	115.0965	0.876	2	114.2487	2.540	3	112.0252	2.412	26	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	112.5530	0.000	1	114.2487	2.540	3	112.0252	2.412	26	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C){1|H<1>,3|C<3>}	116.2910	0.000	1	116.2910	0.000	1	112.0252	2.412	26	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C)	C[6](N[6]C[6,6])(C[6]N[6]C)(CH3){1|Co<6>,1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C){1|N<3>,2|C<3>,2|C<4>}	116.3880	0.000	1	116.3880	0.000	1	116.3880	0.000	1	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3){1|O<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,3|C<3>}	115.7600	0.000	1	115.7600	0.000	1	117.3010	5.017	4	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3){1|H<1>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	119.2015	0.588	2	119.2015	0.345	2	117.3010	5.017	4	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3){1|Re<6>,1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C){1|C<4>,1|N<3>,3|C<3>}	115.0410	0.000	1	115.0410	0.000	1	117.3010	5.017	4	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5a,6]-3:C[6]-3:	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C)	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C){1|C<3>,1|S<2>,3|N<2>}	114.7710	0.132	2	114.7710	0.017	2	114.7710	0.017	2	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-3:C-4:	C[6]-3:Br-1:F-1:F-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]C)(CBrFF)	C(C[6]N[6]2)(Br)(F)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]C[6]C)(CBrFF){3|C<3>}	C(C[6]N[6]2)(Br)(F)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|C<4>,1|H<1>,3|C<3>}	114.6430	0.000	1	114.6430	0.000	1	114.6430	0.000	1	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-3:C-4:	C[6]-3:Cl-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]O)(CClHH)	C(C[6]N[6]2)(Cl)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]C[6]O)(CClHH){3|C<3>}	C(C[6]N[6]2)(Cl)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,1|O<1>,3|C<3>}	119.9010	0.000	1	119.9010	0.000	1	119.9010	0.000	1	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:1:1:1:	3:3:	N[6]-2:N[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]H)(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]C[6]H)(CH3){1|H<1>,3|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|C<4>,2|C<3>,2|H<1>}	118.6020	0.000	1	118.6020	0.000	1	118.6020	0.000	1	114.3782	7.941	64	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CCHH){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){1|C<3>,3|C<4>}	113.5148	0.137	6	113.5148	0.019	6	113.9570	1.384	7	114.9444	8.986	8	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:1:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	116.6100	0.000	1	116.6100	0.000	1	113.9570	1.384	7	114.9444	8.986	8	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:1:1:	3:3:	N[6]-2:N[6]-3:C-4:	C[6]-3:C-4:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]H)(CCHH)	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]C[6]H)(CCHH){1|S<1>,2|C<3>}	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){2|H<1>,3|C<3>}	121.8560	0.000	1	121.8560	0.000	1	121.8560	0.000	1	114.9444	8.986	8	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:4:1:	3:3:	N[6]-2:N[6]-3:C-4:	C[6]-3:C-4:C-4:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]Pd)(CCCH)	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6,6a])(N[6]C[6]Pd)(CCCH){3|C<3>}	C(C[6]N[6]2)(CH3)2(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|Pd<4>,1|H<1>,3|C<3>}	117.4427	0.455	3	117.4427	0.207	3	117.4427	0.207	3	117.4427	0.207	3	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:4:4:	6:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	Nb[3,3,6]-6:C[6]-3:	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6])(C[6]C[6]C)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|C<4>,1|N<2>,4|N<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6])(C[6]C[6]C){1|H<1>,5|C<3>}	116.8560	3.371	2	116.8560	11.367	2	116.8560	11.367	2	116.8560	11.367	2	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	2:3:4:	3:4:4:4:	7:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C-4:C-4:C-4:	Nb[3,3,6]-7:C[6]-3:	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|Cl<1>,1|C<4>,5|N<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C){2|H<1>,5|C<3>}	115.6610	0.000	1	115.6610	0.000	1	115.6610	0.000	1	115.6610	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:	C[6](C[6]C[6]C)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6])	C[6](C[6]C[6]C)(N[6]N[6])(CH3){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]){1|C<3>,1|C<4>,1|O<1>}	114.9470	0.000	1	114.9470	0.000	1	114.9470	0.000	1	111.9457	6.756	3	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:2:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-2:	C[6](N[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6])	C[6](N[6]N[6]C)(N[6]N[6])(CH3){1|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6]){1|N<2>,2|C<3>}	110.4450	0.000	2	110.4450	0.000	2	110.4450	0.000	2	111.9457	6.756	3	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[5a,6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(N[6]N[6])(CH3)	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(N[6]C[6]H)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]N[6])(CH3){1|H<1>,1|N<3>,2|C<3>}	C(C[6]C[5a,6]N[6])(H)3	N[6](C[6]C[5a,6]C)(N[6]C[6]H){1|C<3>,1|C<4>,1|N<2>}	118.5250	0.000	1	118.5250	0.000	1	118.5250	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6,6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(CH3)	C(C[6]C[6,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(CH3){1|B<4>,1|H<1>,3|C<3>}	C(C[6]C[6,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C){1|H<1>,1|N<3>,3|C<3>}	118.1295	0.163	2	118.1295	0.027	2	118.1295	0.027	2	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6,6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CH3)	C(C[6]C[6,6]N[6])(H)3	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CH3){1|B<4>,1|H<1>,3|C<3>}	C(C[6]C[6,6]N[6])(H)3	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	116.7600	0.000	1	116.7600	0.000	1	116.7600	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6,6a]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5a,6]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[5a,6])(CH3)	C(C[6]C[6,6a]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]C)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[5a,6])(CH3){1|H<1>,2|C<3>,2|N<3>}	C(C[6]C[6,6a]N[6])(H)3	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]C){1|C<4>,1|N<2>,3|C<3>}	117.5120	0.000	1	117.5120	0.000	1	117.5120	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CF3){1|O<1>,4|C<3>}	C(C[6]C[6]N[6])(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	114.0700	0.000	1	114.0700	0.000	1	114.0700	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(CF3){1|C<3>,1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,1|C<4>,1|H<1>}	111.6210	0.000	1	111.6210	0.000	1	111.7845	0.053	2	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CF3)	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CF3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]C[6]N[6])(F)3	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	111.9480	0.000	1	111.9480	0.000	1	111.7845	0.053	2	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CH3){1|Ir<6>,4|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	115.0516	0.423	9	115.0516	0.179	9	115.0516	0.179	9	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6]O)(C[6]C[6]C)	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|H<1>}	111.5020	0.000	1	111.5020	0.000	1	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,1|C<4>,1|H<1>}	114.5530	0.000	1	112.3940	3.585	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|C<4>}	111.3145	0.422	2	112.3940	3.585	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]S[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]S[6]N){1|C<3>,1|C<4>}	111.3400	0.000	1	111.3400	0.000	1	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]Cl)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|Cl<1>,1|C<3>,1|H<1>}	116.1885	0.547	2	116.1885	0.299	2	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[5]N[6])(C[6]C[6]C){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	117.0700	0.530	4	117.0700	0.281	4	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]O){1|C<3>,2|H<1>}	115.8750	0.000	1	115.8750	0.000	1	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H){1|Cu<4>,1|C<3>,1|H<1>}	117.3230	0.000	1	117.4300	0.592	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H){1|Cu<4>,1|C<3>,1|H<1>}	116.7200	0.000	1	117.4300	0.592	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]H){1|Ru<6>,1|C<3>,1|H<1>}	118.2470	0.000	1	117.4300	0.592	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	116.0880	0.000	1	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	116.7108	0.634	15	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	116.3847	0.807	33	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|Co<6>,1|C<3>,1|H<1>}	116.6780	0.549	2	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	116.9986	0.423	5	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|Cu<5>,1|C<3>,1|H<1>}	116.9830	0.000	1	116.5400	0.539	57	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<3>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]O){1|H<1>,2|C<3>}	116.1835	0.433	2	116.1835	0.188	2	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|H<1>}	115.9420	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|H<1>,2|C<3>}	116.6130	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|H<1>}	115.5290	0.649	5	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Cd<6>,1|C<3>,1|H<1>}	117.1450	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Mn<6>,1|C<3>,1|H<1>}	116.6780	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Ni<6>,1|C<3>,1|H<1>}	116.4635	0.553	4	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Sn<5>,1|C<3>,1|H<1>}	116.6460	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Ag<5>,1|C<3>,1|H<1>}	116.0530	0.000	1	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]S){1|Cd<6>,1|C<3>,1|H<1>}	116.1013	0.478	3	116.1600	0.421	18	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]C[6]H)(N[6]C[6])(CH3){2|C<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|C<2>,1|H<1>}	118.8780	0.000	1	118.8780	0.000	1	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	115.4550	2.341	2	116.8533	4.636	4	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	118.2515	0.781	2	116.8533	4.636	4	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]N[6])(C[6]C[6]C){1|Ir<6>,1|H<1>,3|C<3>}	116.4450	0.808	2	116.4450	0.652	2	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]Se)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Se<1>,1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<3>}	116.8423	0.160	3	116.8423	0.025	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]I)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|Pd<4>,1|C<3>,1|I<1>}	115.6650	0.000	1	115.6650	0.000	1	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6]H)(C[6]C[6]C)	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	117.9682	0.237	4	117.9682	0.056	4	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Al<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	117.1861	0.243	8	116.8367	1.629	14	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Al<5>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	117.0600	0.018	2	116.8367	1.629	14	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	118.0820	0.181	2	116.8367	1.629	14	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Zn<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	113.9705	0.354	2	116.8367	1.629	14	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<4>,1|H<1>,1|N<2>}	117.5525	0.284	2	117.7580	0.167	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]N[6]N){1|Cu<4>,1|C<4>,1|N<2>}	118.1690	0.000	1	117.7580	0.167	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|C<4>,1|H<1>,1|N<3>}	118.2295	0.327	6	117.7393	0.568	21	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	118.0809	0.628	8	117.7393	0.568	21	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	116.9862	0.385	4	117.7393	0.568	21	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	116.5995	0.484	2	117.7393	0.568	21	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<2>,2|C<3>}	117.3580	0.000	1	117.7393	0.568	21	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Eu<13>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	118.1975	0.887	2	118.0067	0.503	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pt<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	117.6250	0.000	1	118.0067	0.503	3	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	118.4137	0.324	4	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cd<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.5230	0.710	2	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.0860	0.401	3	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	118.3250	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	117.2535	0.671	2	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	117.7860	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	118.3070	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	116.7660	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.3860	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	118.4760	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Pt<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	118.3730	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Re<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.3365	0.315	2	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Sn<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.2630	0.614	2	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	118.0580	0.000	1	118.1366	0.303	23	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|C<4>,1|H<1>,1|N<3>}	118.0298	0.406	6	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|W<6>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	118.0855	0.878	4	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	118.2500	0.498	4	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<5>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	116.8845	0.364	2	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Mn<6>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	118.1870	0.000	1	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	117.3992	0.308	4	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<4>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	118.2730	0.224	4	117.9266	0.369	25	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	117.2915	0.069	2	117.2915	0.005	2	117.0078	1.747	198	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	117.2580	0.422	3	117.2580	0.178	3	117.3172	0.257	6	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]S)	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|S<4>,2|C<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]S){1|C<3>,3|H<1>}	117.6380	0.000	1	117.6380	0.000	1	117.3172	0.257	6	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<4>,1|N<2>,1|N<3>}	117.2455	0.897	2	117.2455	0.805	2	117.3172	0.257	6	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Cu)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Cu<4>,1|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Cu)(C[6]C[6]C){1|C<4>,1|N<2>,1|N<3>}	116.9150	0.000	1	116.9150	0.000	1	116.8015	0.049	4	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Eu)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Eu<13>,1|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Eu)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	116.8495	0.293	2	116.8495	0.086	2	116.8015	0.049	4	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Pt)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Pt<4>,1|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6]Pt)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	116.5920	0.000	1	116.5920	0.000	1	116.8015	0.049	4	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6,6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6,6]C[6,6a]C[6,6])(N[6]C[6,6a])(CH3)	C(C[6]N[6,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C)	C[6](N[6,6]C[6,6a]C[6,6])(N[6]C[6,6a])(CH3){1|H<1>,1|N<3>,4|C<3>}	C(C[6]N[6,6]N[6])(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C){1|C<4>,1|H<1>,3|C<3>}	117.5190	0.000	1	117.5190	0.000	1	117.5190	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:F-1:F-1:F-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CF3)	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CF3){5|C<3>}	C(C[6]N[6]2)(F)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,4|C<3>}	114.5480	0.000	1	114.5480	0.000	1	114.5480	0.000	1	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(CH3){1|N<2>,4|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,4|C<3>}	118.9865	0.046	2	118.9865	0.002	2	119.4137	0.244	4	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]N[6a]C[6])(N[6]C[6,6a])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)	C[6](N[6]N[6a]C[6])(N[6]C[6,6a])(CH3){1|S<1>,4|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C){1|H<1>,1|N<3>,3|C<3>}	119.8410	0.000	2	119.8410	0.000	2	119.4137	0.244	4	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]C[6])(CH3){2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|C<2>,1|C<4>,1|O<2>}	119.0160	0.000	1	119.0160	0.000	1	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]C)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,2|C<4>}	118.2705	1.414	4	118.2705	1.999	4	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Fe)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[5a]C[6])(C[6]N[6]C)	C[6](N[6]C[6]Fe)(N[6]C[6])(CH3){1|C<3>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[5a]C[6])(C[6]N[6]C){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	117.0420	0.683	2	117.0420	0.467	2	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|Cl<1>,1|C<3>,1|H<1>}	120.1965	0.203	2	120.1965	0.041	2	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<2>,1|C<4>,1|H<1>}	117.5660	0.000	1	119.6130	0.688	13	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C){1|Cl<1>,1|C<3>,1|H<1>}	119.8390	0.396	2	119.6130	0.688	13	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,1|C<4>,1|H<1>}	119.6369	0.488	9	119.6130	0.688	13	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,2|H<1>}	120.9930	0.000	1	119.6130	0.688	13	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|N<2>,2|N<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	120.7984	0.503	10	120.7933	0.211	12	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	120.6180	0.000	1	120.7933	0.211	12	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N)	C[6](N[6]C[6]H)(N[6]C[6])(CH3){3|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	120.9180	0.000	1	120.7933	0.211	12	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ni)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](N[6]C[6]Ni)(N[6]C[6])(CH3){1|H<1>,2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]H)(C[6]N[6]C){1|Ni<5>,1|C<3>,1|H<1>}	118.4210	0.434	2	118.4210	0.188	2	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(N[6]C[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](N[6]C[6]Pd)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<2>}	C(C[6]N[6]2)(H)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|Pd<4>,1|C<3>,1|I<1>}	115.5110	0.000	1	115.5110	0.000	1	119.5518	2.083	37	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](N[6]N[6]C)(N[6]N[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6]C)	C[6](N[6]N[6]C)(N[6]N[6])(CH3){2|C<3>}	C(C[6]N[6]2)(H)3	N[6](C[6]N[6]C)(N[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	117.8503	0.826	12	117.8503	0.682	12	117.8503	0.682	12	117.3148	2.813	280	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]MoP)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Mo<7>,1|C<4>,1|H<1>,1|P<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]MoP)(C[6]C[6]C){1|C<3>,2|H<1>}	117.4430	0.000	1	117.4430	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]CuN)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Cu<6>,1|C<4>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]CuN)(C[6]C[6]C){1|C<3>,1|H<1>}	114.5880	0.000	1	114.5880	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]EuS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Eu<12>,1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]EuS)(C[6]C[6]C){1|C<3>,1|H<1>}	115.6750	0.000	1	115.6750	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]GdN)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Gd<15>,1|C<4>,1|N<3>,1|N<4>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]GdN)(C[6]C[6]C){1|C<3>,1|H<1>}	116.9460	0.197	2	116.9460	0.039	2	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]PrS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Pr<12>,1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]PrS)(C[6]C[6]C){1|C<3>,1|H<1>}	113.5430	0.000	1	113.5430	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]RhS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Rh<5>,1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]RhS)(C[6]C[6]C){1|C<3>,1|H<1>}	116.6900	0.000	1	116.6900	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]SmS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Sm<12>,1|C<4>,1|N<3>,1|S<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]N[6]SmS)(C[6]C[6]C){1|C<3>,1|H<1>}	113.3810	0.000	1	113.3810	0.000	1	115.6515	2.630	8	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6]C)(N[6]S[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6]C)(N[6]S[6])(CH3){1|H<1>,1|N<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C){1|C<4>,2|C<3>}	114.6760	0.000	1	114.6760	0.000	1	114.7903	0.332	4	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C){1|C<4>,2|C<3>}	114.5090	0.605	2	114.8283	0.489	3	114.7903	0.332	4	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	C(C[6]C[6]N[6])(H)3	N[6](S[6]N[6]OO)(C[6]C[6]C){1|H<1>,2|C<3>}	115.4670	0.000	1	114.8283	0.489	3	114.7903	0.332	4	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	B[6]-4:C[6]-3:	C[6](N[6]C[6]C)(N[6]B[6])(CH3)	C(C[6]N[6]2)(H)3	N[6](B[6]C[6a]2N[6])(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]B[6])(CH3){1|H<1>,1|N<3>,2|C<3>}	C(C[6]N[6]2)(H)3	N[6](B[6]C[6a]2N[6])(C[6]N[6]C){2|C<4>,5|C<3>}	121.7600	0.000	1	121.7600	0.000	1	121.7600	0.000	1	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:1:1:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	P[6,6]-4:C[6]-3:	C[6](N[6]P[6,6]C)(N[6]P[6,6])(CH3)	C(C[6]N[6]2)(H)3	N[6](P[6,6]C[6,6a]S[6,6]S)(C[6]N[6]C)	C[6](N[6]P[6,6]C)(N[6]P[6,6])(CH3){1|S<2>,2|C<3>,2|S<1>}	C(C[6]N[6]2)(H)3	N[6](P[6,6]C[6,6a]S[6,6]S)(C[6]N[6]C){1|C<4>,1|P<4>,2|C<3>}	116.3350	0.000	1	116.3350	0.000	1	116.3350	0.000	1	115.8906	4.566	14	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:2:1:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:S-2:H-1:H-1:	S[6]-4:C[6]-3:	C[6](N[6]C[6,6a]H)(N[6]S[6])(CHHS)	C(C[6]N[6]2)(SC)(H)2	N[6](S[6]C[6,6a]OO)(C[6]N[6]C)	C[6](N[6]C[6,6a]H)(N[6]S[6])(CHHS){2|C<3>,2|O<1>}	C(C[6]N[6]2)(SC)(H)2	N[6](S[6]C[6,6a]OO)(C[6]N[6]C){1|H<1>,2|C<3>}	116.1035	0.913	2	116.1035	0.833	2	116.1035	0.833	2	116.1035	0.833	2	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:1:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,2|H<1>}	114.8410	0.000	1	114.8410	0.000	1	114.8410	0.000	1	114.8410	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CHHN)	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CHHN){1|Cd<5>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(NC[6a]C)(H)2	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	117.1680	0.000	1	117.1680	0.000	1	117.1680	0.000	1	117.7747	0.545	3	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:H-1:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Zn)(N[6]C[6])(CHHN)	C(C[6]N[6]2)(NCH)(H)2	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](N[6]C[6]Zn)(N[6]C[6])(CHHN){1|H<1>,2|C<3>}	C(C[6]N[6]2)(NCH)(H)2	N[6](C[6]C[6]H)(C[6]N[6]C){1|Zn<5>,1|C<3>,1|H<1>}	118.0780	0.734	2	118.0780	0.539	2	118.0780	0.539	2	117.7747	0.545	3	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:Cl-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CClNN)	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CClNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C){1|C<4>,1|H<1>,1|N<3>}	116.0880	0.000	1	116.0880	0.000	1	117.0495	1.849	2	118.1555	2.329	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:Cl-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]N)(N[6]C[6])(CClNN)	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]N)(N[6]C[6])(CClNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(Cl)	N[6](C[6]N[6]HH)(C[6]N[6]C){1|C<4>,1|N<2>,1|N<3>}	118.0110	0.000	1	118.0110	0.000	1	117.0495	1.849	2	118.1555	2.329	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:H-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]N)(N[6]C[6])(CHNN)	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]N)(N[6]C[6])(CHNN){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)2(H)	N[6](C[6]N[6]HH)(C[6]N[6]C){1|C<4>,2|N<3>}	119.2615	0.496	2	119.2615	0.246	2	119.2615	0.246	2	118.1555	2.329	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:3:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:N-3:	C[6]-4:C[6]-3:	C[6](N[6]C[6]H)(N[6]C[6])(CN3)	C(C[6]N[6]2)(NOO)3	N[6](C[6]N[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]H)(N[6]C[6])(CN3){1|N<3>,4|H<1>}	C(C[6]N[6]2)(NOO)3	N[6](C[6]N[6]HH)(C[6]N[6]C){1|C<4>,1|H<1>,1|N<3>}	114.2740	0.580	2	114.2740	0.336	2	114.0190	1.970	4	114.0190	1.970	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:3:3:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:N-3:N-3:N-3:	C[6]-4:C[6]-3:	C[6](N[6]C[6]N)(N[6]C[6])(CN3)	C(C[6]N[6]2)(NOO)3	N[6](C[6]C[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]N)(N[6]C[6])(CN3){1|C<4>,4|H<1>}	C(C[6]N[6]2)(NOO)3	N[6](C[6]C[6]HH)(C[6]N[6]C){1|C<4>,1|N<3>,2|H<1>}	113.7640	2.305	2	113.7640	5.314	2	114.0190	1.970	4	114.0190	1.970	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:3:4:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:P-3:C-4:H-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]C)(N[6]C[6])(CCHP)	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]C[6])(CCHP){1|C<4>,4|H<1>}	C(C[6]N[6]2)(PC[6a]2)(CCHH)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C){2|C<4>,2|H<1>}	117.0050	0.000	1	117.0050	0.000	1	117.0050	0.000	1	117.0050	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	2:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	O[6]-2:C[6]-3:	C[6](C[6]C[6,6]C)(N[6]O[6])(CCHH)	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](O[6]C[6,6])(C[6]C[6]C)	C[6](C[6]C[6,6]C)(N[6]O[6])(CCHH){1|H<1>,2|C<4>}	C(C[6]C[6]N[6])(CCHH)(H)2	N[6](O[6]C[6,6])(C[6]C[6]C){1|C<4>,1|O<2>,2|C<3>}	113.5000	0.000	1	113.5000	0.000	1	113.5000	0.000	1	113.5000	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(NCCH)(H)2	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,2|H<1>}	116.5180	0.000	1	116.5180	0.000	1	116.5180	0.000	1	116.5180	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:3:	C[6,6a]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]N[6])(CCHH)	C(C[6]C[6,6a]N[6])(CH3)(H)2	N[6](N[6]C[6a]C[6])(C[6]C[6,6a]C)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]N[6])(CCHH){1|C<4>,1|H<1>,3|C<3>}	C(C[6]C[6,6a]N[6])(CH3)(H)2	N[6](N[6]C[6a]C[6])(C[6]C[6,6a]C){2|C<4>,4|C<3>}	115.4845	0.214	2	115.4845	0.046	2	115.4845	0.046	2	117.9766	6.092	12	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]S)	C[6](C[6]N[6]C)(N[6]C[6])(CCHH){1|C<3>,1|H<1>,1|S<2>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]S){1|C<4>,1|N<3>,1|S<2>}	115.0790	0.474	2	115.0790	0.224	2	116.9272	2.219	6	117.9766	6.092	12	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CCHH)	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CCHH){1|Cu<5>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	117.8512	0.455	4	117.8512	0.207	4	116.9272	2.219	6	117.9766	6.092	12	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	C(C[6]C[6]N[6])(NH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(NH3)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>}	121.8960	0.283	2	121.8960	0.080	2	121.8960	0.080	2	117.9766	6.092	12	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:N[6]-3:	C[6](N[6]N[6]C)(N[6]N[6])(CCHH)	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(N[6]C[6]C)	C[6](N[6]N[6]C)(N[6]N[6])(CCHH){2|C<3>}	C(C[6]N[6]2)(CH3)(H)2	N[6](C[6]N[6]C)(N[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	119.6975	0.350	2	119.6975	0.123	2	119.6975	0.123	2	117.9766	6.092	12	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:4:	C[5a,6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-4:	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6])(CCHH)	C(C[6]C[5a,6]N[6])(CCCO)(H)2	N[6](C[6]C[5a,6]C)(C[6]C[6]HH)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6])(CCHH){1|C<4>,2|C<3>,3|H<1>}	C(C[6]C[5a,6]N[6])(CCCO)(H)2	N[6](C[6]C[5a,6]C)(C[6]C[6]HH){1|C<3>,1|N<3>,2|H<1>}	118.9770	0.000	1	118.9770	0.000	1	118.9770	0.000	1	118.1097	0.403	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:4:	C[6,6a]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:C[6]-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6])(CCHH)	C(C[6]C[6,6a]N[6])(CC[6a]HH)(H)2	N[6](C[6]C[6,6a]C)(C[6]C[6]HH)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6])(CCHH){1|C<4>,2|C<3>,3|H<1>}	C(C[6]C[6,6a]N[6])(CC[6a]HH)(H)2	N[6](C[6]C[6,6a]C)(C[6]C[6]HH){2|C<3>,2|H<1>}	118.1090	0.000	1	118.1090	0.000	1	118.1090	0.000	1	118.1097	0.403	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	3:4:	C[6,6a]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-3:S[6]-4:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]S[6])(CCHH)	C(C[6]C[6,6a]N[6])(CCHH)(H)2	N[6](C[6]C[6,6a]C)(S[6]O[6]OO)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]S[6])(CCHH){1|H<1>,1|O<2>,2|C<3>,2|O<1>}	C(C[6]C[6,6a]N[6])(CCHH)(H)2	N[6](C[6]C[6,6a]C)(S[6]O[6]OO){2|C<3>}	117.6765	0.284	2	117.6765	0.080	2	117.6765	0.080	2	118.1097	0.403	4	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:1:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:H-1:H-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]C)(N[6]C[6])(CCHH)	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]C[6])(CCHH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(H)2	N[6](C[6]C[6]HH)(C[6]N[6]C){2|C<4>,2|H<1>}	117.2706	0.425	5	117.2706	0.181	5	117.2706	0.181	5	117.2706	0.181	5	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:2:1:	4:3:	N[6]-3:N[6]-2:C-4:	C[6]-3:C-4:As-2:H-1:	C[6]-4:C[6]-3:	C[6](N[6]C[6]C)(N[6]C[6])(CAsCH)	C(C[6]N[6]2)(CCHH)(AsN)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C)	C[6](N[6]C[6]C)(N[6]C[6])(CAsCH){1|C<4>,4|H<1>}	C(C[6]N[6]2)(CCHH)(AsN)(H)	N[6](C[6]C[6]HH)(C[6]N[6]C){2|C<4>,2|H<1>}	108.6440	0.000	1	108.6440	0.000	1	108.6440	0.000	1	108.6440	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:3:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:N-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CCHN)	C(C[6]C[6]N[6])(CCHH)(NCH)(H)	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CCHN){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CCHH)(NCH)(H)	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,1|H<1>,1|O<2>}	117.6150	0.000	1	117.6150	0.000	1	117.6150	0.000	1	117.6150	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[5,6]O)(C[6]C[6]C)	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH){1|C<3>,1|C<4>,1|O<2>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[5,6]O)(C[6]C[6]C){1|N<3>,1|O<2>,2|C<4>}	114.5685	0.090	2	114.5685	0.008	2	115.5557	1.854	6	115.4276	1.625	10	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CCCH){1|C<3>,1|N<3>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pd<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	116.0493	1.454	4	116.0493	2.113	4	115.5557	1.854	6	115.4276	1.625	10	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:H-1:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CCCH)	C(C[6]C[6]N[6])(CH3)2(H)	N[6](N[6]C[6]Pd)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CCCH){1|Pd<4>,1|C<3>}	C(C[6]C[6]N[6])(CH3)2(H)	N[6](N[6]C[6]Pd)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	115.2355	1.305	4	115.2355	1.703	4	115.2355	1.703	4	115.4276	1.625	10	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CC3){1|N<3>,2|C<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(C[6]N[6]C){1|Fe<5>,1|C<3>,1|H<1>}	117.1180	0.000	1	117.1180	0.000	1	117.1180	0.000	1	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<1>}	116.9215	1.051	2	116.6600	1.011	21	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	116.5755	1.221	13	116.6600	1.011	21	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	116.7562	0.433	6	116.6600	1.011	21	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,1|C<4>,1|H<1>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<3>,1|H<1>,1|S<2>}	115.9513	1.295	3	116.5874	1.601	5	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<3>,1|H<1>,1|S<2>}	117.5415	0.132	2	116.5874	1.601	5	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	C[6]-3:N[6]-3:	C[6](C[6]N[6]O)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]O)(N[6]N[6])(CC3){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(CH3)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>}	118.0880	0.000	1	118.0880	0.000	1	116.6995	1.102	27	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](N[6]C[6]Re)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|Re<6>,1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(CH3)3	N[6](N[6]C[6]Re)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	118.3700	0.000	1	118.3700	0.000	1	118.3700	0.000	1	116.7715	1.123	29	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:2:4:	3:4:4:4:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C-4:C-4:C-4:	Si[6]-4:C[6]-3:	C[6](C[6]C[6]C)(N[6]Si[6])(CC3)	C(C[6]C[6]N[6])(CH3)3	N[6](Si[6]C[6]CC)(C[6]C[6]C)	C[6](C[6]C[6]C)(N[6]Si[6])(CC3){1|C<3>,3|C<4>}	C(C[6]C[6]N[6])(CH3)3	N[6](Si[6]C[6]CC)(C[6]C[6]C){1|C<2>,1|O<2>,2|C<3>}	119.7010	0.000	1	119.7010	0.000	1	119.7010	0.000	1	119.7010	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:4:2:	3:3:1:1:	3:3:	C[6]-3:C-4:N[6]-2:	C[6]-3:C[6a]-3:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]N[6]O)(CC[6a]HH)(N[6]N[6])	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]O)(CC[6a]HH)(N[6]N[6]){1|C<3>,1|H<1>,1|N<3>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(H)2	N[6](C[6]C[6]C)(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>}	118.8800	0.000	1	118.8800	0.000	1	118.8800	0.000	1	118.8800	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	3:4:2:	3:3:4:1:	3:3:	C[6]-3:C-4:N[6]-2:	C[6]-3:C[6a]-3:C-4:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6])	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CCHH)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6]){1|C<3>,1|H<1>}	C(C[6]C[6]N[6])(C[6a]C[6a]2)(CCHH)(H)	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>}	115.8950	0.000	1	115.8950	0.000	1	115.8950	0.000	1	115.8950	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[5,6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(N[6]C[6,6a])(CH3)	C(C[6]C[5,6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]C)	C[6](C[5,6]C[5]N[5]O[6])(N[6]C[6,6a])(CH3){3|C<4>,4|C<3>}	C(C[6]C[5,6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]C){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	118.2150	0.000	1	118.2150	0.000	1	119.3160	0.916	3	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[5,6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[5,6]N[5]O[6]S[5])(N[6]C[6,6a])(CH3)	C(C[6]C[5,6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]C)	C[6](C[5,6]N[5]O[6]S[5])(N[6]C[6,6a])(CH3){1|C<4>,4|C<3>}	C(C[6]C[5,6]N[6])(H)3	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]C){1|N<3>,1|O<2>,1|S<2>,3|C<3>}	119.8665	0.115	2	119.8665	0.013	2	119.3160	0.916	3	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]CH)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]C)	C[6](C[6]C[6]CH)(N[6]N[6])(CH3){1|C<3>,1|C<4>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	116.3490	0.000	1	116.3490	0.000	1	117.4970	2.763	4	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]N[6]HH)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]HH)(N[6]N[6])(CH3){1|C<3>,1|H<1>,1|N<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|N<3>,1|O<1>,2|H<1>}	118.9200	0.197	2	118.9200	0.039	2	117.4970	2.763	4	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:N[6]-3:	C[6](C[6]Si[6,6]HH)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]Si[6,6]HH)(N[6]N[6])(CH3){1|C<4>,1|H<1>,2|N<3>}	C(C[6]C[6]N[6])(H)3	N[6](C[6]C[6]C)(N[6]C[6]H){1|Si<4>,2|C<4>,2|H<1>}	115.7990	0.000	1	115.7990	0.000	1	117.4970	2.763	4	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:	C[6](C[6]S[6]HH)(N[6]N[5,6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)	C[6](C[6]S[6]HH)(N[6]N[5,6])(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[5,6]C[5,6]C[5])(C[6]C[6]C){1|C<4>,1|N<2>,1|N<3>,1|S<2>,2|H<1>}	117.0800	0.000	1	115.7510	3.532	2	115.7510	3.532	2	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:	C[6](C[6]S[6]HH)(N[6]N[5,6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)	C[6](C[6]S[6]HH)(N[6]N[5,6])(CH3){2|C<3>}	C(C[6]C[6]N[6])(H)3	N[6](N[5,6]C[5,6]C[5])(C[6]C[6]C){1|N<2>,1|N<3>,1|S<2>,3|H<1>}	114.4220	0.000	1	115.7510	3.532	2	115.7510	3.532	2	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]CC)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]C[6]CC)(N[6]N[6])(CH3){1|C<3>,1|C<4>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6a]C[6])(C[6]C[6]C){1|H<1>,2|C<3>,4|C<4>}	114.7260	0.000	1	114.7260	0.000	1	116.2100	4.405	2	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]HH)(N[6]N[6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]C[6]HH)(N[6]N[6])(CH3){2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(H)3	N[6](N[6]C[6a]C[6])(C[6]C[6]C){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	117.6940	0.000	1	117.6940	0.000	1	116.2100	4.405	2	117.4416	3.736	11	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:1:1:1:	4:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:H-1:H-1:H-1:	C[5,6]-4:C[6]-3:	C[6](C[6]C[5,6]HH)(N[6]C[5,6])(CH3)	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]O[5,6]C[5]N)(C[6]C[6]C)	C[6](C[6]C[5,6]HH)(N[6]C[5,6])(CH3){1|N<3>,2|C<4>,2|O<2>}	C(C[6]C[6]N[6])(H)3	N[6](C[5,6]O[5,6]C[5]N)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	119.3940	0.000	1	119.3940	0.000	1	119.3940	0.000	1	119.3940	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:2:1:1:	3:2:	C[6]-4:N[6]-2:C-4:	C[6]-3:O-2:H-1:H-1:	C[6]-3:O[6]-2:	C[6](C[6]C[6a]C[6]H)(N[6]O[6])(CHHO)	C(C[6]C[6]N[6])(ON)(H)2	N[6](C[6]C[6]C)(O[6]C[6])	C[6](C[6]C[6a]C[6]H)(N[6]O[6])(CHHO){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(ON)(H)2	N[6](C[6]C[6]C)(O[6]C[6]){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	115.2330	0.000	1	115.2330	0.000	1	115.2330	0.000	1	115.2330	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:4:1:1:	3:3:	C[6]-4:N[6]-2:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]HH)(N[6]C[6])(CHHN)	C(C[6]C[6]N[6])(NMnCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]HH)(N[6]C[6])(CHHN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(NMnCC)(H)2	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,3|H<1>}	117.8040	0.000	1	117.8040	0.000	1	117.8040	0.000	1	117.8040	0.000	1	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	3:4:2:1:	3:2:	C[6]-4:N[6]-2:C-4:	C[6]-3:C-4:O-2:H-1:	C[6]-3:O[6]-2:	C[6](C[6]C[6a]C[6]H)(N[6]O[6])(CCHO)	C(C[6]C[6]N[6])(CH3)(OC)(H)	N[6](C[6]C[6]C)(O[6]C[6])	C[6](C[6]C[6a]C[6]H)(N[6]O[6])(CCHO){1|C<4>,2|C<3>,2|H<1>}	C(C[6]C[6]N[6])(CH3)(OC)(H)	N[6](C[6]C[6]C)(O[6]C[6]){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	116.4095	0.595	2	116.4095	0.354	2	116.4095	0.354	2	116.4095	0.354	2	116.6934	5.543	550	116.6934	5.543	550
762	490	914	0:SP2_SP2_SP3	C[6]	C	N[6]	4:2:4:	4:3:4:1:	4:3:	C[6]-4:N[6]-2:C-4:	C[5]-4:C[6]-3:C-4:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]HH)(N[6]C[6])(CC[5]CH)	C(C[5]C[5,6]C[5]H)(C[6]C[6]N[6])(CH3)(H)	N[6](C[6]C[6]HH)(C[6]C[6]C)	C[6](C[6]C[6]HH)(N[6]C[6])(CC[5]CH){1|C<4>,4|H<1>}	C(C[5]C[5,6]C[5]H)(C[6]C[6]N[6])(CH3)(H)	N[6](C[6]C[6]HH)(C[6]C[6]C){2|C<4>,3|H<1>}	116.2410	0.000	1	116.2410	0.000	1	116.2410	0.000	1	116.2410	0.000	1	116.6934	5.543	550	116.6934	5.543	550