762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	3:4:4:	3:1:1:1:	3:3:1:1:	C[6]-3:S[6]-4:C-4:	C[6]-3:H-1:H-1:H-1:	C[6]-3:C[6]-3:O-1:O-1:	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(CH3)	C(C[6]C[6]S[6])(H)3	S[6](C[6]C[6]C)(C[6]C[6]H)(O)2	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(CH3){2|H<1>,3|C<3>}	C(C[6]C[6]S[6])(H)3	S[6](C[6]C[6]C)(C[6]C[6]H)(O)2{1|N<3>,2|C<3>}	113.1395	0.739	2	113.1395	0.546	2	113.1395	0.546	2	113.1395	0.546	2	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	3:4:4:	3:3:3:1:	2:3:1:1:	C[6]-3:C-4:S[6]-4:	C[6]-3:C[6]-3:C[6a]-3:H-1:	O[6]-2:C[6]-3:O-1:O-1:	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]O[6]OO)	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](O[6]C[6,6a])(C[6]C[6]C)(O)2	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]O[6]OO){2|C<3>}	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](O[6]C[6,6a])(C[6]C[6]C)(O)2{1|O<1>,2|C<3>}	115.6250	0.000	1	115.8970	0.148	2	115.8970	0.148	2	115.8970	0.148	2	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	3:4:4:	3:3:3:1:	2:3:1:1:	C[6]-3:C-4:S[6]-4:	C[6]-3:C[6]-3:C[6a]-3:H-1:	O[6]-2:C[6]-3:O-1:O-1:	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]O[6]OO)	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](O[6]C[6,6a])(C[6]C[6]C)(O)2	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]O[6]OO){2|C<3>}	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](O[6]C[6,6a])(C[6]C[6]C)(O)2{1|O<2>,2|C<3>}	116.1690	0.000	1	115.8970	0.148	2	115.8970	0.148	2	115.8970	0.148	2	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	3:4:4:	3:3:3:1:	3:3:1:1:	C[6]-3:C-4:S[6]-4:	C[6]-3:C[6]-3:C[6a]-3:H-1:	N[6]-3:C[6]-3:O-1:O-1:	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]N[6]OO)	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](N[6]C[6,6a]C)(C[6]C[6]C)(O)2	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]N[6]OO){1|C<4>,2|C<3>}	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](N[6]C[6,6a]C)(C[6]C[6]C)(O)2{1|O<1>,2|C<3>}	113.4610	0.000	1	115.1285	5.561	2	115.1285	5.561	2	115.1285	5.561	2	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	3:4:4:	3:3:3:1:	3:3:1:1:	C[6]-3:C-4:S[6]-4:	C[6]-3:C[6]-3:C[6a]-3:H-1:	N[6]-3:C[6]-3:O-1:O-1:	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]N[6]OO)	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](N[6]C[6,6a]C)(C[6]C[6]C)(O)2	C[6](C[6]C[6,6a]O)(CC[6a]C[6]H)(S[6]N[6]OO){1|C<4>,2|C<3>}	C(C[6]C[6]S[6])2(C[6a]C[6a]2)(H)	S[6](N[6]C[6,6a]C)(C[6]C[6]C)(O)2{1|O<2>,2|C<3>}	116.7960	0.000	1	115.1285	5.561	2	115.1285	5.561	2	115.1285	5.561	2	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	4:3:4:	3:1:1:1:	3:3:1:1:	S[6]-4:C[6]-3:C-4:	C[6]-3:H-1:H-1:H-1:	N[5,6]-3:C[6]-3:O-1:O-1:	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3)	C(C[6]C[6]S[6])(H)3	S[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O)2	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>}	C(C[6]C[6]S[6])(H)3	S[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O)2{1|C<4>,1|N<2>,1|S<2>,3|H<1>}	114.7730	0.000	1	114.7730	0.000	1	114.7730	0.000	1	114.7730	0.000	1	115.8552	6.821	9	115.8552	6.821	9
762	490	961	0:SP2_SP3_SP3	C[6]	C	S[6]	4:4:4:	3:4:1:1:	4:3:1:1:	S[6]-4:S[6]-4:C-4:	C[6]-3:N-4:H-1:H-1:	C[6]-4:C[6]-3:O-1:O-1:	C[6](S[6]C[6]OO)2(CHHN)	C(C[6]S[6]2)(NCCH)(H)2	S[6](C[6]C[6]FF)(C[6]S[6]C)(O)2	C[6](S[6]C[6]OO)2(CHHN){1|C<4>,4|F<1>}	C(C[6]S[6]2)(NCCH)(H)2	S[6](C[6]C[6]FF)(C[6]S[6]C)(O)2{1|C<4>,2|F<1>,2|O<1>}	119.7970	0.509	2	119.7970	0.259	2	119.7970	0.259	2	119.7970	0.259	2	115.8552	6.821	9	115.8552	6.821	9
762	542	542	0:SP2_SP2_SP2	C[6]	N[5,6]	N[5]	3:3:3:	3:3:4:	3:3:3:	N[5,6]-3:C[6]-3:N[5]-3:	C[5,6]-3:C[6]-3:C[5]-4:	C[6]-3:C[5]-3:C[5]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Ir)(N[5]C[5]2)	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]N[5])(C[5]C[5]HH)	N[5](C[6]N[5,6]C[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Ir)(N[5]C[5]2){1|C<4>,1|N<3>,1|O<2>,2|C<3>,4|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]N[5])(C[5]C[5]HH){1|Ir<8>,3|C<3>,3|H<1>}	N[5](C[6]N[5,6]C[6])(C[5]N[5]Ir)(C[5]C[5]H){1|H<1>,2|C<3>,2|C<4>}	122.4740	0.000	1	122.4740	0.000	1	122.4740	0.000	1	122.4740	0.000	1	122.4740	0.000	1	122.4740	0.000	1
762	542	542	6:SP2_SP2_SP2	C[6]	N[5,6]	N[5,6]	3:3:1:	5:3:3:	3:3:3:	N[5,6]-3:N[5,6]-3:O-1:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](Si[5,6]C[6a]N[5a]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){1|N<3>,3|O<2>,5|C<3>}	N[5,6](Si[5,6]C[6a]N[5a]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O){1|H<1>,8|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O){1|Si<5>,1|H<1>,3|C<3>}	115.5555	0.001	2	115.5555	0.000	2	115.5555	0.000	2	115.5555	0.000	2	115.0713	0.703	3	115.0713	0.703	3
762	542	542	6:SP2_SP2_SP2	C[6]	N[5,6]	N[5,6]	3:3:1:	6:3:3:	3:3:3:	N[5,6]-3:N[5,6]-3:O-1:	Si[5,6]-6:C[5,6a]-3:C[6]-3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](Si[5,6]C[6a]N[5a]N[5]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){2|N<3>,3|O<2>,5|C<3>}	N[5,6](Si[5,6]C[6a]N[5a]N[5]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O){10|C<3>,1|H<1>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O){1|Si<6>,1|H<1>,3|C<3>}	114.1030	0.000	1	114.1030	0.000	1	114.1030	0.000	1	114.1030	0.000	1	115.0713	0.703	3	115.0713	0.703	3
762	542	622	0:SP2_SP2_SP2	C[6]	N[5]	O[6]	3:3:2:	3:4:3:	3:3:	C[6]-3:N[5]-3:O[6]-2:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	N[5](C[6]C[6]O[6])(C[5]C[5]CH)(C[5]O[5]O)	O[6](C[6]C[6]N[5])(C[6]N[5,6]O)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6]){1|N<3>,1|O<2>,2|C<3>,2|H<1>,2|O<1>,3|C<4>}	N[5](C[6]C[6]O[6])(C[5]C[5]CH)(C[5]O[5]O){1|C<4>,2|C<3>,2|H<1>}	O[6](C[6]C[6]N[5])(C[6]N[5,6]O){2|C<3>,3|C<4>}	109.9880	0.000	1	109.9880	0.000	1	109.6720	0.200	2	109.6720	0.200	2	109.6720	0.200	2	109.6720	0.200	2
762	542	622	0:SP2_SP2_SP2	C[6]	N[5]	O[6]	3:3:2:	3:4:3:	3:3:	C[6]-3:N[5]-3:O[6]-2:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	N[5](C[6]C[6]O[6])(C[5]C[5]HH)(C[5]O[5]O)	O[6](C[6]C[6]N[5])(C[6]N[5,6]O)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6]){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|O<1>,3|H<1>}	N[5](C[6]C[6]O[6])(C[5]C[5]HH)(C[5]O[5]O){1|C<4>,2|C<3>,2|H<1>}	O[6](C[6]C[6]N[5])(C[6]N[5,6]O){2|C<3>,3|C<4>}	109.3560	0.000	1	109.3560	0.000	1	109.6720	0.200	2	109.6720	0.200	2	109.6720	0.200	2	109.6720	0.200	2
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:3:2:	3:3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[6]-3:N[5]-2:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]N[5])(O[6]C[6,6a])(O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]O[6]O)(N[5]C[5])	O[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)	C[6](N[5,6]C[5,6]N[5])(O[6]C[6,6a])(O){1|C<4>,1|H<1>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]O[6]O)(N[5]C[5]){1|C<4>,2|C<3>,2|H<1>}	O[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	113.5670	0.000	1	113.5670	0.000	1	113.5670	0.000	1	113.5670	0.000	1	116.7226	2.260	9	116.7226	2.260	9
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:4:3:	3:3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O[6](C[6]C[6]N[5])(C[6]N[5,6]O)	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){2|C<3>,4|H<1>}	O[6](C[6]C[6]N[5])(C[6]N[5,6]O){2|C<3>,3|C<4>}	116.2700	0.000	1	116.2700	0.000	1	116.4240	0.386	4	116.4240	0.386	4	116.7226	2.260	9	116.7226	2.260	9
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:4:3:	3:3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O[6](C[6]N[5,6]O)(C[6]C[6]N)	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){1|O<2>,2|C<3>,3|H<1>}	O[6](C[6]N[5,6]O)(C[6]C[6]N){1|C<3>,2|C<4>}	116.9030	0.168	2	116.9030	0.028	2	116.4240	0.386	4	116.4240	0.386	4	116.7226	2.260	9	116.7226	2.260	9
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:4:3:	3:3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]C[5]H)(C[6]O[6]O)	O[6](C[6]C[6]N[5])(C[6]N[5,6]O)	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]C[5]H)(C[6]O[6]O){1|O<2>,3|H<1>,4|C<3>}	O[6](C[6]C[6]N[5])(C[6]N[5,6]O){2|C<3>,3|C<4>}	115.6200	0.000	1	115.6200	0.000	1	116.4240	0.386	4	116.4240	0.386	4	116.7226	2.260	9	116.7226	2.260	9
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:4:3:	3:4:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-4:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O[6](C[6]N[5,6]O)(C[6]C[6]CH)	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){1|C<4>,1|I<1>,1|O<2>,4|H<1>}	O[6](C[6]N[5,6]O)(C[6]C[6]CH){1|H<1>,1|I<1>,2|C<4>}	118.4085	0.641	2	118.4085	0.411	2	118.4085	0.411	2	118.4085	0.411	2	116.7226	2.260	9	116.7226	2.260	9
762	542	622	6:SP2_SP2_SP2	C[6]	N[5,6]	O[6]	3:2:1:	4:4:3:	4:3:	N[5,6]-3:O[6]-2:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-4:C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6])(O[6]C[6])(O)	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6]C[5]C[6]2)(C[6]O[6]O)	O[6](C[6]C[6,6]HH)(C[6]N[5,6]O)	C[6](N[5,6]C[5,6,6]C[5,6])(O[6]C[6])(O){1|C<4>,3|H<1>,4|C<3>}	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6]C[5]C[6]2)(C[6]O[6]O){2|C<4>,3|H<1>,4|C<3>}	O[6](C[6]C[6,6]HH)(C[6]N[5,6]O){1|H<1>,3|C<4>}	117.2115	0.194	2	117.2115	0.038	2	117.2115	0.038	2	117.2115	0.038	2	116.7226	2.260	9	116.7226	2.260	9
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:2:	3:3:4:	3:3:3:	N[5,6]-3:C[6a]-3:N[6]-2:	C[5,6]-3:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(N[6]C[6,6a])	N[5,6](C[5,6]C[6,6a]N[5])(C[6]C[6a]N[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]N[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(N[6]C[6,6a]){1|C<4>,1|N<2>,4|C<3>,4|H<1>}	N[5,6](C[5,6]C[6,6a]N[5])(C[6]C[6a]N[6])(C[5]C[5]HH){2|H<1>,4|C<3>}	C[6a](C[6]N[5,6]N[6])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,3|C<3>}	117.6920	0.000	1	117.6920	0.000	1	117.6920	0.000	1	117.6920	0.000	1	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	C[6]-3:C[5,6]-3:C[5]-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(C[6a]C[6a]2)	N[5,6](C[6]C[6,6a]C[6a])(C[5,6]C[6]N[5])(C[5]N[5]Rh)	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]C)2	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(C[6a]C[6a]2){1|Rh<6>,1|H<1>,2|C<4>,2|N<3>,5|C<3>}	N[5,6](C[6]C[6,6a]C[6a])(C[5,6]C[6]N[5])(C[5]N[5]Rh){1|H<1>,2|C<4>,4|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	121.3990	0.000	1	121.3990	0.000	1	121.3990	0.000	1	121.3990	0.000	1	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	3:4:3:	3:3:2:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6a]-3:N[6a]-2:	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6a]C[6])	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)(N[6a]C[6a])	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H){2|Cl<1>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6a]C[6]){1|N<2>,2|H<1>,4|C<3>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)(N[6a]C[6a]){1|Ga<4>,1|P<3>,2|H<1>,3|C<3>}	114.6070	0.536	2	114.6070	0.287	2	114.6070	0.287	2	114.6070	0.287	2	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:2:	3:3:3:	N[5,6]-3:C[6]-3:C[6a]-3:	C[5,6]-4:C[6]-3:N[5]-2:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[6]C[6a]C[6])(N[5]C[5])	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,3|H<1>,5|C<3>}	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[6]C[6a]C[6])(N[5]C[5]){1|H<1>,7|C<3>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{1|C<4>,1|N<2>,2|C<3>,3|H<1>}	118.5830	0.000	1	118.5830	0.000	1	118.5830	0.000	1	118.5830	0.000	1	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	B[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]B[5,6]C[5])(C[6a]C[6a]2)	N[5,6](B[5,6]C[6a]O[5]O[6])(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]B[5,6]C[5])(C[6a]C[6a]2){2|O<2>,4|H<1>,7|C<3>}	N[5,6](B[5,6]C[6a]O[5]O[6])(C[6]C[6,6a]C[6a])(C[5]C[5]HH){1|O<1>,6|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|B<4>,1|C<4>,2|H<1>,3|C<3>}	122.1800	0.072	2	122.1800	0.005	2	122.1800	0.005	2	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6]-3:C[6a]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2){1|O<1>,3|C<4>,4|C<3>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH){4|C<3>,6|H<1>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	115.5030	0.659	2	115.5030	0.434	2	115.5030	0.434	2	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[4,5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,2|C<4>,3|C<3>,6|H<1>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH){2|C<4>,2|H<1>,5|C<3>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,3|C<4>}	115.2790	0.679	3	115.2790	0.461	3	115.2790	0.461	3	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|N<3>,2|C<4>,4|C<3>,5|H<1>}	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6a]C[6])(C[5]C[5]HH){1|C<4>,5|C<3>,5|H<1>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,3|C<4>}	114.1480	0.000	1	114.1480	0.000	1	117.1314	3.939	5	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6]C)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]C)(C[6]C[6a]C[6])(C[5]C[5]HH){3|C<3>,7|H<1>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{2|C<3>,2|C<4>,3|H<1>}	116.7590	0.000	1	116.7590	0.000	1	117.1314	3.939	5	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH){3|C<3>,7|H<1>}	C[6a](C[6]N[5,6]C[6])(C[6a]C[6a]H)2{2|C<3>,2|C<4>,3|H<1>}	118.2500	1.217	3	118.2500	1.482	3	117.1314	3.939	5	117.2383	7.596	12	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	5:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6,6]-5:C[5,6a]-3:C[6]-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]C[6a]O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|N<3>,2|O<2>,3|H<1>,7|C<3>}	N[5,6](Si[5,6,6]N[5,6]C[6a]O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){1|C<4>,1|H<1>,9|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|Si<5>,2|H<1>,4|C<3>}	122.2040	0.303	2	122.2040	0.092	2	122.2040	0.092	2	121.6663	0.913	3	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	5:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6]Si[5]O[5]O[6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6a]Si[5,6])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|Si<4>,1|C<4>,2|O<2>,3|H<1>,6|C<3>}	N[5,6](Si[5,6]Si[5]O[5]O[6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){1|C<4>,1|H<1>,2|N<3>,6|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|Si<5>,2|H<1>,4|C<3>}	120.5910	0.000	1	120.5910	0.000	1	120.5910	0.000	1	121.6663	0.913	3	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	6:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|N<3>,2|O<2>,3|H<1>,8|C<3>}	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){12|C<3>,1|H<1>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|Si<6>,2|H<1>,4|C<3>}	122.6800	0.000	1	122.6800	0.000	1	122.6800	0.000	1	122.6800	0.000	1	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	6:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]O[6]2CN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2){1|N<2>,1|N<3>,2|C<4>,2|O<2>,4|C<3>,5|H<1>}	N[5,6](Si[5,6,6]N[5,6]O[6]2CN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH){2|H<1>,6|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|Si<6>,1|C<4>,2|H<1>,3|C<3>}	120.6100	0.335	2	120.6100	0.112	2	120.3772	0.118	6	120.3772	0.118	6	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6a]	3:3:3:	6:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2){1|C<4>,1|N<3>,2|N<2>,2|O<2>,4|C<3>,5|H<1>}	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH){2|H<1>,6|C<3>}	C[6a](C[6]C[6,6a]N[5,6])(C[6a]C[6a]H)2{1|Si<6>,1|C<4>,2|H<1>,3|C<3>}	120.2608	0.325	4	120.2608	0.105	4	120.3772	0.118	6	120.3772	0.118	6	118.6552	8.184	27	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP2	C[6]	N[5]	C[6,6a]	3:3:3:	3:3:3:	3:3:3:	C[6,6a]-3:N[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[6]N[6]Ru)(N[5]C[5]2)	N[5](C[6]C[6,6a]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5]N[6])(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]N[6]Ru)(N[5]C[5]2){1|N<3>,2|H<1>,4|C<3>}	N[5](C[6]C[6,6a]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5]N[6])(C[6a]C[6a]H){1|Ru<6>,1|N<2>,1|O<2>,2|H<1>,3|C<3>}	125.7540	0.000	1	125.7540	0.000	1	125.7540	0.000	1	125.7540	0.000	1	125.7540	0.000	1	118.9087	9.680	28
762	542	643	0:SP2_SP2_SP3	C[6]	N[5,6]	C[6a]	3:3:2:	4:4:3:	3:3:3:	N[5,6]-3:C[6a]-3:N[6]-2:	C[5,6]-4:S[5]-4:C[6]-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]S[5])(C[6a]C[6a]2)(N[6]C[6,6a])	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]C[6a]N[6])	C[6a](C[6]N[5,6]N[6])(C[6a]C[6a]H)2	C[6](N[5,6]C[5,6]S[5])(C[6a]C[6a]2)(N[6]C[6,6a]){2|O<1>,3|H<1>,6|C<3>}	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]C[6a]N[6]){6|C<3>}	C[6a](C[6]N[5,6]N[6])(C[6a]C[6a]H)2{1|C<4>,1|S<4>,2|C<3>,2|H<1>}	116.8525	0.689	2	116.8525	0.475	2	116.8525	0.475	2	116.8525	0.475	2	116.8525	0.475	2	118.0900	4.832	3
762	542	643	0:SP2_SP2_SP3	C[6]	N[5]	C[6,6a]	3:3:2:	3:4:4:	3:3:3:	C[6,6a]-3:N[5]-3:N[6]-2:	C[6]-3:C[5]-4:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5]C[5]2)(N[6]C[6])	N[5](C[6]C[6,6a]N[6])(C[5]C[5]HH)2	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5]N[6])(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5]C[5]2)(N[6]C[6]){1|N<2>,2|C<3>,3|C<4>,5|H<1>}	N[5](C[6]C[6,6a]N[6])(C[5]C[5]HH)2{3|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5]N[6])(C[6a]C[6a]H){2|C<3>,2|H<1>,4|C<4>}	120.5650	0.000	1	120.5650	0.000	1	120.5650	0.000	1	120.5650	0.000	1	120.5650	0.000	1	118.0900	4.832	3
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6,6]	C[6,6a]	3:3:1:	4:4:3:	3:3:3:	N[5,6,6]-3:C[6,6a]-3:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6,6]C[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6,6](C[5,6,6]C[5]C[6]2)(C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6,6]O)(C[6a]C[6a]H)	C[6](N[5,6,6]C[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(O){2|C<4>,2|H<1>,5|C<3>}	N[5,6,6](C[5,6,6]C[5]C[6]2)(C[5,6]C[5]C[6]H)(C[6]C[6,6a]O){1|C<4>,1|O<1>,4|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6,6]O)(C[6a]C[6a]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	114.9880	0.000	1	114.9880	0.000	1	114.9880	0.000	1	114.9880	0.000	1	114.9880	0.000	1	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	3:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|H<1>,1|N<3>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6])(C[6]C[6,6a]O){1|Pt<4>,1|H<1>,1|O<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|Pt<4>,2|H<1>,3|C<3>}	112.8057	0.229	3	112.8057	0.052	3	112.8057	0.052	3	112.8057	0.052	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	3:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:H-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(H)	N[5,6](C[5,6]C[6]N[5])(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a,6a]C[6])(C[6]N[5,6]H)(C[6a]O[6a]O)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(H){1|C<4>,1|N<2>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[6]C[6,6a]H)(C[5]C[5]HH){2|H<1>,3|C<3>}	C[6,6a](C[6,6a]C[6a,6a]C[6])(C[6]N[5,6]H)(C[6a]O[6a]O){1|C<4>,4|C<3>}	120.8560	0.000	1	120.8560	0.000	1	120.8560	0.000	1	117.5160	22.311	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	3:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:S-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(S)	N[5,6](C[5,6]C[5]N[6])(C[6]C[6,6a]S)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]S)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(S){1|N<2>,2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]N[6])(C[6]C[6,6a]S)(C[5]C[5]HH){2|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]S)(C[6a]C[6a]H){1|C<4>,2|C<3>,2|H<1>}	114.1760	0.000	1	114.1760	0.000	1	114.1760	0.000	1	117.5160	22.311	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	3:4:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]O[6]C)(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]O[6]C)(C[6]C[6,6a]O){1|H<1>,1|O<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<4>,2|C<3>,2|H<1>}	112.4340	0.000	1	112.4340	0.000	1	112.4340	0.000	1	112.4340	0.000	1	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6]C[6a]C[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|H<1>,1|O<2>,6|C<3>}	N[5,6](C[5,6]C[6a]C[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|H<1>,7|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<4>,2|C<3>,2|H<1>}	113.2820	0.000	1	113.2820	0.000	1	113.2820	0.000	1	115.1366	2.545	5	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[4,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|H<1>,1|O<2>,2|C<4>,4|C<3>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,4|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[4,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H){2|C<3>,2|C<4>,3|H<1>}	116.4740	0.000	1	116.4740	0.000	1	116.7900	0.200	2	115.1366	2.545	5	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[4,5,6]C[4,6]C[4]S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[4,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|H<1>,1|S<2>,2|C<4>,4|C<3>}	N[5,6](C[4,5,6]C[4,6]C[4]S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,3|H<1>,5|C<3>}	C[6,6a](C[6,6a]C[4,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H){2|C<3>,2|C<4>,3|H<1>}	117.1060	0.000	1	117.1060	0.000	1	116.7900	0.200	2	115.1366	2.545	5	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]N[5,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	C[6,6a](C[6,6a]N[5,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<4>,2|H<1>,3|C<3>}	114.3150	0.000	1	114.4105	0.018	2	114.4105	0.018	2	115.1366	2.545	5	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	C[6,6a](C[6,6a]N[5,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,2|H<1>,5|C<3>}	C[6,6a](C[6,6a]N[5,6]C[6a])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<4>,2|H<1>,3|C<3>}	114.5060	0.000	1	114.4105	0.018	2	114.4105	0.018	2	115.1366	2.545	5	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]C)(C[6]C[6,6a]O)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<3>,2|C<4>,3|H<1>}	115.5890	0.000	1	115.5890	0.000	1	115.0613	0.344	6	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<3>,2|C<4>,3|H<1>}	114.9365	0.465	2	114.9365	0.216	2	115.0613	0.344	6	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC)	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,1|S<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC){2|C<3>,3|C<4>}	C[6,6a](C[6,6a]C[6a]N[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|Br<1>,1|C<3>,1|N<3>,3|C<4>}	114.6790	0.000	1	114.6790	0.000	1	115.0613	0.344	6	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]O[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|O<2>,1|S<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]O[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC){2|C<3>,2|C<4>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	114.3910	0.000	1	114.3910	0.000	1	115.0613	0.344	6	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6,6a]O)(C[5]C[5]CH)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|C<4>,1|N<3>,2|H<1>,5|C<3>}	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6,6a]O)(C[5]C[5]CH){1|H<1>,2|O<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	115.8360	0.000	1	115.8360	0.000	1	115.0613	0.344	6	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6]O[5]C)(C[6]C[6,6a]O)(C[5]C[5]CC)	C[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6,6a]O)(C[6]N[5,6]O)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){2|O<2>,3|C<3>,4|C<4>}	N[5,6](C[5,6]C[6]O[5]C)(C[6]C[6,6a]O)(C[5]C[5]CC){1|O<1>,2|C<3>,2|H<1>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6a]C[6,6a]O)(C[6]N[5,6]O){2|C<3>,2|C<4>,3|H<1>}	116.8890	0.000	1	116.8890	0.000	1	116.8890	0.000	1	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6a,6a]-3:C[6,6a]-3:C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	C[6,6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6]N[5,6]O)	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]C[5,6]C[5])(O){3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,5|H<1>}	C[6,6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6a]C[6])(C[6]N[5,6]O){3|C<3>,3|C<4>,3|H<1>}	114.8400	0.000	1	114.8400	0.000	1	114.8400	0.000	1	115.2621	0.684	8	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:4:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]O[6]H)(C[5]C[6a]C[5]H)(C[6]C[6,6a]O)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	N[5,6](C[5,6]C[5]O[6]H)(C[5]C[6a]C[5]H)(C[6]C[6,6a]O){4|C<3>,4|H<1>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<3>,2|C<4>,2|H<1>}	112.9670	0.000	1	112.9670	0.000	1	112.9670	0.000	1	112.8360	0.034	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:4:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:S[5]-4:C[6]-3:	C[5a,6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(N[5,6]C[5,6]S[5])(O)	N[5,6](C[5,6]C[5,6a]N[5a,6]C)(S[5]C[5,6a]OO)(C[6]C[6,6a]O)	C[6,6a](C[5a,6,6a]C[5a,6a]N[5a,6])(C[6]N[5,6]O)(C[6a]C[6a]H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(N[5,6]C[5,6]S[5])(O){1|H<1>,1|N<3>,2|O<1>,5|C<3>}	N[5,6](C[5,6]C[5,6a]N[5a,6]C)(S[5]C[5,6a]OO)(C[6]C[6,6a]O){5|C<3>}	C[6,6a](C[5a,6,6a]C[5a,6a]N[5a,6])(C[6]N[5,6]O)(C[6a]C[6a]H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	112.7050	0.000	1	112.7050	0.000	1	112.7050	0.000	1	112.8360	0.034	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	5:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:H-1:	Ga[5,6,6]-5:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Ga[5,6,6]C[5])(H)	N[5,6](Ga[5,6,6]N[5,6]O[6]2O)(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Ga[5,6,6]C[5])(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>,3|O<2>}	N[5,6](Ga[5,6,6]N[5,6]O[6]2O)(C[6]C[6,6a]H)(C[5]C[5]HH){2|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|Ga<5>,1|C<3>,1|H<1>,2|C<4>}	124.5080	1.541	2	124.5080	2.376	2	125.0635	2.138	4	125.5068	1.951	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	5:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:H-1:	Ga[5,6,6]-5:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Ga[5,6,6]C[5])(H)	N[5,6](Ga[5,6,6]N[5,6]O[6]2P)(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Ga[5,6,6]C[5])(H){1|C<4>,1|N<3>,1|P<2>,2|C<3>,2|O<2>,3|H<1>}	N[5,6](Ga[5,6,6]N[5,6]O[6]2P)(C[6]C[6,6a]H)(C[5]C[5]HH){2|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|Ga<5>,1|C<3>,3|C<4>}	125.6190	1.674	2	125.6190	2.804	2	125.0635	2.138	4	125.5068	1.951	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	5:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:H-1:	In[5,6,6]-5:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]In[5,6,6]C[5])(H)	N[5,6](In[5,6,6]N[5,6]O[6]2C)(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]In[5,6,6]C[5])(H){1|N<3>,2|C<3>,2|C<4>,2|O<2>,3|H<1>}	N[5,6](In[5,6,6]N[5,6]O[6]2C)(C[6]C[6,6a]H)(C[5]C[5]HH){2|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|In<5>,1|C<3>,1|O<2>,2|C<4>}	126.3935	0.992	2	126.3935	0.984	2	126.3935	0.984	2	125.5068	1.951	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	5:4:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	Ga[5,6,6]-5:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]Ga[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](Ga[5,6,6]N[5,6]O[6]2Cl)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]Ga[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H){1|Cl<1>,1|N<3>,2|C<3>,2|C<4>,2|H<1>,2|O<2>}	N[5,6](Ga[5,6,6]N[5,6]O[6]2Cl)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H){2|C<4>,3|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|Ga<5>,1|C<3>,3|C<4>}	125.7255	0.733	2	125.7255	0.538	2	125.7255	0.538	2	126.6977	0.922	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	5:4:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	In[5,6,6]-5:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]In[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](In[5,6,6]N[5,6]O[6]2Cl)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]In[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H){1|Cl<1>,1|N<3>,2|C<3>,2|C<4>,2|H<1>,2|O<2>}	N[5,6](In[5,6,6]N[5,6]O[6]2Cl)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H){2|C<4>,3|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|In<5>,1|C<3>,3|C<4>}	127.1838	0.642	4	127.1838	0.412	4	127.1838	0.412	4	126.6977	0.922	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	6:3:2:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	In[5,5,6,6]-6:C[6]-3:N[5]-2:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]In[5,5,6,6]N[5])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](In[5,5,6,6]N[5,6]O[6]2S[5]2)(C[6]C[6,6a]H)(N[5]C[5])	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]In[5,5,6,6]N[5])(C[6,6a]C[6,6a]C[6a])(H){1|H<1>,1|N<3>,2|O<2>,2|S<2>,3|C<3>}	N[5,6](In[5,5,6,6]N[5,6]O[6]2S[5]2)(C[6]C[6,6a]H)(N[5]C[5]){1|N<2>,1|N<3>,5|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|In<6>,1|C<3>,1|N<2>,2|C<4>}	127.1645	0.542	2	127.1645	0.294	2	127.1645	0.294	2	127.1645	0.294	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	6:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]H)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(H){1|H<1>,1|N<3>,2|O<2>,6|C<3>}	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]H){10|C<3>,1|H<1>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|Si<6>,2|C<3>,2|H<1>}	122.9440	0.000	1	122.9440	0.000	1	122.9440	0.000	1	122.9440	0.000	1	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	6:3:4:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	In[3x5,6,6]-6:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]In[3x5,6,6]C[5])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](In[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]In[3x5,6,6]C[5])(C[6,6a]C[6,6a]C[6a])(H){1|C<4>,1|N<3>,2|C<3>,2|N<4>,2|O<2>,3|H<1>}	N[5,6](In[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[6]C[6,6a]H)(C[5]C[5]HH){4|C<3>,4|C<4>,4|H<1>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|Cl<1>,1|In<6>,1|C<3>,1|C<4>,1|H<1>}	127.4655	0.432	2	127.4655	0.187	2	127.4655	0.187	2	127.4655	0.187	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	6:4:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	In[5,5,6,6]-6:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H){2|C<3>,2|C<4>,2|H<1>,2|N<3>,3|O<2>}	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H){3|C<4>,3|H<1>,6|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|In<6>,1|C<3>,3|C<4>}	127.5190	1.089	2	126.9818	2.263	4	126.9818	2.263	4	126.9818	2.263	4	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:1:	6:4:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:H-1:	In[5,5,6,6]-6:C[5,6]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H)	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H)	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(H){2|C<3>,2|C<4>,2|H<1>,2|N<3>,3|O<2>}	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5,6]C[6]H)(C[6]C[6,6a]H){3|C<4>,3|H<1>,6|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]H)(C[6a]C[6a]H){1|In<6>,1|Si<4>,1|C<3>,2|C<4>}	126.4445	2.109	2	126.9818	2.263	4	126.9818	2.263	4	126.9818	2.263	4	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	3:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[6]-3:C[5]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C)(C[6a]C[6a]H){1|N<3>,1|O<2>,2|C<3>,3|H<1>}	113.0020	0.000	1	112.9920	0.000	2	112.9920	0.000	2	114.4517	6.392	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	3:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[6]-3:C[5]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C)(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O){2|C<3>,3|C<4>,3|H<1>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C)(C[6a]C[6a]H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	112.9820	0.000	1	112.9920	0.000	2	112.9920	0.000	2	114.4517	6.392	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	3:3:3:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	C[6]-3:C[5,6]-3:C[5]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(C[6a]C[6a]2)	N[5,6](C[6]C[6,6a]C[6a])(C[5,6]C[6]N[5])(C[5]N[5]Rh)	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(C[6a]C[6a]2){1|Rh<6>,1|H<1>,2|C<4>,2|N<3>,5|C<3>}	N[5,6](C[6]C[6,6a]C[6a])(C[5,6]C[6]N[5])(C[5]N[5]Rh){1|H<1>,2|C<4>,4|C<3>}	C[6,6a](C[6,6a]C[6a]C[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){3|H<1>,5|C<3>}	117.3710	0.000	1	117.3710	0.000	1	117.3710	0.000	1	114.4517	6.392	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	B[5,6]-4:C[6]-3:C[5]-4:	C[6a,6a]-3:C[6,6a]-3:C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]B[5,6]C[5])(C[6a]C[6a]2)	N[5,6](B[5,6]C[6a]O[5]O[6])(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6,6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]B[5,6]C[5])(C[6a]C[6a]2){2|O<2>,4|H<1>,7|C<3>}	N[5,6](B[5,6]C[6a]O[5]O[6])(C[6]C[6,6a]C[6a])(C[5]C[5]HH){1|O<1>,6|C<3>}	C[6,6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a]){1|B<4>,1|C<4>,2|H<1>,5|C<3>}	116.7100	0.774	2	116.7100	0.598	2	116.7100	0.598	2	116.7100	0.598	2	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	5:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6,6]-5:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]C[6a]O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|N<3>,2|O<2>,3|H<1>,7|C<3>}	N[5,6](Si[5,6,6]N[5,6]C[6a]O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){1|C<4>,1|H<1>,9|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){1|Si<5>,2|H<1>,4|C<3>}	119.1530	0.136	2	119.1530	0.018	2	119.1530	0.018	2	119.6740	0.824	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	5:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6]Si[5]O[5]O[6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](N[5,6]C[5,6a]Si[5,6])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|Si<4>,1|C<4>,2|O<2>,3|H<1>,6|C<3>}	N[5,6](Si[5,6]Si[5]O[5]O[6]C)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){1|C<4>,1|H<1>,2|N<3>,6|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){1|Si<5>,2|H<1>,4|C<3>}	120.7160	0.000	1	120.7160	0.000	1	120.7160	0.000	1	119.6740	0.824	3	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	6:3:3:	3:3:3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a])	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2){1|N<3>,2|O<2>,3|H<1>,8|C<3>}	N[5,6](Si[5,6,6]N[5,6]C[6a]2O[6]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]C[6a]){12|C<3>,1|H<1>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){1|Si<6>,2|H<1>,4|C<3>}	120.2900	0.000	1	120.2900	0.000	1	120.2900	0.000	1	120.2900	0.000	1	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	6:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]O[6]2CN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2){1|N<2>,1|N<3>,2|C<4>,2|O<2>,4|C<3>,5|H<1>}	N[5,6](Si[5,6,6]N[5,6]O[6]2CN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH){2|H<1>,6|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){1|Si<6>,1|C<4>,2|H<1>,3|C<3>}	121.3465	0.115	2	121.3465	0.013	2	121.6240	0.590	6	121.6240	0.590	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6a]	3:3:3:	6:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH)	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2){1|C<4>,1|N<3>,2|N<2>,2|O<2>,4|C<3>,5|H<1>}	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[6]C[6,6a]C[6a])(C[5]C[5]HH){2|H<1>,6|C<3>}	C[6,6a](C[6,6a]C[6a]O[6])(C[6]N[5,6]C[6a])(C[6a]C[6a]H){1|Si<6>,1|C<4>,2|H<1>,3|C<3>}	121.7627	0.950	4	121.7627	0.902	4	121.6240	0.590	6	121.6240	0.590	6	120.1495	30.361	57	120.0606	30.288	58
762	542	643	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6,6a]	3:3:1:	4:3:4:	3:3:3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6,6]C[5])(O)	N[5,6](C[5,6,6]C[5,6,6]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	C[6,6a](C[6,6a]C[5,6,6]C[6a])(C[6a]C[5,6a]H)(C[6]N[5,6]O)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6,6]C[5])(O){2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,6,6]C[5,6,6]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|H<1>,4|C<3>}	C[6,6a](C[6,6a]C[5,6,6]C[6a])(C[6a]C[5,6a]H)(C[6]N[5,6]O){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	116.5320	0.000	1	116.5320	0.000	1	116.5320	0.000	1	116.5320	0.000	1	116.5320	0.000	1	116.5320	0.000	1
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	3:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:H-1:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H)	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H){1|B<4>,1|C<4>,1|O<2>,2|F<1>,3|C<3>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|C<3>,1|C<4>,1|N<3>,2|F<1>}	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H){1|B<4>,1|C<4>,1|H<1>,1|N<3>,2|F<1>}	124.4140	0.000	1	124.2180	0.136	4	124.2180	0.136	4	121.0790	23.730	6	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	3:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:H-1:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H)	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H){1|B<4>,1|C<4>,1|O<2>,2|F<1>,3|C<3>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|N<3>,2|C<3>,2|F<1>}	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H){1|B<4>,1|C<4>,1|H<1>,1|N<3>,2|F<1>}	123.9125	0.098	2	124.2180	0.136	4	124.2180	0.136	4	121.0790	23.730	6	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	3:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:H-1:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H)	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H){1|B<4>,1|C<4>,1|O<2>,2|F<1>,3|C<3>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|N<3>,2|C<3>,2|F<1>}	C[5a,6](N[5a,6]C[5a]B[6])(C[5a]C[5a]C)(C[6]N[5,6]H){1|B<4>,1|N<3>,2|C<4>,2|F<1>}	124.6330	0.000	1	124.2180	0.136	4	124.2180	0.136	4	121.0790	23.730	6	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	3:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,6]-3:C[6]-3:C[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,6]C[5])(C[6]C[5a,6]O)(C[5]C[5]HH)	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O){2|C<4>,3|C<3>,3|H<1>}	N[5,6](C[5,6]C[5,6]C[5])(C[6]C[5a,6]O)(C[5]C[5]HH){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O){2|Br<1>,1|C<4>,1|N<2>,2|C<3>}	114.8010	0.041	2	114.8010	0.002	2	114.8010	0.002	2	121.0790	23.730	6	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	4:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,5,6]-4:C[6]-3:C[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O)	N[5,6](C[5,5,6]C[5,6]C[5]N[5])(C[6]C[5a,6]O)(C[5]C[5]HH)	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O){1|N<2>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,6]C[5]N[5])(C[6]C[5a,6]O)(C[5]C[5]HH){1|N<3>,1|O<2>,2|C<3>,5|H<1>}	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O){2|Br<1>,1|H<1>,1|O<2>,2|C<4>}	115.4660	0.000	1	115.4660	0.000	1	115.4660	0.000	1	115.4560	0.000	2	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	4:3:4:	3:3:3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]N)(C[6]C[5a,6]O)(C[5]C[5]HH)	C[5a,6](N[5a,6]C[5a]C[6])(C[5a]C[5a]H)(C[6]N[5,6]O)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]N)(C[6]C[5a,6]O)(C[5]C[5]HH){1|C<3>,1|N<2>,1|N<3>,5|H<1>}	C[5a,6](N[5a,6]C[5a]C[6])(C[5a]C[5a]H)(C[6]N[5,6]O){2|Br<1>,1|H<1>,1|N<2>,2|C<4>}	115.4460	0.000	1	115.4460	0.000	1	115.4460	0.000	1	115.4560	0.000	2	118.8918	21.167	10	118.8918	21.167	10
762	542	727	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5a,6]	3:3:1:	4:4:3:	3:3:3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	N[5a,6]-3:C[5a]-3:C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O)	N[5,6](C[5,5,6]C[5,6]2N[5])(C[5]C[5,6]HH)(C[6]C[5a,6]O)	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O){1|N<2>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,6]2N[5])(C[5]C[5,6]HH)(C[6]C[5a,6]O){2|C<3>,2|C<4>,2|N<3>,3|H<1>}	C[5a,6](N[5a,6]C[5,6]C[5a])(C[5a]C[5a]H)(C[6]N[5,6]O){2|Br<1>,1|H<1>,1|N<3>,2|C<4>}	115.7660	0.000	2	115.7660	0.000	2	115.7660	0.000	2	115.7660	0.000	2	118.8918	21.167	10	118.8918	21.167	10
762	542	762	0:SP2_SP2_SP2	C[3x6]	N[5,6]	C[6,6]	4:3:3:	3:3:4:	3:4:4:	C[4x6]-4:N[5,6]-3:C[6,6]-3:	C[3x6]-3:C[5,6]-3:C[5]-4:	C[3x6]-3:C[3x6]-4:C-4:	C[3x6](C[4x6]C[6,6]P[3x6]C)(N[5,6]C[5,6]C[5])(C[6,6]C[3x6]C)	N[5,6](C[3x6]C[4x6]C[6,6])(C[5,6]C[5]C[6])(C[5]C[5]CC)	C[6,6](C[3x6]C[4x6]N[5,6])(C[3x6]C[6,6]2H)(CCCH)	C[3x6](C[4x6]C[6,6]P[3x6]C)(N[5,6]C[5,6]C[5])(C[6,6]C[3x6]C){2|C<3>,2|H<1>,5|C<4>}	N[5,6](C[3x6]C[4x6]C[6,6])(C[5,6]C[5]C[6])(C[5]C[5]CC){1|C<3>,1|P<3>,2|H<1>,6|C<4>}	C[6,6](C[3x6]C[4x6]N[5,6])(C[3x6]C[6,6]2H)(CCCH){1|P<3>,2|C<3>,2|C<4>,3|H<1>}	120.2360	0.072	2	120.2360	0.005	2	120.2360	0.005	2	120.2360	0.005	2	120.2360	0.005	2	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5,6]-3:C[6,6]-3:C[6]-3:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[6,6]-3:C[6]-3:O-1:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]H)	C[6](C[6,6]C[6,6]N[5,6])(C[6]C[6]C)(O)	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O){1|C<2>,1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6,6]C[6,6]N[5,6])(C[6]C[6]C)(O){1|C<2>,1|O<2>,3|C<3>}	120.5770	0.000	1	120.5770	0.000	1	120.5770	0.000	1	120.5770	0.000	1	120.1554	2.630	5	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6]	3:3:3:	3:3:4:	3:3:1:	N[5,6]-3:C[6]-3:C[6,6]-3:	C[6,6]-3:C[5,6]-3:C[5]-4:	C[6,6a]-3:C[6,6]-3:O-1:	C[6,6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]O)(C[6,6]C[6]2)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[5,6])(O)	C[6,6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]O)(C[6,6]C[6]2){1|C<4>,1|N<3>,1|O<1>,3|H<1>,4|C<3>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[5,6])(O){1|H<1>,2|C<4>,4|C<3>}	118.4830	0.000	2	118.4830	0.000	2	118.4830	0.000	2	118.4830	0.000	2	120.1554	2.630	5	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6]	3:4:3:	4:3:4:	4:3:1:	N[5,6]-3:C[6,6]-4:C[6]-3:	C[5,6,6]-4:C[6,6]-3:C[5]-4:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6](N[5,6]C[5,6,6]C[5])(C[6,6]C[5,6]C[6]C)(C[6]C[3x6]H)	N[5,6](C[5,6,6]O[5,6]C[6]2)(C[6,6]C[6,6]C[6])(C[5]C[5,6]HH)	C[6](C[3x6]C[3x6]C[6,6]C[6])(C[6,6]C[6,6]N[5,6])(H)	C[6,6](N[5,6]C[5,6,6]C[5])(C[6,6]C[5,6]C[6]C)(C[6]C[3x6]H){1|O<2>,4|H<1>,8|C<4>}	N[5,6](C[5,6,6]O[5,6]C[6]2)(C[6,6]C[6,6]C[6])(C[5]C[5,6]HH){6|C<4>,6|H<1>}	C[6](C[3x6]C[3x6]C[6,6]C[6])(C[6,6]C[6,6]N[5,6])(H){1|C<3>,1|O<2>,4|H<1>,7|C<4>}	122.1040	0.000	1	122.1040	0.000	1	122.1040	0.000	1	122.1040	0.000	1	120.1554	2.630	5	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6]	4:3:3:	3:3:3:	3:3:4:	C[5,6,6]-4:N[5,6]-3:C[6]-3:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[6,6]-3:C[6]-3:C-4:	C[6,6](C[5,6,6]Si[5,6]C[5,6]C)(N[5,6]C[5,6]C[5])(C[6]C[6]C)	N[5,6](C[6,6]C[5,6,6]C[6])(C[5,6]N[5]N[6])(C[5]C[5]H)	C[6](C[6,6]C[5,6,6]N[5,6])(C[6]C[6]H)(CCCH)	C[6,6](C[5,6,6]Si[5,6]C[5,6]C)(N[5,6]C[5,6]C[5])(C[6]C[6]C){1|Si<4>,1|N<3>,1|O<2>,2|C<3>,2|N<2>,3|H<1>}	N[5,6](C[6,6]C[5,6,6]C[6])(C[5,6]N[5]N[6])(C[5]C[5]H){1|Si<4>,1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6]C[5,6,6]N[5,6])(C[6]C[6]H)(CCCH){1|Si<4>,1|H<1>,2|C<3>,2|C<4>}	121.1300	0.000	1	121.1300	0.000	1	121.1300	0.000	1	121.1300	0.000	1	120.1554	2.630	5	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5]	C[6,6]	4:3:3:	3:4:3:	3:4:1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:C[5]-4:C[5]-3:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O)	C[6,6](C[6,6]C[3x6]N[5])(C[3x6]C[6,6]2H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O){3|C<4>,4|H<1>}	C[6,6](C[6,6]C[3x6]N[5])(C[3x6]C[6,6]2H)(H){2|C<3>,3|C<4>,4|H<1>}	123.9217	0.173	3	123.9217	0.030	3	123.9217	0.030	3	123.9062	0.021	4	124.0772	0.402	6	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5]	C[6,6]	4:3:3:	3:4:3:	3:4:1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:C[5]-4:C[5]-3:	C[6,6]-3:C[4x6]-4:H-1:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O)	C[6,6](C[6,6]C[3x6]N[5])(C[4x6]C[3x6]2H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O){3|C<4>,4|H<1>}	C[6,6](C[6,6]C[3x6]N[5])(C[4x6]C[3x6]2H)(H){1|C<3>,3|H<1>,5|C<4>}	123.8600	0.000	1	123.8600	0.000	1	123.8600	0.000	1	123.9062	0.021	4	124.0772	0.402	6	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5]	C[6,6]	4:3:3:	3:4:3:	4:3:1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:C[5]-4:C[5]-3:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N[5])(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2){1|N<3>,1|O<1>,1|O<2>,4|C<4>,5|H<1>}	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]CH)(C[5]O[5]O){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N[5])(H){1|C<3>,1|S<4>,3|C<4>,3|H<1>}	125.3120	0.000	1	125.3120	0.000	1	125.3120	0.000	1	124.4190	1.595	2	124.0772	0.402	6	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6,6]	N[5]	C[6,6]	4:3:3:	3:4:3:	4:3:1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:C[5]-4:C[5]-3:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]HH)(C[5]O[5]O)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]N[5])(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]HH)(C[5]O[5]O){3|C<4>,4|H<1>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]N[5])(H){1|C<3>,1|N<3>,4|C<4>,6|H<1>}	123.5260	0.000	1	123.5260	0.000	1	123.5260	0.000	1	124.4190	1.595	2	124.0772	0.402	6	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:2:	3:3:2:	N[5,6]-3:C[6]-3:C[6]-3:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:N[6]-2:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5])	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Br<1>,1|H<1>,1|N<3>,4|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5]){1|Zn<4>,1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6]){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	120.2940	0.000	1	120.2940	0.000	1	120.2940	0.000	1	120.2940	0.000	1	121.9320	5.366	2	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[6]-3:C[6]-3:	C[5,6]-3:N[5]-3:C[6]-3:	C[6]-3:N[6]-3:C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5]N[6])(N[5]C[5]Pd)(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|N<2>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]N[6])(N[5]C[5]Pd)(C[6]C[6]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	123.5700	0.000	1	123.5700	0.000	1	123.5700	0.000	1	123.5700	0.000	1	121.9320	5.366	2	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:2:	3:4:3:	3:3:1:	N[5]-3:C[6]-3:C[6]-2:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6]C[5])(C[6]C[6]H)(C[6]C[6])	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](N[5]C[5,6]C[5])(C[6]C[6]H)(C[6]C[6]){1|C<2>,1|C<4>,2|C<3>,2|H<1>,2|O<2>}	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]2){3|H<1>,4|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<4>,3|C<3>}	118.9740	0.000	1	118.9740	0.000	1	118.9740	0.000	1	118.9740	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:2:	3:4:3:	4:3:3:	C[6]-3:N[5]-3:O[6]-2:	C[6]-3:C[5]-4:C[5]-3:	C[5,6]-4:C[6]-3:C[6a]-3:	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	N[5](C[6]C[6]O[6])(C[5]C[5]CH)(C[5]O[5]O)	C[6](C[5,6]N[5,6]C[5]H)(C[6]N[5]O[6])(C[6a]C[6a]2)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6]){1|N<3>,1|O<2>,2|C<3>,2|H<1>,2|O<1>,3|C<4>}	N[5](C[6]C[6]O[6])(C[5]C[5]CH)(C[5]O[5]O){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]N[5]O[6])(C[6a]C[6a]2){3|C<4>,4|C<3>,4|H<1>}	124.6040	0.000	1	124.6040	0.000	1	125.9565	3.659	2	125.9565	3.659	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:2:	3:4:3:	4:3:3:	C[6]-3:N[5]-3:O[6]-2:	C[6]-3:C[5]-4:C[5]-3:	C[5,6]-4:C[6]-3:C[6a]-3:	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	N[5](C[6]C[6]O[6])(C[5]C[5]HH)(C[5]O[5]O)	C[6](C[5,6]N[5,6]C[5]H)(C[6]N[5]O[6])(C[6a]C[6a]2)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6]){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|O<1>,3|H<1>}	N[5](C[6]C[6]O[6])(C[5]C[5]HH)(C[5]O[5]O){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]N[5]O[6])(C[6a]C[6a]2){3|C<4>,4|C<3>,4|H<1>}	127.3090	0.000	1	127.3090	0.000	1	125.9565	3.659	2	125.9565	3.659	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:2:1:	N[5]-3:C[6]-3:C[6]-3:	C[5]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-2:H-1:	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5])	C[6](C[6]C[6]N[5])(C[6]C[6])(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5]){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6])(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	120.3200	0.000	1	120.3200	0.000	1	120.3200	0.000	1	120.3200	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[6]-3:C[6]-3:	C[5]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5])	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5]){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	117.8420	0.000	1	117.8420	0.000	1	118.5320	0.952	2	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[6]-3:C[6]-3:	C[5]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5])	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5]){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	119.2220	0.000	1	119.2220	0.000	1	118.5320	0.952	2	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[6]-3:C[6]-3:	C[5]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:O-1:	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5])	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O)	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5]){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O){1|N<2>,2|C<3>,2|H<1>}	116.6940	0.000	1	116.6940	0.000	1	116.6940	0.000	1	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[5]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]Ir)(N[5]N[5])	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]Ir)(N[5]N[5]){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<2>,2|C<3>}	124.9780	1.929	2	124.9780	3.721	2	124.1067	2.012	6	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[5]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5])	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5]){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	123.5390	1.912	2	123.6710	1.354	4	124.1067	2.012	6	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[5]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5])	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5]){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	123.8030	0.581	2	123.6710	1.354	4	124.1067	2.012	6	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:C[5]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(N[5]C[5])	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){1|Cu<3>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(N[5]C[5]){1|Cu<3>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,1|N<2>,3|C<3>}	120.2520	0.000	1	120.2520	0.000	1	120.2520	0.000	1	121.8650	10.303	10	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:2:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-2:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6])(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6])(H){1|H<1>,1|I<1>,3|C<3>}	120.7780	0.000	1	120.7780	0.000	1	120.7780	0.000	1	121.7798	2.155	8	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:2:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:N[6]-2:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(N[6]C[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H){2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Re)(C[5]C[5]H){1|C<3>,1|N<2>,3|H<1>}	C[6](C[6]N[5]N[6])(N[6]C[6])(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	123.9130	1.601	2	123.9130	2.563	2	123.9130	2.563	2	121.7798	2.155	8	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:2:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:N[6]-2:H-1:	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2){1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H){1|Re<6>,4|C<3>}	121.1268	0.268	5	121.1268	0.072	5	121.1268	0.072	5	121.7798	2.155	8	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:2:4:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-2:C-4:	C[6](C[6]C[6]C)2(N[5]C[5]2)	N[5](C[5]N[5]Pt)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6])(CH3)	C[6](C[6]C[6]C)2(N[5]C[5]2){1|Pt<3>,1|H<1>,1|N<3>,2|C<3>}	N[5](C[5]N[5]Pt)(C[5]C[5]H)(C[6]C[6]2){1|C<3>,1|H<1>,2|C<2>,2|C<4>}	C[6](C[6]C[6]N[5])(C[6]C[6])(CH3){1|C<2>,2|C<3>,2|C<4>}	118.7742	0.682	4	118.7742	0.465	4	118.4490	0.878	5	118.4490	0.878	5	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:2:4:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-2:C-4:	C[6](C[6]C[6]C)2(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6])(CCCH)	C[6](C[6]C[6]C)2(N[5]C[5]2){1|Rh<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[5])(C[6]C[6])(CCCH){1|C<4>,1|H<1>,3|C<3>}	117.1480	0.000	1	117.1480	0.000	1	118.4490	0.878	5	118.4490	0.878	5	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5](C[5]N[5]Fe)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	117.8260	0.000	1	117.8260	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]N[5]H)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<2>,1|N<3>,3|H<1>}	N[5](C[5]N[5]H)2(C[6]C[6]2){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	117.4000	0.000	1	117.4000	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]C[5,6a]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Pd<4>,1|H<1>,2|O<1>,3|C<3>}	N[5](C[5]C[5,6a]O)2(C[6]C[6]2){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	121.5903	0.898	3	121.5903	0.806	3	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]C[5]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Re<6>,1|H<1>,2|O<1>,3|C<3>}	N[5](C[5]C[5]O)2(C[6]C[6]2){1|C<3>,1|N<3>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	122.0310	0.000	1	122.0310	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Rh<6>,1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	122.0690	0.000	1	122.0690	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5,6,6]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,2|H<1>,2|O<1>}	N[5](C[5]C[5,6,6]O)2(C[6]C[6]2){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	120.7815	0.759	2	120.7815	0.576	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|I<1>,2|C<3>}	120.2400	0.000	1	120.2400	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[6]N[5])(C[5]N[5]Pt)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|Pt<4>,1|C<2>,1|C<3>,1|N<2>,1|N<3>,2|H<1>}	N[5](C[5]C[6]N[5])(C[5]N[5]Pt)(C[6]C[6]2){2|H<1>,5|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	119.0245	2.063	2	119.0245	4.254	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2){2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ir<8>,3|C<3>}	124.7580	0.000	1	124.7580	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	123.6010	0.000	1	123.6735	0.011	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Rh<8>,3|C<3>}	123.7460	0.000	1	123.6735	0.011	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ru<9>,3|C<3>}	124.7760	0.000	1	125.1230	0.241	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2){2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ru<9>,3|C<3>}	125.4700	0.000	1	125.1230	0.241	2	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]N[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	125.9160	0.000	1	125.9160	0.000	1	121.7898	6.871	18	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5](C[5]N[5]Fe)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O){2|H<1>,3|C<3>}	117.6850	0.000	1	117.6850	0.000	1	118.4670	1.223	2	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]N[5]H)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<2>,1|N<3>,3|H<1>}	N[5](C[5]N[5]H)2(C[6]C[6]2){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	119.2490	0.000	1	119.2490	0.000	1	118.4670	1.223	2	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]C[5,6a]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Pd<4>,1|H<1>,2|O<1>,3|C<3>}	N[5](C[5]C[5,6a]O)2(C[6]C[6]2){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(N[6]C[6]Pd)(H){2|H<1>,3|C<3>}	118.6243	0.862	4	118.6243	0.742	4	118.8995	5.934	8	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]C[5]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]Re)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Re<6>,1|H<1>,2|O<1>,3|C<3>}	N[5](C[5]C[5]O)2(C[6]C[6]2){1|C<3>,1|N<3>,4|H<1>}	C[6](C[6]C[6]N[5])(N[6]C[6]Re)(H){2|H<1>,3|C<3>}	119.9310	0.000	1	119.9310	0.000	1	118.8995	5.934	8	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Rh<6>,1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){2|H<1>,3|C<3>}	118.9270	0.000	1	118.9270	0.000	1	118.8995	5.934	8	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]C[5]H)(C[5]N[5]C)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5](C[5]C[5]H)(C[5]N[5]C)(C[6]C[6]2){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	114.5650	0.000	1	114.5650	0.000	1	118.8995	5.934	8	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	123.2760	0.000	1	123.2760	0.000	1	118.8995	5.934	8	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){2|C<3>,2|N<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H){2|C<3>,4|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	120.0090	0.000	1	120.0090	0.000	1	124.4860	6.320	5	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]V)	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]V)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]V){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]V){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|V<6>,3|C<3>}	125.6052	0.274	4	125.6052	0.075	4	124.4860	6.320	5	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[6]-3:C[6]-3:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](N[5]C[5]N[5])(C[6]C[6]Ru)(C[6]C[6]O)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	C[6](N[5]C[5]N[5])(C[6]C[6]Ru)(C[6]C[6]O){1|O<1>,2|H<1>,3|C<3>}	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]C[6]2){1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){1|Ru<6>,2|C<3>,2|N<3>}	118.7400	0.074	2	118.7400	0.005	2	118.7400	0.005	2	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:B[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]B[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(B[5]N[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]B[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(B[5]N[5]Ir){2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	126.4130	0.000	1	126.4130	0.000	1	126.4130	0.000	1	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Fe)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Fe){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	129.4155	3.152	2	128.0517	10.546	3	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Fe)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Fe){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	125.3240	0.000	1	128.0517	10.546	3	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ir){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	124.5725	0.319	2	124.5725	0.102	2	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ir){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	124.3920	0.000	1	124.3920	0.000	1	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Mn)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Mn){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	124.0450	0.000	1	124.0450	0.000	1	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd){2|H<1>,5|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	128.3670	0.137	2	124.8753	7.219	7	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	125.5850	0.000	1	124.8753	7.219	7	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Pd){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	122.9520	1.097	4	124.8753	7.219	7	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Re)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Re){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	124.0080	0.666	3	124.0080	0.444	3	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	125.0480	0.168	2	125.3951	1.062	8	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	127.0145	0.110	2	125.3951	1.062	8	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	124.4090	0.000	1	125.3951	1.062	8	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]N[5]Ru){3|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	124.8757	0.253	3	125.3951	1.062	8	125.2420	4.386	25	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:N[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(N[5]C[5]Fe)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(N[5]C[5]Fe){3|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	127.3440	0.184	3	127.3440	0.034	3	126.0808	3.911	5	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:N[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[5,6a]C[6a,6a]C[5,6a])(C[6]C[6]N[6])(N[5]C[5]Pd)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[5,6a]C[6a,6a]C[5,6a])(C[6]C[6]N[6])(N[5]C[5]Pd){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	122.8430	0.000	1	122.8430	0.000	1	126.0808	3.911	5	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:N[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(N[5]N[5]Ru)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(N[5]N[5]Ru){2|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	125.5290	0.000	1	125.5290	0.000	1	126.0808	3.911	5	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[5]-3:N[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]Ir)(N[5]N[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|Ir<8>,1|N<2>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]Ir)(N[5]N[5]Ir){1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	122.1370	0.000	1	122.1370	0.000	1	122.1370	0.000	1	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6,6]Ni)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6,6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	120.7187	0.562	3	120.7187	0.315	3	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Al)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Al)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Al)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	122.1870	0.000	1	122.1870	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|Cl<1>,1|N<3>,2|C<3>}	123.4330	0.229	2	123.4330	0.052	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	123.4567	1.068	6	123.4567	1.141	6	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	123.8840	0.014	2	123.8840	0.000	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	122.0000	0.360	3	122.0000	0.130	3	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cr)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cr)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cr)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cr)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	125.8650	0.563	2	125.8650	0.317	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	124.9160	0.206	2	124.7173	0.377	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<6>,1|N<3>,2|C<3>}	124.5185	0.964	2	124.7173	0.377	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	120.3480	0.158	2	122.1157	2.761	7	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	123.3200	0.974	4	122.1157	2.761	7	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	120.8340	0.000	1	122.1157	2.761	7	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	127.0920	0.078	2	127.0920	0.006	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	122.9993	0.533	4	122.9993	0.285	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	126.8445	0.905	4	126.8445	0.818	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	126.7568	0.648	14	125.6971	1.830	145	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	124.4229	1.218	18	125.6971	1.830	145	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	125.7607	1.315	109	125.6971	1.830	145	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	125.9873	0.410	4	125.6971	1.830	145	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	124.9424	1.427	12	125.0615	3.182	50	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	125.8402	1.442	26	125.0615	3.182	50	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	123.3170	1.730	2	125.0615	3.182	50	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	124.3342	2.396	4	125.0615	3.182	50	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	122.9915	1.514	6	125.0615	3.182	50	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	122.4515	1.139	2	122.4515	1.298	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,1|S<2>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	125.2135	1.528	31	125.2135	2.336	31	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	121.1940	0.177	2	121.6915	0.224	6	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	121.9402	0.339	4	121.6915	0.224	6	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	120.2720	0.000	1	120.2720	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	121.7400	0.000	1	121.7400	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Ir)(C[5]C[5]H){1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	122.3800	0.000	1	122.3800	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	124.8955	0.527	2	124.8955	0.278	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Mn<8>,1|H<1>,1|N<3>,2|C<3>}	122.5140	0.000	1	122.5140	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	125.3978	0.245	4	125.6740	0.299	9	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Ni<6>,1|N<3>,2|C<3>}	125.5670	0.532	2	125.6740	0.299	9	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	126.1137	0.715	3	125.6740	0.299	9	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	125.4187	0.366	3	125.4187	0.134	3	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	125.8520	0.000	1	125.8520	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Pd<4>,1|N<2>,1|N<3>,3|C<3>}	121.0600	0.000	1	121.0600	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	122.3605	0.873	2	122.1318	0.877	5	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H){1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	121.9793	1.134	3	122.1318	0.877	5	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	120.9560	0.000	1	121.8195	1.491	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H){1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	122.6830	0.000	1	121.8195	1.491	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	124.7510	0.000	1	125.6850	3.533	8	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	125.8184	1.989	7	125.6850	3.533	8	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	122.6130	0.000	1	122.6130	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(N[5]N[5]Ru)(C[5]C[5]H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	121.9450	0.431	2	121.9450	0.186	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Sm)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Sm)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	120.2650	0.000	1	120.2650	0.000	1	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	124.5250	0.129	2	122.8918	3.821	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	121.8820	0.000	1	122.8918	3.821	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|Zn<5>,1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C){1|Zn<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	120.6350	0.000	1	122.8918	3.821	4	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	123.3415	0.790	2	123.3415	0.624	2	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	122.9390	0.306	4	123.4514	0.371	10	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	123.8010	0.539	2	123.4514	0.371	10	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	123.7890	0.582	4	123.4514	0.371	10	124.8959	3.511	329	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	N[5](N[5]C[5,6a]Fe)(C[5]C[5,6a]H)(C[6]C[6]N[6])	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[5](N[5]C[5,6a]Fe)(C[5]C[5,6a]H)(C[6]C[6]N[6]){1|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	126.8727	0.167	4	126.8727	0.028	4	126.8727	0.028	4	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<2>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H){1|Cu<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	119.4390	0.375	2	119.3553	0.521	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<3>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H){1|Cu<3>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,4|C<3>}	120.0195	0.359	2	119.3553	0.521	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<3>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H){1|Cu<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,4|C<3>}	118.6075	0.565	2	119.3553	0.521	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Pd<4>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|Cu<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	119.0110	0.931	2	119.0110	0.866	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	129.2690	0.000	1	124.8350	39.321	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2){1|Pd<4>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|Pd<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	120.4010	0.000	1	124.8350	39.321	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	123.6140	0.000	1	123.6140	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	121.6940	0.000	1	121.6940	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(C[5]N[5]C)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(C[5]N[5]C){1|Ru<6>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	123.4800	0.000	1	123.4800	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<5>,4|C<3>}	121.4050	0.000	1	125.8478	9.213	4	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	127.3287	0.813	3	125.8478	9.213	4	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]W)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]W){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|W<6>,4|C<3>}	120.9480	0.000	1	120.9480	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ba)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ba)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ba<7>,1|H<1>,3|C<3>}	118.8610	0.044	2	118.8610	0.002	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ca)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ca)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ca<6>,1|H<1>,3|C<3>}	120.8060	0.601	6	120.8060	0.361	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Cr)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cr)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,3|C<3>}	122.4480	0.000	2	122.4480	0.000	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<3>,1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H){1|Cu<3>,2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,3|C<3>}	119.8860	0.000	1	119.8860	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	124.7220	0.000	1	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	123.5021	0.595	8	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	125.5623	1.119	3	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	125.6213	0.161	7	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	128.3313	0.260	4	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	127.9520	0.000	1	125.4188	3.300	24	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	123.5030	0.000	1	123.5030	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	124.0583	0.983	3	125.2536	3.768	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	123.8680	0.000	1	125.2536	3.768	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	123.6630	0.000	1	125.2536	3.768	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|Ir<6>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	127.5370	0.000	1	125.2536	3.768	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	127.3930	1.155	2	125.2536	3.768	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Li)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Li)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	120.7065	0.868	2	120.7065	0.753	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Mn)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Mn)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	123.2343	0.308	3	123.2343	0.095	3	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ni)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ni)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	125.6480	0.000	1	125.6480	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Os)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Os)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	124.2670	0.000	1	124.2670	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	123.4070	0.000	1	123.4070	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	124.2334	2.258	5	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	122.8900	0.000	1	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	123.9000	0.000	1	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	123.2232	0.364	6	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	121.8430	0.000	1	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	128.3790	0.464	2	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	126.5290	0.000	2	124.3864	4.678	18	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,3|C<3>}	122.8437	0.055	3	122.8437	0.003	3	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	123.0305	0.530	4	122.8949	0.263	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	122.7592	0.532	4	122.8949	0.263	8	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	125.8110	0.000	1	125.8110	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,3|C<3>}	123.0065	0.366	2	122.8235	0.306	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	122.4750	0.501	3	122.8235	0.306	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	123.5030	0.000	1	122.8235	0.306	6	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|N<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H){1|Ru<9>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	118.3280	0.000	1	118.3280	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|H<1>,2|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Ru<6>,1|H<1>,1|N<2>,4|C<3>}	127.2915	0.847	4	127.2915	0.717	4	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	123.1200	0.000	1	123.1200	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	123.8423	0.332	4	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	123.5650	0.696	8	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	124.1225	0.484	2	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	123.9400	0.000	1	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	126.2001	0.741	25	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	121.8490	0.000	1	125.1933	2.151	41	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,3|C<3>}	126.3360	0.170	2	126.3360	0.029	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]N[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]N[5]H){1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	124.0150	0.000	1	124.0150	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Sr)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Sr)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sr<7>,1|H<1>,3|C<3>}	119.2750	0.076	2	119.2750	0.006	2	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|O<2>,2|C<3>}	123.9060	0.000	1	123.9060	0.000	1	124.0276	6.314	159	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<5>,1|N<3>,3|C<3>}	123.7510	0.346	3	123.4358	0.267	5	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	122.9630	0.290	2	123.4358	0.267	5	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]N[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]N[5]H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	121.1270	0.008	2	121.1270	0.000	2	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	125.7410	0.001	2	125.9183	0.094	3	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	126.2730	0.000	1	125.9183	0.094	3	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]N[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]N[5]H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	123.0550	1.021	2	123.0550	1.043	2	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ni<6>,1|N<3>,3|C<3>}	124.7300	0.000	1	124.7300	0.000	1	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H){2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<9>,1|N<3>,3|C<3>}	119.4590	0.000	1	119.4590	0.000	1	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	121.3070	0.000	1	121.3070	0.000	1	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]N[5]H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]N[5]H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	122.5550	1.072	2	122.5550	1.149	2	123.1708	3.454	17	124.4146	5.571	576	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:3:	C[6]-3:N[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:C[6a]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6]Ru)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(C[6a]C[6a]2)	C[6](C[6]C[6a]C[6])(N[6]C[6,6]Ru)(N[5]C[5]2){2|H<1>,2|N<3>,4|C<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(C[6a]C[6a]2){1|Ru<5>,2|H<1>,6|C<3>}	121.8580	0.000	1	121.8580	0.000	1	121.8580	0.000	1	122.3460	0.333	3	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:3:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]2)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](C[6]C[5a,6]2)(C[6]C[6,6a]H)(C[6]N[5]N[6])	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]2){2|H<1>,6|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6,6a]H)(C[6]N[5]N[6]){1|Ru<9>,3|N<3>,5|C<3>}	122.5900	0.556	2	122.5900	0.309	2	122.5900	0.309	2	122.3460	0.333	3	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)2(N[5]C[5]2)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCCH)	C[6](C[6]C[6]C)2(N[5]C[5]2){1|Rh<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCCH){1|C<2>,1|C<4>,1|H<1>,2|C<3>}	118.8060	0.000	1	118.8060	0.000	1	118.8060	0.000	1	124.0853	7.320	6	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:4:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Ir<4>,1|H<1>,3|C<3>}	125.2770	0.000	1	125.5023	0.131	3	125.1412	0.789	5	124.0853	7.320	6	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:4:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Ir<7>,1|H<1>,3|C<3>}	125.6150	0.431	2	125.5023	0.131	3	125.1412	0.789	5	124.0853	7.320	6	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:4:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Pd<4>,1|H<1>,3|C<3>}	123.6210	0.000	1	124.5995	1.915	2	125.1412	0.789	5	124.0853	7.320	6	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:4:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Pd<4>,1|H<1>,3|C<3>}	125.5780	0.000	1	124.5995	1.915	2	125.1412	0.789	5	124.0853	7.320	6	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[5]-4:B[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]B[5]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(B[5]O[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]B[5]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(B[5]O[5]Ir){1|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|C<3>,1|C<4>,1|H<1>}	126.4190	0.000	1	126.4190	0.000	1	126.4190	0.000	1	125.1634	6.269	7	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]HH)(C[5]C[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|C<4>,4|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]HH)(C[5]C[5]Ir){2|C<3>,5|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	122.3990	0.000	1	122.3990	0.000	1	124.9542	7.154	6	125.1634	6.269	7	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]HH)(C[5]C[5]Ir)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]HH)(C[5]C[5]Ir){3|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	124.3040	0.000	1	124.3040	0.000	1	124.9542	7.154	6	125.1634	6.269	7	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]C[5]HH)(C[5]N[5]Mg)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]HH)(C[5]N[5]Mg){3|C<3>,3|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|C<4>,1|H<1>,2|C<3>}	123.1940	0.083	2	123.1940	0.007	2	124.9542	7.154	6	125.1634	6.269	7	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]PdC)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	N[5](C[6]C[6]N[6])(C[5]N[5]PdC)(C[5]C[5]H){2|H<1>,3|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,2|C<3>}	128.3170	0.000	2	128.3170	0.000	2	124.9542	7.154	6	125.1634	6.269	7	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	3:4:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]HH)2	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]HH)2{2|C<3>,6|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	123.4430	0.359	2	123.4430	0.129	2	123.4430	0.129	2	123.4430	0.129	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2){1|Br<1>,1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	117.6150	0.000	1	117.6150	0.000	1	118.2230	0.739	2	118.2230	0.739	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:3:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[5]CH)(C[5]N[5]Rh)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|Rh<6>,1|C<2>,1|N<3>,2|C<4>,3|H<1>}	N[5](C[5]C[5]CH)(C[5]N[5]Rh)(C[6]C[6]2){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	118.8310	0.000	1	118.8310	0.000	1	118.2230	0.739	2	118.2230	0.739	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:3:3:	3:3:4:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[5]CH)(C[5]N[5]Rh)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCHH)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|Rh<6>,1|C<2>,1|N<3>,2|C<4>,3|H<1>}	N[5](C[5]C[5]CH)(C[5]N[5]Rh)(C[6]C[6]2){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCHH){1|C<4>,1|H<1>,2|C<3>}	120.0780	0.000	1	120.0780	0.000	1	120.0780	0.000	1	120.0780	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:3:3:	3:4:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:Br-1:	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]HH)(Br)	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2){1|Br<1>,1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]HH)(Br){1|C<4>,2|H<1>,3|C<3>}	124.3270	0.000	1	124.3270	0.000	1	124.3270	0.000	1	124.3270	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:3:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[5]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[5]C[6a]C[5]H)(C[6]C[6]N[6])(C[5]C[5]CH)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	N[5](C[5]C[6a]C[5]H)(C[6]C[6]N[6])(C[5]C[5]CH){4|C<3>,4|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	123.9170	0.000	1	123.9170	0.000	1	123.9170	0.000	1	123.9170	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:O-1:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[5])(O)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|Cl<1>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[5])(O){1|Cl<1>,1|H<1>,2|C<4>,3|C<3>}	117.8920	0.000	1	117.8920	0.000	1	118.0545	0.053	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:O-1:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[5])(O)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|O<1>,1|S<2>,2|C<3>,4|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[5])(O){1|H<1>,1|S<2>,2|C<4>,3|C<3>}	118.2170	0.000	1	118.2170	0.000	1	118.0545	0.053	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:Cl-1:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(Cl)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|Cl<1>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(Cl){1|O<1>,2|C<3>,2|C<4>}	125.8630	0.000	1	125.8630	0.000	1	126.2130	0.245	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:Cl-1:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(Cl)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(N[5]C[5]2){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|Cl<1>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|O<1>,2|C<4>}	126.5630	0.000	1	126.5630	0.000	1	126.2130	0.245	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){3|C<3>,5|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|C<3>,3|C<4>}	120.8840	0.000	1	120.8840	0.000	1	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]C[5]CH)(C[5]C[5]HH)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]CH)(C[5]C[5]HH)(C[6]C[6]2){1|O<1>,2|C<3>,5|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>,2|C<4>}	121.9190	0.000	1	121.9190	0.000	1	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>,2|C<4>}	120.6415	0.776	4	121.1196	0.554	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,4|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>,2|C<4>}	121.7460	0.006	2	121.1196	0.554	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,4|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>,2|C<4>}	121.4495	0.398	2	121.1196	0.554	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	122.1295	0.685	2	121.9855	0.796	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	121.8355	0.325	2	121.9855	0.796	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>,2|C<4>}	122.5945	1.449	2	121.9855	0.796	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)2(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){2|C<3>,6|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|C<4>}	121.3825	1.158	2	121.9855	0.796	8	121.5358	0.766	18	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(N[5]C[5]2){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|Cl<1>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(O){2|Cl<1>,1|C<3>,2|C<4>}	116.9660	0.000	1	116.9660	0.000	1	118.3445	3.801	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:1:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	N[5](C[5]C[5]CH)(C[5]C[5]HH)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]CH)(C[5]C[5]HH)(C[6]C[6]2){1|O<1>,2|C<3>,5|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	119.7230	0.000	1	119.7230	0.000	1	118.3445	3.801	2	121.3695	4.557	24	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:2:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:S-2:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|O<1>,1|S<2>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a]){1|O<1>,2|C<3>,2|C<4>}	125.9090	0.000	1	125.9090	0.000	1	125.9090	0.000	1	125.9090	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	4:4:3:	3:3:3:	C[6]-3:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(CN[5]O)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){3|C<3>,5|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(CN[5]O){1|C<3>,1|H<1>,3|C<4>}	124.2640	0.000	1	124.2640	0.000	1	124.2640	0.000	1	124.2640	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:3:3:	6:3:3:	3:3:1:	N[5]-3:C[6]-3:N[6]-3:	In[5,5]-6:C[5,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H)	N[5](In[5,5]N[5,5]N[5,6]Cl3)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H){3|Cl<1>,2|H<1>,2|N<3>,3|C<3>}	N[5](In[5,5]N[5,5]N[5,6]Cl3)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6]){1|N<2>,3|H<1>,6|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	121.0450	0.000	1	121.0450	0.000	1	121.0450	0.000	1	121.0450	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:4:3:	3:3:3:	3:3:1:	N[5]-3:N[6]-4:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu2)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C){1|Cu<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	121.4380	0.409	2	121.4380	0.167	2	121.4380	0.167	2	121.4380	0.167	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:4:3:	3:3:3:	3:4:1:	N[5]-3:C[6]-4:C[6]-3:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:H-1:	C[6](N[5]C[5,6a]C[5])(C[6]C[6]HH)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]HH)(H)	C[6](N[5]C[5,6a]C[5])(C[6]C[6]HH)(C[6]C[6]H){1|N<2>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(C[6]C[6]2){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]N[6]HH)(H){2|C<3>,2|C<4>,2|H<1>}	121.4360	0.000	1	121.4360	0.000	1	121.4360	0.000	1	122.6830	3.110	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	3:4:3:	3:3:3:	3:4:1:	N[5]-3:N[6]-4:C[6]-3:	C[6]-3:N[5]-3:C[5]-3:	C[6]-3:C[6]-4:H-1:	C[6](N[5]C[5]N[5])(N[6]C[6]RuB)(C[6]C[6]H)	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](C[6]N[5]N[6])(C[6]C[6]HH)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]RuB)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C){1|B<5>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]HH)(H){1|Ru<7>,1|B<5>,1|H<1>,1|N<3>,2|C<3>}	123.9300	0.000	1	123.9300	0.000	1	123.9300	0.000	1	122.6830	3.110	2	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:2:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:N[5]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]TaO)(C[6]C[6]H)(N[5]N[5]2)	N[5](N[5]C[5,6a]Ta)(N[5]C[5,6a])(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(N[5]N[5]2){1|C<4>,1|H<1>,3|C<3>}	N[5](N[5]C[5,6a]Ta)(N[5]C[5,6a])(C[6]C[6]2){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Ta<7>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	118.6650	0.000	1	118.6650	0.000	1	118.6650	0.000	1	118.6650	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:3:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]ErN)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Er)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]N[5]Er)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Er<10>,1|H<1>,1|N<3>,3|C<3>}	117.1610	0.261	4	117.1610	0.068	4	116.7464	0.697	12	115.4967	10.776	14	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:3:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]N[5]Yb)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]N[5]Yb)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Yb<10>,1|H<1>,1|N<3>,3|C<3>}	116.5391	0.959	8	116.5391	0.919	8	116.7464	0.697	12	115.4967	10.776	14	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:3:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:O-1:	C[6](C[6]C[6]HH)(C[6]N[6]O)(N[5]C[5]2)	N[5](C[5]C[5,6a]O)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(N[6]C[6]H)(O)	C[6](C[6]C[6]HH)(C[6]N[6]O)(N[5]C[5]2){2|O<1>,3|C<3>,3|H<1>}	N[5](C[5]C[5,6a]O)2(C[6]C[6]2){1|C<4>,1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[5])(N[6]C[6]H)(O){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	107.9985	1.111	2	107.9985	1.234	2	107.9985	1.234	2	115.4967	10.776	14	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:3:3:	3:3:4:	C[6]-4:C[6]-3:N[5]-3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[5]C[5]H)(C[5]N[5]P)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,1|P<4>,2|C<3>,3|H<1>}	N[5](C[5]C[5]H)(C[5]N[5]P)(C[6]C[6]2){1|Ru<6>,1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3){1|Ru<6>,2|C<4>,3|C<3>}	118.9630	0.000	1	118.9630	0.000	1	118.9630	0.000	1	118.9630	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	3:4:4:	3:3:1:	C[5,6]-4:C[6]-3:N[5]-3:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[5,6]C[6])(C[5]C[5]HH)2	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,4|C<4>,6|H<1>}	N[5](C[6]C[5,6]C[6])(C[5]C[5]HH)2{1|Fe<10>,1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,4|C<4>}	120.6830	0.000	1	120.6830	0.000	1	120.6830	0.000	1	120.6830	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	4:3:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]CH)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|O<1>,1|O<2>,2|C<3>,4|H<1>}	N[5](C[5]C[6a]C[5]H)(C[5]O[5]O)(C[6]C[6]2){2|C<4>,3|C<3>,4|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	120.7170	0.000	1	120.7170	0.000	1	120.7170	0.000	1	120.7170	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP2	C[6]	N[5]	C[6]	4:3:3:	4:4:3:	3:3:1:	C[6]-4:C[6]-3:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]HH)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,3|C<4>,6|H<1>}	N[5](C[5]C[5]HH)2(C[6]C[6]2){1|C<3>,1|C<4>,7|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){3|C<4>,4|H<1>}	121.8640	0.000	1	121.8640	0.000	1	121.8640	0.000	1	121.8640	0.000	1	123.9181	8.015	676	123.8759	8.019	691
762	542	762	0:SP2_SP2_SP3	C[6]	N[5]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	123.9077	0.350	3	123.9077	0.123	3	123.9077	0.123	3	123.9077	0.123	3	122.6423	3.391	7	122.6423	3.391	7
762	542	762	0:SP2_SP2_SP3	C[6]	N[5]	C[6]	3:3:3:	3:3:4:	3:3:1:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:C[6]-3:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(C[6]C[6]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]C[5]HH)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,3|C<3>,4|H<1>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])(C[5]C[5]HH){1|Rh<8>,3|H<1>,4|C<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	120.9025	0.521	2	120.9025	0.272	2	120.9025	0.272	2	120.9025	0.272	2	122.6423	3.391	7	122.6423	3.391	7
762	542	762	0:SP2_SP2_SP3	C[6]	N[5]	C[6]	3:3:3:	3:4:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O)	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(C[5]C[5]HH)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(C[5]C[5]HH){1|O<1>,2|C<3>,5|H<1>}	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	124.5960	0.000	1	124.5960	0.000	1	124.5960	0.000	1	124.5960	0.000	1	122.6423	3.391	7	122.6423	3.391	7
762	542	762	0:SP2_SP2_SP3	C[6]	N[5]	C[6]	4:3:3:	4:3:3:	3:3:4:	C[6]-4:C[6]-3:N[5]-3:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2)	N[5](C[5]C[5]HH)(C[5]N[5]Ru)(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	N[5](C[5]C[5]HH)(C[5]N[5]Ru)(C[6]C[6]2){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3){1|Ru<6>,2|C<3>,3|C<4>}	120.3720	0.000	1	120.3720	0.000	1	120.3720	0.000	1	120.3720	0.000	1	122.6423	3.391	7	122.6423	3.391	7
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,3x6]	C[6,6]	3:3:1:	4:4:3:	3:4:4:	N[5,3x6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[5,6,6]-4:C[6,6]-3:	C[6,6]-3:C[3x6]-4:C-4:	C[6,6](N[5,3x6]C[5,6,6]2)(C[6,6]C[3x6]C)(H)	N[5,3x6](C[5,6,6]C[5,5]C[6,6]H)(C[5,6,6]C[6,6]C[5]H)(C[6,6]C[6,6]H)	C[6,6](C[6,6]N[5,3x6]H)(C[3x6]C[6,6]2H)(CCHO)	C[6,6](N[5,3x6]C[5,6,6]2)(C[6,6]C[3x6]C)(H){3|H<1>,4|C<4>}	N[5,3x6](C[5,6,6]C[5,5]C[6,6]H)(C[5,6,6]C[6,6]C[5]H)(C[6,6]C[6,6]H){2|C<3>,3|C<4>,5|H<1>}	C[6,6](C[6,6]N[5,3x6]H)(C[3x6]C[6,6]2H)(CCHO){3|C<4>,3|H<1>}	117.6030	0.000	1	117.6030	0.000	1	117.6030	0.000	1	117.6030	0.000	1	117.6030	0.000	1	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6,6]	C[6]	3:4:3:	4:3:3:	3:3:1:	N[5,6,6]-3:C[6]-4:C[6]-3:	C[5,6,6]-4:C[5,6]-3:C[6,6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6](N[5,6,6]C[5,6,6]C[5,6])(C[6]C[6a]2C[6])(C[6]C[6]H)	N[5,6,6](C[5,6,6]C[5,6]C[6]N[6])(C[5,6]C[5]C[6])(C[6,6]C[6]2)	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[5,6,6]C[5,6,6]C[5,6])(C[6]C[6a]2C[6])(C[6]C[6]H){1|H<1>,1|N<3>,1|O<1>,2|C<4>,6|C<3>}	N[5,6,6](C[5,6,6]C[5,6]C[6]N[6])(C[5,6]C[5]C[6])(C[6,6]C[6]2){6|C<3>,7|H<1>}	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	116.9450	0.000	1	116.9450	0.000	1	116.9450	0.000	1	116.9450	0.000	1	116.9450	0.000	1	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:3:	3:3:3:	3:3:2:	N[5,6]-3:C[6,6]-3:C[6]-3:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[6,6]-3:C[6]-3:O[6]-2:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]H)	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6]O)(O[6]C[6])	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O){1|C<2>,1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6]O)(O[6]C[6]){1|C<2>,1|O<1>,2|H<1>,3|C<3>}	116.1140	0.000	1	116.1140	0.000	1	116.1140	0.000	1	116.1140	0.000	1	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[6,6]-3:N[6]-3:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[6,6]-3:C[6]-3:C[6]-3:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Ir)	N[5,6](C[6,6]C[6,6]N[6])(C[5,6]C[6]N[5])(C[5]C[5]Ir)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Ir){1|N<3>,3|C<3>,3|H<1>}	N[5,6](C[6,6]C[6,6]N[6])(C[5,6]C[6]N[5])(C[5]C[5]Ir){1|Ir<8>,1|H<1>,4|C<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Ir<8>,1|H<1>,4|C<3>}	119.5310	0.000	1	119.5310	0.000	1	118.7590	1.050	4	118.7590	1.050	4	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[6,6]-3:N[6]-3:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[6,6]-3:C[6]-3:C[6]-3:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Pd)	N[5,6](C[6,6]C[6,6]N[6])(C[5,6]C[6]N[5])(C[5]C[5]Pd)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Pd){1|N<3>,3|C<3>,3|H<1>}	N[5,6](C[6,6]C[6,6]N[6])(C[5,6]C[6]N[5])(C[5]C[5]Pd){1|Pd<4>,1|H<2>,4|C<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Pd<4>,1|H<1>,4|C<3>}	118.5017	1.085	3	118.5017	1.177	3	118.7590	1.050	4	118.7590	1.050	4	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:3:	3:3:4:	3:4:3:	N[5,6]-3:C[6]-3:C[6,6]-3:	C[6,6]-3:C[5,6]-3:C[5]-4:	C[6,6]-3:C[6]-4:C[6]-3:	C[6,6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]O)(C[6,6]C[6]2)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH)	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6,6a]O)	C[6,6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]O)(C[6,6]C[6]2){1|C<4>,1|N<3>,1|O<1>,3|H<1>,4|C<3>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6,6a]O){1|C<4>,1|O<1>,6|C<3>}	120.2300	0.000	2	120.2300	0.000	2	120.2300	0.000	2	120.2300	0.000	2	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:4:	3:3:4:	3:4:3:	N[5,6]-3:C[6,6]-3:C[6]-4:	C[6,6]-3:C[5,6]-3:C[5]-4:	C[6,6]-3:C[6]-4:C[6]-3:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH)	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6]O)	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH){1|C<4>,1|N<3>,1|O<1>,3|C<3>,5|H<1>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]N[5])(C[5]C[5]HH){1|C<2>,1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6]O){1|C<2>,2|C<4>,3|C<3>,4|H<1>}	120.0480	0.000	2	120.0480	0.000	2	120.2186	0.057	5	120.2186	0.057	5	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6,6]	N[5,6]	C[6,6]	3:3:4:	3:3:4:	3:4:3:	N[5,6]-3:C[6,6]-3:C[6]-4:	C[6,6]-3:C[5,6]-3:C[5]-4:	C[6,6]-3:C[6]-4:C[6]-3:	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH)	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]S[5])(C[5]C[5]HH)	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6]O)	C[6,6](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH){1|O<1>,1|S<2>,2|C<3>,3|H<1>,4|C<4>}	N[5,6](C[6,6]C[6,6]C[6])(C[5,6]C[6]S[5])(C[5]C[5]HH){2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]N[5,6]C[6])(C[6]C[6a]C[6]H)(C[6]C[6]O){2|C<4>,4|C<3>,4|H<1>}	120.3323	0.256	3	120.3323	0.066	3	120.2186	0.057	5	120.2186	0.057	5	119.3919	1.868	12	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6,6]	3:3:1:	4:3:4:	4:3:3:	C[6,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6,6]-4:C[6]-3:C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	C[6,6](C[6,6]C[6]2H)(C[6]N[5,6]O)(C[6]O[6]C)	C[6](C[6,6]C[6,6]C[6])(N[5,6]C[5,6]C[5])(O){1|O<2>,4|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<4>,3|C<3>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]N[5,6]O)(C[6]O[6]C){3|C<4>,4|H<1>}	116.8760	0.000	1	116.8760	0.000	1	116.8760	0.000	1	116.8760	0.000	1	116.8760	0.000	1	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:2:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ge[5]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ge[5]N[5,6a])(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ge[5]N[5,6a])(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<2>,2|C<3>}	121.5390	0.000	1	121.5390	0.000	1	121.5390	0.000	1	120.9086	0.404	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:2:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ge[5]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6])(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>}	121.2730	0.168	2	121.2730	0.028	2	121.2730	0.028	2	120.9086	0.404	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:2:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:P[5]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6])(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	120.2290	0.000	2	120.2290	0.000	2	120.2290	0.000	2	120.9086	0.404	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5]){1|Co<6>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	117.3420	0.000	1	117.6573	0.228	4	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5]){1|Fe<6>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	117.7623	0.525	3	117.6573	0.228	4	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5]){1|Co<6>,1|H<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	116.8150	0.000	1	116.6395	0.062	2	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5]){1|Mn<6>,1|H<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	116.4640	0.000	1	116.6395	0.062	2	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){1|Cd<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	116.7960	0.000	1	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){1|Co<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	116.6230	0.000	1	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){1|Cu<5>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	116.4335	0.006	2	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){1|Mn<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	116.7150	0.000	1	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){1|Zn<4>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	116.7347	0.138	4	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5]){2|Ag<5>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|N<2>}	116.1970	0.013	2	116.5758	0.056	11	116.8378	0.301	17	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	117.5900	0.000	1	117.6110	0.001	2	119.0962	2.978	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5]){1|Cl<1>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	117.6320	0.000	1	117.6110	0.001	2	119.0962	2.978	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]Ge[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|S<2>}	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]Ge[5]){1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	120.3480	0.000	1	120.3480	0.000	1	119.0962	2.978	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]In[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|S<2>}	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]In[5]){2|Cl<1>,1|C<3>,2|H<1>,2|O<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	120.8150	0.000	1	120.8150	0.000	1	119.0962	2.978	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:P[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]){2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	118.7330	0.000	1	118.7330	0.000	1	118.7330	0.000	1	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:S[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(S[5]C[5])	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(S[5]C[5]){1|Cu<4>,1|C<3>,1|N<2>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	119.4340	0.000	1	119.4340	0.000	1	119.4340	0.000	1	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:Se[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(Se[5]N[5])	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(Se[5]N[5]){2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	120.8820	0.000	1	120.8820	0.000	1	120.8820	0.000	1	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){1|Pt<4>,1|C<3>,3|H<1>}	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	110.9620	0.403	2	110.6655	0.185	4	110.6655	0.185	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){2|Pd<4>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<2>}	110.3690	0.201	2	110.6655	0.185	4	110.6655	0.185	4	116.5835	7.851	28	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:B[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	121.4560	0.000	1	121.4560	0.000	1	121.4560	0.000	1	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5,6]C[6])(C[5,6]C[6]P[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	N[5,6](C[5,6]N[5,6]C[6])(C[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.8280	0.000	2	118.8113	0.001	3	118.8113	0.001	3	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5,6]C[6])(C[5,6]C[6]P[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	N[5,6](C[5,6]N[5,6]C[6])(C[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>,4|F<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.7780	0.000	1	118.8113	0.001	3	118.8113	0.001	3	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:Cl-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]C)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]C)(C[6]C[6]H){1|Re<6>,2|Cl<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl){1|Cl<1>,2|C<3>}	117.0570	0.000	1	117.0570	0.000	1	117.0570	0.000	1	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H){1|Se<2>,1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.8525	0.149	2	119.8525	0.022	2	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H){1|Ru<6>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.5510	0.000	1	118.5120	0.041	3	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H){1|Ru<6>,1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.4925	0.281	2	118.5120	0.041	3	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]Os)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]Os)(C[6]C[6]H){1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.7900	0.065	2	119.7900	0.004	2	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Cd<5>,1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.5390	0.000	1	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Cd<5>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.2467	1.008	3	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Co<5>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	117.9940	0.000	1	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Co<6>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.1765	0.525	2	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Fe<5>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.1980	0.011	2	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Fe<5>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.5210	0.000	1	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Fe<6>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.7800	0.123	2	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Zn<4>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.5780	0.000	1	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Zn<5>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.0057	0.815	3	118.9186	0.651	16	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|Fe<6>,1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.5820	0.000	1	118.7535	0.059	2	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|Ru<6>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.9250	0.000	1	118.7535	0.059	2	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Co<6>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.8645	0.040	2	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Cu<3>,1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.8250	0.341	2	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Cu<5>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.8730	0.798	2	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Fe<6>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	120.0640	0.000	1	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Pt<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.8960	0.000	1	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Re<6>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.4260	0.000	1	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){1|Ru<9>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.1845	0.370	2	119.0800	0.506	11	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Pt<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.6760	0.000	1	118.6760	0.000	1	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H){1|Co<4>,1|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.9860	0.000	1	119.4312	1.084	5	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H){1|Pt<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.3750	0.000	1	119.4312	1.084	5	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H){1|Pt<5>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.9720	0.000	1	119.4312	1.084	5	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H){1|Ru<6>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.9115	1.860	2	119.4312	1.084	5	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H){1|Fe<6>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	119.7440	0.000	1	119.7440	0.000	1	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|P<2>,1|P<3>}	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H){1|Mo<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	120.5953	0.421	3	120.6070	0.119	4	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|P<2>}	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	120.6420	0.000	1	120.6070	0.119	4	119.2109	0.722	47	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:P[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N){2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	121.0850	0.000	1	121.0850	0.000	1	121.0850	0.000	1	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]H){1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	118.3400	0.028	2	118.3400	0.001	2	119.0607	1.558	3	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6a]C[5a,6a]C[5,6a])(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	N[5,6](C[5,6a]C[5a,6a]C[5,6a])(C[5,6]C[6]N[5])(C[6]C[6]H){1|Cu<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	120.5020	0.000	1	120.5020	0.000	1	119.0607	1.558	3	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ge[5,6]N[5,6,6]N[6,6])(C[5,6]C[5,6,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	N[5,6](Ge[5,6]N[5,6,6]N[6,6])(C[5,6]C[5,6,6]C[6])(C[6]C[6]H){3|C<3>,3|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	120.8040	0.000	1	120.7520	0.005	2	120.7520	0.005	2	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ge[5,6]N[5,6,6]N[6,6])(C[5,6]C[5,6,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	N[5,6](Ge[5,6]N[5,6,6]N[6,6])(C[5,6]C[5,6,6]C[6])(C[6]C[6]H){2|H<1>,3|C<3>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	120.7000	0.000	1	120.7520	0.005	2	120.7520	0.005	2	119.2694	0.959	58	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H)	N[5,6](C[5,6]C[6,6a]C[5,5])(C[5]C[5,5]O)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(CC3)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H){1|O<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5,5])(C[5]C[5,5]O)(C[6]C[6]H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(CC3){1|H<1>,4|C<3>}	122.7410	0.000	1	122.7410	0.000	1	122.7410	0.000	1	122.7410	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	3:4:1:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:H-1:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H){1|C<3>,1|C<4>,6|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H){1|H<1>,1|N<3>,2|C<3>}	121.1930	0.000	1	121.1930	0.000	1	121.1930	0.000	1	121.1930	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:2:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:N[6]-2:C-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]S)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6])(CC[6a]H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O){1|C<4>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]S)(C[6]C[6]O){1|N<2>,1|O<1>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]O)(N[6]C[6])(CC[6a]H){1|C<3>,1|C<4>,1|O<1>}	116.6370	0.000	1	116.6370	0.000	1	116.6370	0.000	1	116.6370	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]Cl)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]Cl){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	121.3770	0.037	3	121.3770	0.001	3	121.5000	0.031	6	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl){1|C<3>,1|O<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	121.6080	0.000	1	121.6230	0.031	3	121.5000	0.031	6	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl){1|Cl<1>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	121.6305	0.250	2	121.6230	0.031	3	121.5000	0.031	6	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]OO)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<2>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]OO)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<4>,2|C<3>}	121.0830	0.000	1	121.0830	0.000	1	121.0830	0.000	1	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:B[5,5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6a]C[6])(B[5,5]C[5,6a]3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(B[5,5]C[5,6a]3)(C[6]C[6]H){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	121.8870	0.000	1	121.8870	0.000	1	121.0692	0.234	5	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:B[5,5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(B[5,5]O[5]3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|O<2>}	N[5,6](C[5,6]C[5]C[6])(B[5,5]O[5]3)(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	120.8648	0.183	4	120.8648	0.034	4	121.0692	0.234	5	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5])(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5])(C[5]C[5]CH)(C[6]C[6]H){3|C<3>,3|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	120.4020	0.000	1	120.4020	0.000	1	120.4020	0.000	1	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6a]C[6])(C[5]C[5,6a]C[3]C)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(C[5]C[5,6a]C[3]C)(C[6]C[6]H){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.3600	0.000	1	117.3600	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]CH)(C[6]C[6]H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.2750	0.000	1	118.2750	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]OsC)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]OsC)(C[6]C[6]H){1|Os<5>,1|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	120.4360	0.000	1	120.4360	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CC)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CC)(C[6]C[6]H){1|C<3>,1|O<1>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.9780	0.000	1	118.9780	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CH)(C[6]C[6]H){1|C<3>,1|O<1>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.2150	0.000	1	119.2150	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H){1|C<3>,1|O<1>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.8830	0.000	1	118.8830	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]N[5]CH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]N[5]CH)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	119.3610	0.000	1	119.3610	0.000	1	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	120.0687	0.393	3	120.0687	0.154	3	119.2714	0.941	10	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Fe2)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){2|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Fe2)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	122.2700	1.071	2	122.2700	1.146	2	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	120.8130	0.000	1	121.3160	0.506	2	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.8190	0.000	1	121.3160	0.506	2	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3)(C[6]C[6]H){2|Si<4>,2|C<4>,4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.6560	0.000	1	121.6560	0.000	1	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	122.0830	0.000	1	121.5450	0.579	2	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H){2|Si<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.0070	0.000	1	121.5450	0.579	2	121.7026	0.538	7	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ge[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	120.8760	0.413	2	120.8760	0.171	2	120.8760	0.171	2	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]Cl2)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]Cl2)(C[6]C[6]H){2|Si<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	121.9890	0.000	1	121.9890	0.000	1	121.9075	0.013	2	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]II)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,2|I<1>}	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]II)(C[6]C[6]H){2|Si<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	121.8260	0.000	1	121.8260	0.000	1	121.9075	0.013	2	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:P[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(P[5]O[5]CW)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,1|W<6>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(P[5]O[5]CW)(C[6]C[6]H){2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	120.2340	0.199	2	120.2340	0.040	2	120.2340	0.040	2	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-4:C[6]-3:	C[4,6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H)	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H)	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H){2|Si<4>,1|C<3>,2|C<4>}	124.7610	0.000	1	124.7610	0.000	1	124.7610	0.000	1	120.8448	1.787	37	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|C<4>,1|N<3>}	120.0850	0.000	1	120.0850	0.000	1	120.0850	0.000	1	117.9924	3.082	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:N-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]N[5]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]N[5]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	118.1970	0.000	1	118.1970	0.000	1	118.2237	0.013	3	117.9924	3.082	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:N-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	118.2370	0.158	2	118.2370	0.025	2	118.2237	0.013	3	117.9924	3.082	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(C[6a]C[6a]2)(C[6]N[6]S)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O){1|C<4>,1|S<1>,2|C<3>,2|H<1>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]C[6]O){2|H<1>,4|C<3>}	C[6](C[6]N[5,6]O)(C[6a]C[6a]2)(C[6]N[6]S){1|C<4>,2|H<1>,4|C<3>}	115.2060	0.000	1	115.2060	0.000	1	115.2060	0.000	1	117.9924	3.082	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]Br2)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){2|Br<1>,1|H<1>,3|C<3>}	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]Br2)(C[6]C[6]H){1|C<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|B<4>,1|C<3>,1|H<1>}	120.8440	0.000	1	120.8440	0.000	1	120.8440	0.000	1	121.0722	1.215	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	118.9830	0.000	1	118.9830	0.000	1	121.1178	1.504	5	121.0722	1.215	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H){1|C<3>,1|N<3>,1|O<2>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	121.6515	0.325	4	121.6515	0.106	4	121.1178	1.504	5	121.0722	1.215	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:4:3:	5:3:3:	C[6]-3:N[5,6]-3:H-1:	C[5,6]-3:B[5]-4:C[6]-3:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H)	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]CC)(C[6]C[6]H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H){1|H<1>,2|C<4>,3|C<3>,4|B<6>}	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]CC)(C[6]C[6]H){1|C<5>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H){1|B<4>,1|C<3>,1|C<5>,5|B<6>,5|H<1>}	123.3020	0.000	1	123.3020	0.000	1	123.3020	0.000	1	123.3020	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5,5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6]2O[5]O)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6]2O[5]O)(C[6]C[6]H){1|H<1>,7|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<5>,2|C<3>}	122.2270	0.608	2	122.2270	0.370	2	122.2270	0.370	2	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[5,6]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5,6]N[5,6]Se[6]2Cl)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H){1|Cl<1>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5,6]N[5,6]Se[6]2Cl)(C[6]C[6]H){1|In<4>,1|In<6>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<5>,2|C<3>}	122.0140	1.858	2	122.0140	3.453	2	122.0140	3.453	2	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3Fe)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Fe<11>,1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3Fe)(C[6]C[6]H){2|Si<4>,1|C<3>,2|H<1>,6|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	122.6180	0.099	2	122.6180	0.010	2	122.6180	0.010	2	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CCO)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CCO)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.5350	0.544	2	121.5350	0.296	2	121.4980	0.082	7	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]Cl3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]Cl3)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.3810	0.305	2	121.3810	0.093	2	121.4980	0.082	7	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.6465	0.105	2	121.5513	0.033	3	121.4980	0.082	7	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H){2|C<3>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.3610	0.000	1	121.5513	0.033	3	121.4980	0.082	7	121.8618	0.559	13	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[3x5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H){1|H<1>,9|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	122.5810	0.243	3	122.5810	0.059	3	122.5810	0.059	3	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	122.4130	0.010	2	122.4130	0.000	2	122.3720	0.005	3	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	122.2900	0.000	1	122.2900	0.000	1	122.3720	0.005	3	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5,6]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	121.5085	0.989	4	121.5085	0.978	4	121.5085	0.978	4	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ga[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	121.6160	0.000	1	121.6160	0.000	1	121.6160	0.000	1	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Ge[3x5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ge[3x5]N[5,6]C[5]O[5]3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ge[3x5]N[5,6]C[5]O[5]3)(C[6]C[6]H){2|C<4>,2|H<1>,7|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<6>,2|C<3>}	121.4450	0.622	2	121.4450	0.387	2	121.4450	0.387	2	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[3x5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(In[3x5]N[5,6]2O[5]3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(In[3x5]N[5,6]2O[5]3)(C[6]C[6]H){1|H<1>,9|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.2535	0.517	6	122.2535	0.267	6	122.2535	0.267	6	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[5,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5,5]N[5,6a]N[5,6]2II)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5,5]N[5,6a]N[5,6]2II)(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.3045	0.299	2	122.3045	0.089	2	122.2850	0.046	3	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[5,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(In[5,5]N[5,6a]N[5,6]2II)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(In[5,5]N[5,6a]N[5,6]2II)(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.2460	0.000	1	122.2460	0.000	1	122.2850	0.046	3	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5]N[5,6]O4)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(In[5]N[5,6]O4)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.6577	2.040	4	122.6577	4.163	4	122.7016	3.132	5	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(In[5]N[5,6a]ClO3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(In[5]N[5,6a]ClO3)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.8770	0.000	1	122.8770	0.000	1	122.7016	3.132	5	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[4,5,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5,5]N[4]2O[5]3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5,5]N[4]2O[5]3)(C[6]C[6]H){1|H<1>,2|C<4>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.3400	0.000	1	121.3400	0.000	1	121.3400	0.000	1	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]Br2)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]Br2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.7890	0.000	1	121.7890	0.000	1	121.6898	0.028	5	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]Cl2)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]Cl2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.5790	0.000	1	121.5790	0.000	1	121.6898	0.028	5	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]NN)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<2>,2|N<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[4,5]N[4]2O[5]NN)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.6937	0.213	3	121.6937	0.045	3	121.6898	0.028	5	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]Cl4)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){4|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]Cl4)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.2970	0.414	2	121.2970	0.172	2	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]N4)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|N<2>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]N4)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.8230	0.153	2	121.8230	0.023	2	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]N[5a]2NN)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Si[5]N[5,6]N[5a]2NN)(C[6]C[6]H){1|H<1>,4|C<3>,4|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	120.7690	0.955	2	120.7690	0.911	2	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]CF3)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]CF3)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	122.1525	0.428	2	122.1525	0.183	2	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]Cl4)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){4|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]Cl4)(C[6]C[6]H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.0960	0.000	1	121.0960	0.000	1	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]N[5a]2NN)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Si[5]N[5,6a]N[5a]2NN)(C[6]C[6]H){1|H<1>,4|C<3>,4|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	121.6080	0.000	1	121.6080	0.000	1	121.4787	0.408	10	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[3x5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|N<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H){11|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	121.5303	0.474	6	121.5303	0.224	6	121.5303	0.224	6	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Ga[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.0300	1.010	2	122.0300	1.020	2	122.0300	1.020	2	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	122.4360	0.265	4	122.5383	0.111	8	122.5383	0.111	8	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	122.6405	0.401	4	122.5383	0.111	8	122.5383	0.111	8	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Nb[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Nb[5]N[5,6]N3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,3|N<2>}	N[5,6](C[5,6]C[5,6]C[6])(Nb[5]N[5,6]N3O)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	122.3630	0.124	2	122.3630	0.015	2	122.3630	0.015	2	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:P[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6]F4)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|F<1>}	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6]F4)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	120.1620	0.000	1	120.1620	0.000	1	120.1620	0.000	1	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:Si[5]-6:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CF3)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CF3)(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.6485	0.080	2	121.6485	0.006	2	121.6485	0.006	2	121.9624	0.658	64	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:C-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5]C[6])(In[5]O[5]Cl3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|O<2>,1|O<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(In[5]O[5]Cl3O)(C[6]C[6]H){1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO){1|In<6>,1|C<3>,1|H<1>}	121.9050	0.000	1	121.9050	0.000	1	121.9050	0.000	1	121.9050	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|In<6>,1|C<3>,1|H<1>}	123.7110	0.217	4	123.5230	0.118	6	123.5230	0.118	6	123.5230	0.118	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:6:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:In[5]-6:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|In<6>,1|C<3>,1|H<1>}	123.1470	0.158	2	123.5230	0.118	6	123.5230	0.118	6	123.5230	0.118	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	3:7:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6a]-3:Nb[3x5]-7:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Nb[3x5]N[5,6]2O[5]3O)(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Nb[3x5]N[5,6]2O[5]3O)(C[6]C[6]H){1|H<1>,9|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Nb<7>,2|C<3>}	122.3455	0.612	2	122.3455	0.374	2	122.3455	0.374	2	122.3455	0.374	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[4,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[4,5]C[4,5]C[6a]O[4])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	N[5,6](B[4,5]C[4,5]C[6a]O[4])(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	122.3890	0.000	1	122.3890	0.000	1	122.3890	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,5]C[5]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	N[5,6](B[5,5]C[5]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<3>,2|B<3>,2|C<4>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	121.0900	0.000	1	121.0900	0.000	1	121.0900	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:F-1:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H)	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[6]N[5])(C[6]C[6]H){1|C<3>,1|F<1>,5|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F){1|B<4>,1|C<3>,1|H<1>}	121.0650	0.000	1	121.0650	0.000	1	121.0650	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<3>,5|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	122.4910	0.272	2	122.4914	0.073	5	122.4914	0.073	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H){1|Si<4>,1|C<3>,4|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	122.1600	0.000	1	122.4914	0.073	5	122.4914	0.073	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]H){2|C<3>,4|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	122.6575	0.227	2	122.4914	0.073	5	122.4914	0.073	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6a]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,6a]C[6a,6a]2C[5,6a])(C[5,6]C[5,6a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	N[5,6](B[5,6a]C[6a,6a]2C[5,6a])(C[5,6]C[5,6a]C[6])(C[6]C[6]H){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	120.8385	0.057	2	120.8385	0.003	2	120.5693	0.219	3	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5,6a]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5,6a]C[6a,6a]N[5,6a]O)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	N[5,6](B[5,6a]C[6a,6a]N[5,6a]O)(C[5,6]C[5]C[6])(C[6]C[6]H){1|N<2>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	120.0310	0.000	1	120.0310	0.000	1	120.5693	0.219	3	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	N[5,6](B[5]C[5,5a]C[6a]2)(C[5,6]C[5,5a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	N[5,6](B[5]C[5,5a]C[6a]2)(C[5,6]C[5,5a]C[6])(C[6]C[6]H){1|S<2>,2|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	122.5370	0.000	1	122.5370	0.000	1	121.4073	0.278	10	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	121.3109	0.379	7	121.3109	0.143	7	121.4073	0.278	10	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	N[5,6](B[5]C[6a]C[5]C)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	N[5,6](B[5]C[6a]C[5]C)(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	121.4930	0.000	1	121.4930	0.000	1	121.4073	0.278	10	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	120.8670	0.000	1	120.8670	0.000	1	121.4073	0.278	10	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,5]C[5,5]C[5]H)(C[5,6]Se[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5]C[5,5]C[5]H)(C[5,6]Se[5]C[6])(C[6]C[6]H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	120.7490	0.000	1	120.7490	0.000	1	120.7490	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6,6]C[5,6,6]C[6,6]O)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>}	N[5,6](C[5,6,6]C[5,6,6]C[6,6]O)(C[5,6]C[5,6]C[6])(C[6]C[6]H){1|N<3>,3|C<3>,3|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	119.0210	0.000	1	119.0210	0.000	1	119.0210	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6]C)(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,1|N<2>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6]C)(C[5,6]C[6]N[5])(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.1680	0.000	1	119.1680	0.000	1	118.8925	0.152	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6])(C[6]C[6]H){1|Br<1>,2|C<3>,2|C<4>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.6170	0.000	1	118.6170	0.000	1	118.8925	0.152	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]O)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<2>,1|O<1>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]O)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	119.6820	0.000	1	119.6820	0.000	1	119.5935	0.016	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]C)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]C)(C[6]C[6]H){2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	119.5050	0.000	1	119.5050	0.000	1	119.5935	0.016	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|N<2>,1|O<1>,3|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.9780	0.000	1	119.9780	0.000	1	119.9780	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H){1|C<4>,1|O<1>,4|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H){1|N<3>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	118.0920	0.000	1	118.0920	0.000	1	118.0920	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:N[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]N[5]H)(N[5]C[6a]N[5])(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H){1|H<1>,2|N<3>,3|C<3>}	N[5,6](C[5,6]C[6,6a]N[5]H)(N[5]C[6a]N[5])(C[6]C[6]H){1|H<1>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.9510	0.000	1	122.9510	0.000	1	122.9510	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5]C[6a]C[5]C)(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	N[5,6](C[5]C[6a]C[5]C)(C[5,6]C[6]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.1410	0.000	1	119.1410	0.000	1	118.9668	0.864	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H){1|N<2>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.7740	0.000	1	119.7740	0.000	1	118.9668	0.864	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5]C[6a]C[5]O)(C[5,6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<3>}	N[5,6](C[5]C[6a]C[5]O)(C[5,6]N[5]N[6])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	117.7510	0.000	1	117.7510	0.000	1	118.9668	0.864	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5]C[6a]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5]C[6a]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.2870	0.000	1	118.2870	0.000	1	118.9668	0.864	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5]N[6a]Si[5]H)(C[5,6]C[6]O[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,1|O<2>,2|H<1>}	N[5,6](C[5]N[6a]Si[5]H)(C[5,6]C[6]O[5])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	119.8810	0.000	1	119.8810	0.000	1	118.9668	0.864	5	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	N[5,6](Ga[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.4910	0.000	1	121.4910	0.000	1	121.4910	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	122.3040	0.132	2	122.3040	0.017	2	122.3040	0.017	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	122.4100	0.000	1	122.4100	0.000	1	122.4100	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	123.2857	0.708	3	123.2857	0.502	3	123.2857	0.502	3	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:N[6]-3:O-1:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]N[6]O)(O)	N[5,6](C[5,5,6]C[5,5]C[5,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[5,6]C)(O)	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]N[6]O)(O){3|C<3>,3|C<4>}	N[5,6](C[5,5,6]C[5,5]C[5,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<1>,1|O<2>,2|H<1>,2|N<3>,5|C<3>}	C[6](C[6]N[5,6]O)(N[6]C[5,6]C)(O){1|C<4>,1|H<1>,2|C<3>}	116.9030	0.031	2	116.9030	0.001	2	116.9030	0.001	2	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:N[6]-3:O-1:	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]O)(O)	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6]C)(O)	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]O)(O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]O){1|N<3>,2|H<1>,2|O<1>,3|C<3>}	C[6](C[6]N[5,6]O)(N[6]C[6]C)(O){1|C<3>,1|C<4>,1|O<1>}	116.3540	0.000	1	116.3540	0.000	1	116.3540	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H){1|C<4>,2|C<3>}	114.9590	0.000	1	114.9590	0.000	1	114.9590	0.000	1	120.6275	4.012	46	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:2:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:O-2:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]O)(O)	N[5,6](C[5,5,6]C[5,6]N[5]2)(C[5]C[5]C)(C[6]C[6]O)	C[6](C[6]C[5,6]H)(C[6]N[5,6]O)(OC)	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]O)(O){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](C[5,5,6]C[5,6]N[5]2)(C[5]C[5]C)(C[6]C[6]O){1|C<4>,1|H<1>,1|O<1>,2|O<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[5,6]O)(OC){2|C<3>,2|C<4>}	114.3360	0.000	1	114.3360	0.000	1	114.3360	0.000	1	114.3360	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:B-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H)	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H){1|H<1>,5|C<3>}	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H){1|B<3>,1|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2){1|B<4>,1|C<3>,1|H<1>}	122.6350	0.373	2	122.6350	0.139	2	122.6350	0.139	2	120.8838	17.928	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:C-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH){1|B<4>,1|C<3>,1|H<1>}	122.9420	0.000	1	122.9420	0.000	1	122.9420	0.000	1	120.8838	17.928	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H)	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H){1|H<1>,7|C<3>}	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[6]H){1|H<1>,8|C<3>}	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|B<4>,3|C<3>,3|H<1>}	122.8860	0.000	1	122.8860	0.000	1	122.8860	0.000	1	120.8838	17.928	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:N[6]-3:C-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6]2)(CHH)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O){1|C<4>,5|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|H<1>,1|N<3>,1|O<1>,6|C<3>}	C[6](C[6]N[5,6]O)(N[6]C[6]2)(CHH){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	113.3210	0.000	1	113.3210	0.000	1	113.3210	0.000	1	120.8838	17.928	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:4:	N[5,6]-3:C[6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	N[5,6](B[5]C[5,5]C[6a]Cl)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|Cl<1>,1|H<1>,2|C<3>,2|C<4>}	N[5,6](B[5]C[5,5]C[6a]Cl)(C[5,6]C[5,5]C[6])(C[6]C[6]H){1|Fe<10>,3|C<3>,4|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|C<4>}	121.2510	0.148	2	121.2510	0.022	2	121.2510	0.022	2	121.2510	0.022	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:2:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:N[6]-2:O-1:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]N[6])(O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<2>,1|S<4>,2|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O){1|N<2>,2|H<1>,3|O<1>}	C[6](C[6]N[5,6]O)(N[6]N[6])(O){2|C<4>}	116.4710	0.000	1	116.4020	0.010	2	116.4020	0.010	2	116.4020	0.010	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:2:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:N[6]-2:O-1:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]N[6])(O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<3>,1|S<4>,2|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O){1|N<2>,3|H<1>,3|O<1>}	C[6](C[6]N[5,6]O)(N[6]N[6])(O){1|H<1>,2|C<4>}	116.3330	0.000	1	116.4020	0.010	2	116.4020	0.010	2	116.4020	0.010	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]H){1|Br<1>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Br<1>,2|C<4>}	121.2665	0.006	2	121.2665	0.000	2	121.2665	0.000	2	117.9113	7.094	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,7|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H){2|C<3>,2|C<4>,2|H<1>}	115.7510	0.363	2	115.7510	0.132	2	115.7510	0.132	2	117.9113	7.094	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:N[6]-3:O-1:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6]C)(O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|S<2>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]HH)(C[6]C[6]O){1|N<3>,1|O<2>,2|O<1>,3|H<1>}	C[6](C[6]N[5,6]O)(N[6]C[6]C)(O){1|O<1>,2|C<4>}	116.7165	0.797	2	116.7165	0.635	2	116.7165	0.635	2	117.9113	7.094	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:2:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C-2:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]H){1|C<2>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN){1|H<1>,2|C<4>}	121.5450	0.000	1	121.5450	0.000	1	121.5450	0.000	1	121.5450	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:N[6]-3:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6]O)(CC[6a]H)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|N<3>,1|O<1>,4|H<1>}	C[6](C[6]N[5,6]O)(N[6]C[6]O)(CC[6a]H){1|O<1>,2|C<4>}	115.1700	0.000	1	115.1700	0.000	1	115.1700	0.000	1	115.1700	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:4:3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(COO)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]H){1|C<3>,1|C<4>,6|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(COO){2|C<4>,2|H<1>}	123.4800	0.000	1	123.4800	0.000	1	123.4800	0.000	1	119.6955	28.645	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:4:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(C[6]C[6]HH)(CC[6a]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]N[5,6]O)(C[6]C[6]HH)(CC[6a]O){2|C<4>,2|H<1>}	115.9110	0.000	1	115.9110	0.000	1	115.9110	0.000	1	119.6955	28.645	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	4:3:1:	N[5,6]-3:C[6]-3:O-1:	C[5,3x6]-4:C[5]-4:C[6]-3:	C[6]-4:C[6]-3:H-1:	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O)	N[5,6](C[5,3x6]C[5,3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]C[5,3x6]HH)(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,3x6]C[5,3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	C[6](C[6]C[5,3x6]HH)(C[6]N[5,6]O)(H){4|C<4>}	119.0250	0.000	1	119.0250	0.000	1	119.0250	0.000	1	119.0250	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:2:1:	N[5,6]-3:C[6]-3:H-1:	Ga[3x5]-5:C[5,6]-3:C[6]-3:	C[6]-3:N[6]-2:H-1:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H)	N[5,6](Ga[3x5]N[5,5]N[5]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(N[6]C[6])(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H){2|C<3>,2|N<3>,2|S<2>}	N[5,6](Ga[3x5]N[5,5]N[5]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>,3|N<2>}	C[6](C[6]N[5,6]H)(N[6]C[6])(H){1|Ga<5>,1|C<3>,1|H<1>}	119.9450	0.000	1	119.9450	0.000	1	119.9450	0.000	1	119.9450	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<4>,2|C<3>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	122.0580	0.731	2	122.0580	0.535	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]FF)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|F<1>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]FF)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	121.7475	0.428	2	121.7475	0.183	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]II)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]II)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	121.2185	0.395	2	121.2185	0.156	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5]S[5]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](Ga[5,5]N[5,5]S[5]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	121.9510	0.000	1	122.1955	0.120	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5]S[5]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](Ga[5,5]N[5,5]S[5]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	122.4400	0.000	1	122.1955	0.120	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,6]N[5]2Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	N[5,6](Ga[5,5]N[5,6]N[5]2Cl)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	123.1260	0.000	1	123.1260	0.000	1	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,6]N[5]2O)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<3>,2|C<3>,3|N<3>}	N[5,6](Ga[5,5]N[5,6]N[5]2O)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	123.2090	0.000	1	123.2090	0.000	1	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,6]N[5]2S)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>,3|N<3>}	N[5,6](Ga[5,5]N[5,6]N[5]2S)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	123.0910	0.115	2	123.0910	0.013	2	122.2463	0.620	12	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]Se[5]Br2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,2|Br<1>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](In[5,5]N[5,5]Se[5]Br2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	122.1880	0.000	1	122.1880	0.000	1	122.1880	0.000	1	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,5]C[6a]S[5]Br)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](Si[5,5]N[5,5]C[6a]S[5]Br)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.6330	0.000	1	121.6330	0.000	1	121.3010	0.276	7	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,5]C[6a]S[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](Si[5,5]N[5,5]C[6a]S[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.6005	0.045	2	121.6005	0.002	2	121.3010	0.276	7	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,5]C[6a]S[5]N)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](Si[5,5]N[5,5]C[6a]S[5]N)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	120.9980	0.738	3	120.9980	0.544	3	121.3010	0.276	7	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,5]S[5]CO)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<4>}	N[5,6](Si[5,5]N[5,5]S[5]CO)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	121.2790	0.000	1	121.2790	0.000	1	121.3010	0.276	7	121.9126	0.658	20	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[4x3,4x5,12x6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[4x3,4x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6]H[3])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|H<2>,3|B<6>}	N[5,6](B[4x3,4x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6]H[3])(C[5,6]C[5]C[6])(C[6]C[6]H){1|B<5>,1|C<3>,4|B<6>,7|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	119.5850	0.000	1	119.5850	0.000	1	119.5850	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	B[5x3,6x5,20x6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H)	N[5,6](B[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	N[5,6](B[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<3>,5|B<6>,8|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	120.1320	0.000	1	120.1320	0.000	1	120.1320	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[3x5,6,6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<4>}	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,6|C<4>,6|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.1355	0.220	2	122.1355	0.048	2	122.1355	0.048	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>}	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,3|C<4>,6|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	121.9710	0.068	2	121.9710	0.005	2	121.9710	0.005	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[4,5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){1|Ga<6>,2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	121.9467	0.777	16	121.9467	0.603	16	121.9467	0.603	16	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	120.6360	1.819	2	121.3697	1.854	4	121.3697	1.854	4	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,2|N<2>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.1035	0.316	2	121.3697	1.854	4	121.3697	1.854	4	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5,6,6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<3>}	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|S<4>,4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	121.7115	0.078	2	121.7115	0.006	2	121.7115	0.006	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5,6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,9|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.9395	0.562	4	122.9395	0.316	4	122.9395	0.316	4	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.0270	0.407	2	122.0270	0.166	2	122.0896	0.081	5	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.0160	0.252	2	122.0160	0.063	2	122.0896	0.081	5	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|F<1>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	122.3620	0.000	1	122.3620	0.000	1	122.0896	0.081	5	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Ga[5x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>,2|O<2>}	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>,5|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	121.5410	0.000	1	121.5410	0.000	1	121.5410	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[3x4,5,3x6]-6:C[5,6,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H)	N[5,6](In[3x4,5,3x6]S[3x4,3x6]3N[5,6]Cl)(C[5,6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|S<3>}	N[5,6](In[3x4,5,3x6]S[3x4,3x6]3N[5,6]Cl)(C[5,6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H){3|In<6>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	122.5741	1.659	12	122.5741	2.753	12	122.7170	2.583	14	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[3x4,5,3x6]-6:C[5,6,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H)	N[5,6](In[3x4,5,3x6]S[3x4,3x6]3N[5,6a]Cl)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|S<3>}	N[5,6](In[3x4,5,3x6]S[3x4,3x6]3N[5,6a]Cl)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H){3|In<6>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	123.5745	1.257	2	123.5745	1.579	2	122.7170	2.583	14	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[3x5]N[3x5]N[5]2N[6]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<4>,3|N<3>}	N[5,6](In[3x5]N[3x5]N[5]2N[6]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H){2|S<4>,3|C<3>,4|C<4>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.8720	0.000	1	121.8720	0.000	1	122.0483	0.045	3	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[3x5]N[5,6]O[5]4)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|O<2>}	N[5,6](In[3x5]N[5,6]O[5]4)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.1365	0.210	2	122.1365	0.044	2	122.0483	0.045	3	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[4,5,6]-6:C[5,6,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H)	N[5,6](In[4,5,6]N[5,6a]Se[4,6]Se[4]Se[6]Cl)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H){1|Cl<1>,1|Se<3>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](In[4,5,6]N[5,6a]Se[4,6]Se[4]Se[6]Cl)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H){1|In<5>,2|In<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	123.9280	0.000	1	123.9280	0.000	1	123.9280	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[4x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	N[5,6](In[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.6077	0.237	4	122.6077	0.056	4	122.6077	0.056	4	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5,6,6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>,3|O<2>}	N[5,6](In[5,5,6,6]N[5,6]2O[5]O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){2|C<4>,4|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.2375	0.357	2	122.2375	0.128	2	122.2375	0.128	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.4065	0.470	2	122.4065	0.221	2	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]N[5,6]Br3)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	N[5,6](In[5,5]N[5,5]N[5,6]Br3)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.9160	0.000	1	121.9160	0.000	1	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]N[5]Cl3)(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|N<3>}	N[5,6](In[5,5]N[5,5]N[5]Cl3)(C[5,6]C[6]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.6420	0.000	1	122.6420	0.000	1	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]S[5]Br2O)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	N[5,6](In[5,5]N[5,5]S[5]Br2O)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.8830	0.000	1	121.8830	0.000	1	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]S[5]Cl2O)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	N[5,6](In[5,5]N[5,5]S[5]Cl2O)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.2660	0.000	1	122.3860	0.029	2	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]S[5]Cl2O)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	N[5,6](In[5,5]N[5,5]S[5]Cl2O)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.5060	0.000	1	122.3860	0.029	2	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,5]S[5]Cl3)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](In[5,5]N[5,5]S[5]Cl3)(C[5,6]C[5]C[6])(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.5820	0.000	1	121.5820	0.000	1	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,5]N[5,6]O[5]2OO)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	N[5,6](In[5,5]N[5,6]O[5]2OO)(C[5,6]C[5]C[6])(C[6]C[6]H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,2|C<3>}	121.5215	0.514	2	121.5215	0.264	2	122.0651	0.241	10	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5,6]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[5,6]N[5,5,6]N[5,6]Cl2O)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	N[5,6](In[5,6]N[5,5,6]N[5,6]Cl2O)(C[5,6]C[5,5]C[6])(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.9200	0.000	1	122.9200	0.000	1	122.9200	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	N[5,6](In[5]N[5]O[5]Cl3)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	N[5,6](In[5]N[5]O[5]Cl3)(C[5,6]C[5]C[6])(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	122.3530	0.000	1	122.3530	0.000	1	122.3530	0.000	1	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	P[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H)	N[5,6](P[3x5]N[5,5,6]N[5,6]C[6a]O[5]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H){1|H<1>,2|N<3>,2|O<2>,3|C<3>}	N[5,6](P[3x5]N[5,5,6]N[5,6]C[6a]O[5]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,9|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	120.1640	0.115	2	120.1640	0.013	2	120.1640	0.013	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[3x5]-6:C[5,6,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H)	N[5,6](Si[3x5]N[5,6a]2N[5,6]O[5]2)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	N[5,6](Si[3x5]N[5,6a]2N[5,6]O[5]2)(C[5,6,6a]C[5,6a,6a]C[6,6a])(C[6]C[6]H){10|C<3>,1|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	122.0840	0.100	2	122.0840	0.010	2	122.0840	0.010	2	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,5a]2N[5,6]NN)(C[5,6]C[5,5a]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	N[5,6](Si[5,5]N[5,5a]2N[5,6]NN)(C[5,6]C[5,5a]C[6])(C[6]C[6]H){2|H<1>,3|N<2>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.7470	0.000	1	121.7470	0.000	1	121.4926	0.080	5	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,6]3Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	N[5,6](Si[5,5]N[5,6]3Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.4290	0.282	4	121.4290	0.080	4	121.4926	0.080	5	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](Si[5]N[5,6]Cl2HH)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,3|H<1>}	N[5,6](Si[5]N[5,6]Cl2HH)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.1300	0.410	2	121.1300	0.168	2	121.1987	0.073	7	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](Si[5]N[5,6]N[5a]2NN)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	N[5,6](Si[5]N[5,6]N[5a]2NN)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,3|C<3>,4|N<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.1353	0.175	3	121.2262	0.065	5	121.1987	0.073	7	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	Si[5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](Si[5]N[5,6]N[5a]2NN)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	N[5,6](Si[5]N[5,6]N[5a]2NN)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,3|N<2>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	121.3625	0.368	2	121.2262	0.065	5	121.1987	0.073	7	122.0113	1.054	90	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:1:	7:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	In[3x5]-7:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](In[3x5]N[5,5,6]O[5]3OO)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<3>,3|O<2>}	N[5,6](In[3x5]N[5,5,6]O[5]3OO)(C[5,6]C[5]C[6])(C[6]C[6]H){1|O<1>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>}	122.8940	0.000	1	122.8940	0.000	1	122.8940	0.000	1	122.8940	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:2:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:O-2:	C[5,6]-3:N[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(OMn)	N[5,6](C[5,6]N[5]N[6])(N[5]C[5]Mn)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(OMn){1|C<3>,1|N<2>,1|N<3>,1|O<1>}	N[5,6](C[5,6]N[5]N[6])(N[5]C[5]Mn)(C[6]C[6]O){1|C<3>,3|H<1>}	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	113.6900	0.000	1	113.6900	0.000	1	113.6900	0.000	1	113.6900	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:2:	3:3:3:	3:3:2:	N[5,6]-3:C[6]-3:N-2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:C-2:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]N)	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH){1|C<2>,1|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]N){1|C<2>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN){1|H<1>,2|C<3>}	112.9380	0.000	1	112.9380	0.000	1	112.9380	0.000	1	112.9380	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:2:	3:3:3:	3:4:3:	N[5,6]-3:C[6]-3:O-2:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(C[6]C[6]HH)(COO)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O){1|C<4>,3|C<3>,4|H<1>}	C[6](C[6]N[5,6]O)(C[6]C[6]HH)(COO){1|H<1>,1|N<3>,2|C<3>}	118.5660	0.047	2	118.5660	0.002	2	118.5660	0.002	2	118.5660	0.002	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:2:	4:3:3:	3:2:4:	N[5,6]-3:C[6]-3:O-2:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:N[6]-2:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC)	N[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC){1|C<3>,1|O<1>,1|O<2>,2|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]O){1|H<1>,1|N<2>,1|O<2>,2|C<4>}	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH){1|C<3>,1|C<4>,1|O<2>}	120.0190	0.059	2	120.0190	0.004	2	120.0190	0.004	2	120.0190	0.004	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:2:	4:4:3:	3:4:3:	N[5,6]-3:C[6]-3:N-2:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-4:N-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(NH)	N[5,6](C[5,6]C[6]N[5]C)(C[5]C[5]HH)(C[6]C[6]N)	C[6](C[6]N[5,6]N)(C[6]C[6]CC)(NOO)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(NH){1|N<3>,2|H<1>,5|C<4>}	N[5,6](C[5,6]C[6]N[5]C)(C[5]C[5]HH)(C[6]C[6]N){1|C<4>,1|N<3>,5|H<1>}	C[6](C[6]N[5,6]N)(C[6]C[6]CC)(NOO){2|C<4>,2|H<1>}	118.1570	0.000	1	118.1570	0.000	1	118.1570	0.000	1	118.1570	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:2:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:O[5]-2:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO)	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO){1|In<6>,1|O<2>,2|C<3>}	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C){1|H<1>,2|C<3>,4|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|H<1>,1|O<2>,3|C<3>}	118.1710	0.000	1	118.1710	0.000	1	118.1710	0.000	1	118.1710	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:C[6]-3:P[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5])	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5]){2|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	120.3500	0.139	2	120.3500	0.019	2	120.3500	0.019	2	115.7480	14.670	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C[6]-3:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5])	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Br<1>,1|H<1>,1|N<3>,4|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5]){1|Zn<4>,1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	117.5250	0.000	1	117.5250	0.000	1	117.5250	0.000	1	115.7480	14.670	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:N-3:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5]){1|Zn<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	113.9600	0.098	2	113.0027	4.113	4	113.0027	4.113	4	115.7480	14.670	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:N-3:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5]){2|Cu<5>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<2>}	112.0455	2.944	2	113.0027	4.113	4	113.0027	4.113	4	115.7480	14.670	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C[6]-3:	C[5,6]-3:N[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5]N[6])(N[5]C[5]Pd)(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|N<2>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]N[6])(N[5]C[5]Pd)(C[6]C[6]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H){2|C<3>,2|N<3>}	113.9240	0.000	1	113.9240	0.000	1	113.9240	0.000	1	113.9240	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:3:2:	N[5,6]-3:C[6]-3:N-3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:C-2:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NHH)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]N)	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NHH){1|C<2>,1|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]N){1|C<2>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN){1|H<1>,2|C<3>}	116.0160	0.000	1	116.0160	0.000	1	116.0160	0.000	1	116.0160	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:In[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN)	N[5,6](C[5,6]C[5]C[6])(In[5]N[5]ClS)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN){1|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(In[5]N[5]ClS)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	120.1290	0.000	1	120.1290	0.000	1	120.1290	0.000	1	120.1157	0.936	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[5a,6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]C[5]C)(C[6]C[6]C)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO){6|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]C[5]C)(C[6]C[6]C){1|N<3>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H){1|C<4>,1|N<3>,3|C<3>}	118.3050	0.000	1	118.3050	0.000	1	118.3050	0.000	1	120.1157	0.936	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:N-3:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH)	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)(C[6]C[6]N)	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH){1|H<1>,2|C<4>,3|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)(C[6]C[6]N){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	119.4960	0.000	1	119.4960	0.000	1	119.4960	0.000	1	120.1157	0.936	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:P-3:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6]P)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6]P){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.0025	0.196	2	121.0025	0.038	2	121.0025	0.038	2	120.1157	0.936	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6a]C[6])	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H){2|Cl<1>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6a]C[6]){1|N<2>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<2>,2|C<3>}	120.4375	0.366	2	120.4375	0.134	2	120.4375	0.134	2	120.1157	0.936	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:C-3:	C[5,6,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]C[6,6a]C)(C[6]N[5,6]C)(C[6a]C[6a]2)	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH){2|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C){2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[5,6]C)(C[6a]C[6a]2){1|C<4>,2|H<1>,4|C<3>}	115.6500	0.000	1	115.6500	0.000	1	115.4327	0.036	3	115.4327	0.036	3	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	3:3:3:	N[5,6]-3:C[6]-3:C-3:	C[5,6,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]C[6,6a]C[6a])(C[6]N[5,6]C)(C[6a]C[6a]2)	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH){1|C<4>,2|H<1>,5|C<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C){2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[5,6]C)(C[6a]C[6a]2){1|C<4>,2|H<1>,6|C<3>}	115.3240	0.014	2	115.3240	0.000	2	115.4327	0.036	3	115.4327	0.036	3	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	4:3:3:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[5,6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5,6]C)(COO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]H)(C[6]C[6]C)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[5,6]C)(COO)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5,6]C)(COO){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]H)(C[6]C[6]C){1|H<1>,2|C<2>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[5,6]C)(COO){1|C<4>,1|N<3>,1|O<1>,2|C<2>,3|C<3>}	123.4670	0.000	1	123.4670	0.000	1	123.4670	0.000	1	122.0267	1.755	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	4:3:3:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(COO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]N[5]H)(C[6]C[6]C)	C[6](C[6]C[5,6]CC)(C[6]N[5,6]C)(COO)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(COO){1|C<4>,1|H<1>,1|N<3>,2|C<2>,2|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]N[5]H)(C[6]C[6]C){1|H<1>,2|C<4>,5|C<3>}	C[6](C[6]C[5,6]CC)(C[6]N[5,6]C)(COO){1|C<4>,3|C<3>}	123.9410	0.000	1	123.9410	0.000	1	123.9410	0.000	1	122.0267	1.755	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	3:4:3:	4:3:3:	N[5,6]-3:C[6]-3:N-3:	C[5,6]-3:C[5]-4:C[6]-3:	C[5,6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]C)(NHH)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[5,6]N)(CC[6a]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]C)(NHH){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]N){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[5,6]N)(CC[6a]O){1|C<4>,1|O<1>,2|N<3>,3|C<3>}	121.1880	0.271	4	121.1880	0.074	4	121.1880	0.074	4	122.0267	1.755	6	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C[6a]-3:	C[5,6]-4:C[6]-3:N[5]-2:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[6]C[6a]C[6])(N[5]C[5])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,3|H<1>,5|C<3>}	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[6]C[6a]C[6])(N[5]C[5]){1|H<1>,7|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])(H){1|C<4>,1|H<1>,1|N<2>,4|C<3>}	116.9170	0.000	1	116.9170	0.000	1	116.9170	0.000	1	116.9170	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:3:1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6]C)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]C)(C[6]C[6a]C[6])(C[5]C[5]HH){3|C<3>,7|H<1>}	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	122.3290	0.000	1	122.3290	0.000	1	122.3135	0.038	4	122.3135	0.038	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:3:1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH){3|C<3>,7|H<1>}	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	122.3083	0.239	3	122.3083	0.057	3	122.3135	0.038	4	122.3135	0.038	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:3:3:	N[5,6]-3:C[6]-3:C[6a]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6a]C[6a]2)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2){1|O<1>,3|C<4>,4|C<3>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6])(C[5]C[5]HH){4|C<3>,6|H<1>}	C[6](C[6]N[5,6]C[6a])(C[6a]C[6a]2)(C[6]C[6]O){2|C<4>,4|C<3>,4|H<1>}	122.8075	0.482	2	122.8075	0.232	2	122.8075	0.232	2	122.8075	0.232	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:4:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[4,5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(CCrO)	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,2|C<4>,3|C<3>,6|H<1>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH){2|C<4>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(CCrO){3|C<3>,3|C<4>}	118.8150	0.000	1	118.8150	0.000	1	118.7683	0.020	3	119.6303	2.985	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:4:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[4,5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(COO)	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,2|C<4>,3|C<3>,6|H<1>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH){2|C<4>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(COO){3|C<3>,3|C<4>}	118.8820	0.000	1	118.8820	0.000	1	118.7683	0.020	3	119.6303	2.985	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:4:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[4,5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(CSeO)	C[6](N[5,6]C[4,5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|O<2>,2|C<4>,3|C<3>,6|H<1>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[6]C[6a]C[6])(C[5]C[5]HH){2|C<4>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]C[6a])(C[6]C[4,6]HH)(CSeO){3|C<3>,3|C<4>}	118.6080	0.000	1	118.6080	0.000	1	118.7683	0.020	3	119.6303	2.985	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	4:3:4:	3:4:3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-4:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C)	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6a]C[6])(C[5]C[5]HH)	C[6](C[6]N[5,6]C[6a])(C[6]C[6a]C[6]H)(CC[6a]O)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]C){1|N<3>,2|C<4>,4|C<3>,5|H<1>}	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6a]C[6])(C[5]C[5]HH){1|C<4>,5|C<3>,5|H<1>}	C[6](C[6]N[5,6]C[6a])(C[6]C[6a]C[6]H)(CC[6a]O){2|C<4>,2|H<1>,4|C<3>}	122.2160	0.000	1	122.2160	0.000	1	122.2160	0.000	1	119.6303	2.985	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:P-3:	In[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2)	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]P)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl2)(C[5,6]C[5,6]C[6])(C[6]C[6]P){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	120.2790	0.539	2	120.2790	0.290	2	120.2790	0.290	2	120.2790	0.290	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	In[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO)	N[5,6](In[3x5]N[5,6]2O[5]3)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](In[3x5]N[5,6]2O[5]3)(C[5,6]C[5]C[6])(C[6]C[6]C){1|O<1>,2|H<1>,7|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.8880	0.237	3	121.8880	0.056	3	121.8880	0.056	3	121.5472	0.247	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:3:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN)	N[5,6](In[5,5]N[5,5]S[5]Cl2S)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	N[5,6](In[5,5]N[5,5]S[5]Cl2S)(C[5,6]C[5]C[6])(C[6]C[6]C){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	121.0360	0.065	2	121.0360	0.004	2	121.0360	0.004	2	121.5472	0.247	5	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Pt<4>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	113.0165	0.361	2	113.6577	1.299	3	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Ru<9>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	114.9400	0.000	1	113.6577	1.299	3	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Co<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	115.0180	0.000	1	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Cu<5>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	115.3398	0.814	5	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Fe<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	114.9620	0.000	1	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Mn<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	115.0430	0.000	1	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Ni<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	115.0980	0.000	1	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Pt<4>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	114.6305	0.385	2	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Zn<4>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	114.9720	0.093	2	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Zn<6>,1|C<3>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	115.2030	0.000	1	115.0877	0.278	14	114.8354	0.704	17	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:S[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]C)(S[5]C[5])	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]C)(S[5]C[5]){1|Cu<4>,1|C<3>,1|N<2>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	117.5630	0.095	2	117.5630	0.009	2	117.5630	0.009	2	115.1225	1.366	19	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	3:3:4:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[6]N[5,6]C)(C[6]N[6]C)(CH3)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Ru<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(CH3){1|C<3>,1|N<2>}	115.2640	0.000	1	115.2640	0.000	1	115.2640	0.000	1	115.2640	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:2:	4:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:N[5]-2:	C[3,6]-4:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](C[3,6]C[3]H[3]N[6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3){1|C<3>,1|C<4>,1|H<2>,1|N<2>,1|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|Cu<5>,1|C<4>,2|H<1>}	C[6](C[3,6]C[3]H[3]N[6])(C[6]N[5,6]C)(H){1|C<3>,1|N<2>,2|H<1>}	114.9320	0.000	1	114.9320	0.000	1	114.9320	0.000	1	114.9320	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5a,6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3)	N[5,6](C[5,6a]C[5,6a]N[6a])(C[5,6]C[5a,6]N[5])(C[6]C[6]C)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3){1|N<2>,1|N<3>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]N[6a])(C[5,6]C[5a,6]N[5])(C[6]C[6]C){1|N<3>,2|H<1>,3|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H){5|C<3>}	115.7930	0.000	1	115.7930	0.000	1	115.7930	0.000	1	115.7930	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:3:	3:3:4:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6,6a]C)(CCHH)	N[5,6](N[5,6]C[6,6a]C[5])(C[5]C[5]H)(C[6]C[6]C)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(CCHH)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6,6a]C)(CCHH){1|H<1>,4|C<3>}	N[5,6](N[5,6]C[6,6a]C[5])(C[5]C[5]H)(C[6]C[6]C){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(CCHH){1|H<1>,1|N<3>,3|C<3>}	119.3130	0.000	1	119.3130	0.000	1	119.3130	0.000	1	119.3130	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:3:3:	4:3:3:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(CCCH)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]C)	C[6](C[6]C[6a]N[6]H)(C[6]N[5,6]C)(COO)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(CCCH){1|H<1>,1|N<2>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]C){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]N[5,6]C)(COO){4|C<3>}	115.5930	0.000	1	115.5930	0.000	1	115.5930	0.000	1	115.5930	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HH)(C[6]C[6]C){2|C<3>,4|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	118.4860	0.000	1	118.4860	0.000	1	118.5265	0.003	2	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HO)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HO)(C[6]C[6]C){2|C<3>,4|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	118.5670	0.000	1	118.5670	0.000	1	118.5265	0.003	2	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]HH)(C[6]C[6]C){1|C<2>,1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.9100	0.000	1	117.9100	0.000	1	118.0660	0.101	3	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C){1|C<3>,1|F<1>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	118.4320	0.000	1	118.1440	0.166	2	118.0660	0.101	3	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C){1|C<3>,1|O<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.8560	0.000	1	118.1440	0.166	2	118.0660	0.101	3	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6]C[5]C[6])(Ga[5]P[5]Cl2)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3){2|Cl<1>,1|H<1>,1|P<4>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(Ga[5]P[5]Cl2)(C[6]C[6]C){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	121.2240	0.000	1	121.2240	0.000	1	120.3105	1.669	2	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:Ga[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN)	N[5,6](C[5,6]C[5]C[6])(Ga[5]O[5]OO)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>,3|O<2>}	N[5,6](C[5,6]C[5]C[6])(Ga[5]O[5]OO)(C[6]C[6]C){1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	119.3970	0.000	1	119.3970	0.000	1	120.3105	1.669	2	118.8389	1.366	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	4:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-4:C[6]-3:H-1:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(H){1|C<4>,1|S<4>,3|C<3>}	119.8200	0.000	1	119.8200	0.000	1	119.8200	0.000	1	119.8200	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	4:3:3:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(CH3)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(CNO)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(CH3){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]C){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(CNO){1|C<4>,4|C<3>}	120.1990	0.000	1	120.1990	0.000	1	120.1990	0.000	1	119.3040	1.602	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:4:3:	4:3:3:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-4:C[6]-3:C-3:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(COO)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(COO){1|H<1>,1|S<4>,3|C<3>}	118.4090	0.000	1	118.4090	0.000	1	118.4090	0.000	1	119.3040	1.602	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6,6a]-3:Ga[5,5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]2O[5]O)(C[6]C[6]C)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]2O[5]O)(C[6]C[6]C){1|H<1>,7|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	119.3030	0.000	1	119.3030	0.000	1	119.6899	0.203	8	119.6899	0.203	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6,6a]-3:Ga[5,5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]O[5]2Cl)(C[6]C[6]C)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]O[5]2Cl)(C[6]C[6]C){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	120.0970	0.000	1	120.0970	0.000	1	119.6899	0.203	8	119.6899	0.203	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	3:5:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6,6a]-3:Ga[5,5]-5:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]O[5]2O)(C[6]C[6]C)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>,3|O<2>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[5,5]N[5,6]O[5]2O)(C[6]C[6]C){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	119.6865	0.471	6	119.6865	0.221	6	119.6899	0.203	8	119.6899	0.203	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|H<1>,1|P<4>,2|C<3>}	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C){1|Ga<4>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	119.6580	0.000	1	119.4580	0.080	2	119.4580	0.080	2	118.4412	1.487	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	B[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|H<1>,1|P<4>,2|C<3>}	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C){2|C<4>,3|C<3>,4|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	119.2580	0.000	1	119.4580	0.080	2	119.4580	0.080	2	118.4412	1.487	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,5|C<3>}	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C){1|Au<2>,1|C<4>,1|N<2>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.7760	0.000	1	117.4245	0.247	2	117.4245	0.247	2	118.4412	1.487	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5]-4:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,5|C<3>}	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C){1|Au<2>,1|N<2>,2|H<1>,5|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	117.0730	0.000	1	117.4245	0.247	2	117.4245	0.247	2	118.4412	1.487	4	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3)	N[5,6](C[5,6]C[6,6a]C[6a]O[5])(C[5]C[5]CC)(C[6]C[6]C)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3){1|O<2>,3|C<3>,3|C<4>}	N[5,6](C[5,6]C[6,6a]C[6a]O[5])(C[5]C[5]CC)(C[6]C[6]C){3|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|H<1>,2|C<3>,2|C<4>}	119.7320	0.000	1	119.7320	0.000	1	119.7320	0.000	1	119.7320	0.000	1	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	In[5,5,6,6]-5:C[5,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	N[5,6](In[5,5,6,6]N[5,6]3Cl)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C)	C[6](C[6]N[5,6]C)2(H)	C[6](N[5,6]In[5,5,6,6]C[5,6a])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,2|C<3>,3|N<3>}	N[5,6](In[5,5,6,6]N[5,6]3Cl)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]C)2(H){1|In<5>,2|C<3>}	123.9257	0.100	4	123.9257	0.010	4	123.9257	0.010	4	122.0480	4.096	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	5:3:3:	3:3:1:	N[5,6]-3:C[6]-3:P-4:	In[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PIrCC)	N[5,6](In[5,5]N[5,5,5a]N[5,6]ClIr)(C[5,6]C[5,5a]C[6])(C[6]C[6]P)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PIrCC){1|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](In[5,5]N[5,5,5a]N[5,6]ClIr)(C[5,6]C[5,5a]C[6])(C[6]C[6]P){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	120.1703	0.382	4	120.1703	0.146	4	120.1703	0.146	4	122.0480	4.096	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	5:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Ga[5,6,6]-5:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Ga[5,6,6]N[5,6]O[6]2C)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H)	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3){1|C<3>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	N[5,6](Ga[5,6,6]N[5,6]O[6]2C)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,3|H<1>}	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H){1|Ga<5>,1|C<4>,2|C<3>}	121.7250	0.110	2	121.7250	0.012	2	121.7250	0.012	2	122.2369	0.546	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	5:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	In[5,6,6]-5:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](In[5,6,6]N[5,6]O[6]2Cl)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	N[5,6](In[5,6,6]N[5,6]O[6]2Cl)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<5>,1|C<4>}	123.1185	0.455	2	123.1185	0.207	2	123.1185	0.207	2	122.2369	0.546	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	5:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Si[5,6]-5:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Si[5,6]O[5]O[6]CC)(C[5]C[5]CH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6]C[5])(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	N[5,6](Si[5,6]O[5]O[6]CC)(C[5]C[5]CH)(C[6]C[6]C){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<5>,1|C<4>}	121.9903	0.631	3	121.9903	0.398	3	121.9903	0.398	3	122.2369	0.546	7	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	N[5,6](Si[5,6,6]C[6a]O[6]3S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3){1|C<4>,1|S<2>,3|C<3>,3|O<2>}	N[5,6](Si[5,6,6]C[6a]O[6]3S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]C){2|H<1>,7|C<3>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<3>}	120.6243	0.379	3	120.6243	0.144	3	120.6243	0.144	3	120.6243	0.144	3	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Ga[3x5,6,6]-6:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Ga[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>,2|N<4>,2|O<2>}	N[5,6](Ga[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,4|C<4>,5|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|C<4>}	123.4930	0.000	1	123.4930	0.000	1	123.4930	0.000	1	122.6564	0.930	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Ga[5,6,6]-6:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Ga[5,6,6]N[5,6]O[6]2ClLi)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|Li<6>,1|N<3>,2|C<4>,2|H<1>,2|O<3>}	N[5,6](Ga[5,6,6]N[5,6]O[6]2ClLi)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|Li<6>,1|C<4>}	122.1015	1.201	2	122.1015	1.443	2	122.1015	1.443	2	122.6564	0.930	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	In[5,6,6]-6:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](In[5,6,6]N[5,6]O[5]O[6]2Cl)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,1|O<3>,2|C<4>,2|H<1>,2|O<2>}	N[5,6](In[5,6,6]N[5,6]O[5]O[6]2Cl)(C[5]C[5]HH)(C[6]C[6]C){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	123.4450	0.437	2	123.4450	0.191	2	123.0567	0.449	4	122.6564	0.930	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	In[5,6,6]-6:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](In[5,6,6]N[5,6]O[6]2ClO)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,3|O<2>}	N[5,6](In[5,6,6]N[5,6]O[6]2ClO)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	122.6685	0.745	2	122.6685	0.554	2	123.0567	0.449	4	122.6564	0.930	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:3:4:	6:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	Si[5,6,6]-6:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Si[5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[5]C[5]HH)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6,6]C[5])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>,2|N<2>,2|O<2>}	N[5,6](Si[5,6,6]N[5,6]O[6]2NN)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,3|H<1>}	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<4>}	121.3280	0.000	1	121.3280	0.000	1	121.3280	0.000	1	122.6564	0.930	8	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:4:3:	5:3:3:	3:3:1:	N[5,6]-3:P-4:C[6]-3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]Ga[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]ClPd)(C[5,6]C[5,6]C[6])(C[6]C[6]P)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](Ga[5,5]N[5,5,6]N[5,6]ClPd)(C[5,6]C[5,6]C[6])(C[6]C[6]P){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	120.0805	0.315	2	120.0805	0.099	2	120.0805	0.099	2	120.0805	0.099	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP2	C[6]	N[5,6]	C[6]	3:4:3:	6:3:3:	3:3:1:	N[5,6]-3:P-4:C[6]-3:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]In[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl2Pd)(C[5,6]C[5,6]C[6])(C[6]C[6]P)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](In[5,5]N[5,5,6]N[5,6]Cl2Pd)(C[5,6]C[5,6]C[6])(C[6]C[6]P){2|H<1>,5|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	118.8900	0.291	2	118.8900	0.085	2	118.8900	0.085	2	118.8900	0.085	2	120.3433	6.495	536	120.3052	6.430	551
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	3:3:3:	4:3:2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:O-2:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(OC)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(OC){1|H<1>,1|N<3>,4|C<3>}	120.0610	0.000	1	120.0610	0.000	1	120.0610	0.000	1	120.0610	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,5,6]C[5,5]C[5,6]C)(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	N[5,6](C[5,5,6]C[5,5]C[5,6]C)(C[5]C[6a]C[5])(C[6]C[6]H){1|H<1>,1|O<2>,6|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H){1|C<4>,2|C<3>}	120.9040	0.000	1	120.9040	0.000	1	120.9040	0.000	1	120.9040	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:3:3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:C[6a]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	N[5,6](C[5,6]C[5,5]C[6a]O[6])(C[5]C[5]O)(C[6]C[6]O)	C[6](C[6]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]2)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O){1|O<1>,1|O<2>,2|C<4>,4|C<3>}	N[5,6](C[5,6]C[5,5]C[6a]O[6])(C[5]C[5]O)(C[6]C[6]O){8|C<3>}	C[6](C[6]C[6a]O[6])(C[6]N[5,6]O)(C[6a]C[6a]2){1|C<4>,2|H<1>,5|C<3>}	113.2930	0.000	1	113.2930	0.000	1	113.2930	0.000	1	113.2930	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:3:3:	3:4:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|C<4>,1|O<1>,4|C<3>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	121.7900	0.000	1	121.7900	0.000	1	121.7900	0.000	1	121.7900	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5,5]H)(C[5]C[5]CH)(C[6]C[6]H){2|H<1>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	123.6590	0.000	2	123.6590	0.000	2	121.7038	5.486	5	121.7038	5.486	5	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CC)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CC)(C[6]C[6]H){1|N<3>,2|C<3>,4|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	118.8600	0.000	1	119.1755	0.199	2	121.7038	5.486	5	121.7038	5.486	5	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CC)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CC)(C[6]C[6]H){3|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	119.4910	0.000	1	119.1755	0.199	2	121.7038	5.486	5	121.7038	5.486	5	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CH)(C[6]C[6]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]CH)(C[6]C[6]H){1|C<4>,1|S<3>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	122.8500	0.000	1	122.8500	0.000	1	121.7038	5.486	5	121.7038	5.486	5	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	3:3:3:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:N[6]-3:C-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6]C)(O)	N[5,6](C[5,5,6]C[5,5]C[6]O[5])(C[5]C[5]HH)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]C[6]H)(CC[5a]H)	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6]C)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,5]C[6]O[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]O)(N[6]C[6]H)(CC[5a]H){1|O<1>,2|C<4>}	113.4380	0.000	1	113.4380	0.000	1	113.4380	0.000	1	113.4380	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:1:	4:4:3:	4:3:4:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-4:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]H)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(CC[6a]HH)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,3|H<1>,4|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]H){1|N<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(CC[6a]HH){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	125.6860	0.000	1	125.6860	0.000	1	125.6860	0.000	1	125.6860	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:4:1:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:O-1:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(CC[6a]H)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]HH)(O)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(CC[6a]H){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<1>,5|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]HH)(O){1|H<1>,1|N<3>,2|C<3>}	115.1120	0.000	1	115.1120	0.000	1	115.1120	0.000	1	115.1120	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:3:	3:3:3:	3:4:2:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-4:O-2:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C[6](C[6]N[5,6]C)(C[6]C[6]HH)(OSi)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<2>,5|H<1>}	C[6](C[6]N[5,6]C)(C[6]C[6]HH)(OSi){1|H<1>,1|N<3>,2|C<3>}	118.5970	0.000	1	118.5970	0.000	1	118.5970	0.000	1	118.5970	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:3:	4:3:3:	3:3:2:	N[5,6]-3:C[6]-3:N-3:	C[5,6]-4:C[6]-3:N[5]-3:	C[6]-3:C[6]-3:C-2:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(NHH)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]N)(N[5]C[5]H)	C[6](C[6]C[6a]C[6])(C[6]N[5,6]N)(CN)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(NHH){2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]N)(N[5]C[5]H){1|C<3>,2|C<2>,4|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[5,6]N)(CN){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	119.2370	0.000	1	119.2370	0.000	1	119.2370	0.000	1	119.2370	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	762	6:SP2_SP2_SP3	C[6]	N[5,6]	C[6]	3:3:4:	4:4:3:	3:3:1:	N[5,6]-3:C[6]-3:C-4:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3)	N[5,6](C[5,6]C[6,6a]C[6a]O[5])(C[5]C[5]CC)(C[6]C[6]C)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3){1|O<2>,3|C<3>,3|C<4>}	N[5,6](C[5,6]C[6,6a]C[6a]O[5])(C[5]C[5]CC)(C[6]C[6]C){3|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|H<1>,2|C<3>,2|C<4>}	120.0440	0.000	1	120.0440	0.000	1	120.0440	0.000	1	120.0440	0.000	1	119.7787	13.326	15	119.7787	13.326	15
762	542	790	0:SP2_SP-NON_SP2	C[6]	N[5,6]	Cl	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]Cl)	Cl(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]Cl){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	Cl(C[6]N[5,6]C[6])	116.8167	0.087	3	116.8167	0.008	3	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6
762	542	790	0:SP2_SP-NON_SP2	C[6]	N[5,6]	Cl	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	Cl(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl){1|C<3>,1|O<3>,2|C<4>,2|H<1>}	Cl(C[6]N[5,6]C[6])	116.6850	0.000	1	116.5473	0.053	3	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6
762	542	790	0:SP2_SP-NON_SP2	C[6]	N[5,6]	Cl	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:Cl-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	Cl(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl){1|Cl<1>,1|C<3>,2|C<4>,2|H<1>}	Cl(C[6]N[5,6]C[6])	116.4785	0.279	2	116.5473	0.053	3	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6	116.6820	0.046	6
762	542	818	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5,6]	3:3:1:	3:4:3:	3:3:3:	C[5,6]-3:N[5,6]-3:H-1:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H)	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]Cl2)(C[6]C[5,6]H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]H)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H){2|Cl<1>,1|B<4>,5|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]Cl2)(C[6]C[5,6]H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]H){2|Cl<1>,1|B<4>,2|H<1>,3|C<3>}	120.6120	0.000	1	120.6120	0.000	1	120.6120	0.000	1	120.6120	0.000	1	117.4920	8.963	6	117.4920	8.963	6
762	542	818	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5,6]	3:3:1:	4:3:3:	3:3:3:	C[5,6]-3:N[5,6]-3:H-1:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H)	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[5,6]H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]H)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H){1|B<4>,7|C<3>}	N[5,6](B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]C[6])(C[6]C[5,6]H){1|H<1>,1|N<3>,7|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]H){1|B<4>,2|H<1>,5|C<3>}	119.5510	0.000	1	119.5510	0.000	1	119.5510	0.000	1	119.5510	0.000	1	117.4920	8.963	6	117.4920	8.963	6
762	542	818	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5,6]	3:3:1:	4:4:3:	3:3:4:	C[5,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[5,6]-3:C[6]-3:C[5]-4:	C[6](C[5,6]C[5,6]C[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[3x5,6]O[6]H)(C[5]C[5,5,6]HH)(C[6]C[5,6]O)	C[5,6](C[5,6]C[5]O[6])(C[6]N[5,6]O)(C[5]C[5]HH)	C[6](C[5,6]C[5,6]C[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[3x5,6]O[6]H)(C[5]C[5,5,6]HH)(C[6]C[5,6]O){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[5,6](C[5,6]C[5]O[6])(C[6]N[5,6]O)(C[5]C[5]HH){2|H<1>,4|C<4>}	111.9460	0.000	1	111.9460	0.000	1	111.9460	0.000	1	111.9460	0.000	1	117.4920	8.963	6	117.4920	8.963	6
762	542	818	6:SP2_SP2_SP2	C[6]	N[5,6]	C[5,6]	3:3:4:	4:3:3:	3:3:3:	C[5,6]-3:N[5,6]-3:C-4:	B[5]-4:C[5,6]-3:C[6]-3:	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)	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[5,6]C)	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>}	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[5,6]C){1|C<4>,1|N<3>,5|C<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>}	117.6143	0.135	3	117.6143	0.018	3	117.6143	0.018	3	117.6143	0.018	3	117.4920	8.963	6	117.4920	8.963	6
762	542	856	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:3:	4:4:3:	3:3:3:	N[6]-3:N[6]-2:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:C[6a]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]N[6]2)	N[6](C[6]C[6,6a]N)(C[6]N[5]N[6])(C[6a]C[6a]2)	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(N[5]C[5]2){1|N<2>,2|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]N[6]2){3|C<3>,4|H<1>}	N[6](C[6]C[6,6a]N)(C[6]N[5]N[6])(C[6a]C[6a]2){2|C<4>,2|H<1>,4|C<3>}	115.6560	0.000	1	115.6560	0.000	1	115.6560	0.000	1	115.6560	0.000	1	117.7607	8.582	6	117.7607	8.582	6
762	542	856	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	N[6](C[6]N[5a]C[6])(C[6]C[6]N[5])(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){2|C<3>,2|N<3>,3|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H){2|C<3>,4|H<1>}	N[6](C[6]N[5a]C[6])(C[6]C[6]N[5])(H){2|H<1>,5|C<3>}	114.3890	0.000	1	114.3890	0.000	1	114.3890	0.000	1	114.3890	0.000	1	117.7607	8.582	6	117.7607	8.582	6
762	542	856	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:3:	3:4:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[6]C[6]N[6])(C[5]C[5]HH)2	N[6](C[6]C[6]N[5])2(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]HH)2{2|C<3>,6|H<1>}	N[6](C[6]C[6]N[5])2(H){1|C<3>,2|H<1>,4|C<4>}	117.7830	0.549	2	117.7830	0.301	2	117.7830	0.301	2	117.7830	0.301	2	117.7607	8.582	6	117.7607	8.582	6
762	542	856	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:3:	4:3:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[5]-4:C[6]-3:C[5]-4:	C[6]-3:C[6]-3:H-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	N[5](C[5]C[6a]C[5]H)(C[6]C[6]N[6])(C[5]C[5]CH)	N[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	N[5](C[5]C[6a]C[5]H)(C[6]C[6]N[6])(C[5]C[5]CH){4|C<3>,4|H<1>}	N[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	118.0210	0.000	1	118.0210	0.000	1	118.0210	0.000	1	118.0210	0.000	1	117.7607	8.582	6	117.7607	8.582	6
762	542	856	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:3:	6:3:3:	3:3:1:	N[5]-3:C[6]-3:N[6]-3:	In[5,5]-6:C[5,6a]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H)	N[5](In[5,5]N[5,5]N[5,6]Cl3)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6])	N[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H){3|Cl<1>,2|H<1>,2|N<3>,3|C<3>}	N[5](In[5,5]N[5,5]N[5,6]Cl3)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]N[6]){1|N<2>,3|H<1>,6|C<3>}	N[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	122.9320	0.000	1	122.9320	0.000	1	122.9320	0.000	1	122.9320	0.000	1	117.7607	8.582	6	117.7607	8.582	6
762	542	856	0:SP2_SP2_SP3	C[6]	N[5]	N[6]	3:3:3:	3:4:4:	3:3:1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:O-1:	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O)	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(C[5]C[5]HH)	N[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N[5](C[6]C[6]N[6])(C[5]C[5]CH)(C[5]C[5]HH){1|O<1>,2|C<3>,5|H<1>}	N[6](C[6]C[6]N[5])(C[6]C[6]H)(O){1|C<3>,2|C<4>,2|H<1>}	118.0150	0.000	1	118.0150	0.000	1	118.0150	0.000	1	118.0150	0.000	1	118.0150	0.000	1	118.0150	0.000	1
762	542	856	6:SP2_SP2_SP2	C[6,6]	N[5,6,6]	N[6]	3:3:3:	4:4:3:	3:4:1:	N[5,6,6]-3:N[6]-3:N[6]-3:	C[5,6]-4:C[5,6]-4:C[6,6]-3:	C[6,6]-3:C[6,6]-4:H-1:	C[6,6](N[5,6,6]C[5,6]2)(N[6]C[6,6]H)(N[6]C[6]H)	N[5,6,6](C[5,6]C[5]C[6]H)2(C[6,6]N[6]2)	N[6](C[6,6]N[5,6,6]N[6])(C[6,6]C[6]2O[6])(H)	C[6,6](N[5,6,6]C[5,6]2)(N[6]C[6,6]H)(N[6]C[6]H){2|H<1>,2|O<2>,6|C<4>}	N[5,6,6](C[5,6]C[5]C[6]H)2(C[6,6]N[6]2){1|C<3>,2|C<4>,9|H<1>}	N[6](C[6,6]N[5,6,6]N[6])(C[6,6]C[6]2O[6])(H){1|C<3>,4|H<1>,5|C<4>}	120.0330	0.000	1	120.0330	0.000	1	120.0330	0.000	1	120.2970	0.139	2	120.2970	0.139	2	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6,6]	N[5,6,6]	N[6]	3:3:3:	4:4:3:	3:4:1:	N[5,6,6]-3:N[6]-3:N[6]-3:	C[5,6]-4:C[5,6]-4:C[6,6]-3:	C[6,6]-3:C[6]-4:H-1:	C[6,6](N[5,6,6]C[5,6]2)(N[6]C[6,6]H)(N[6]C[6]H)	N[5,6,6](C[5,6]C[5]C[6]H)2(C[6,6]N[6]2)	N[6](C[6,6]N[5,6,6]N[6])(C[6]C[6]CO)(H)	C[6,6](N[5,6,6]C[5,6]2)(N[6]C[6,6]H)(N[6]C[6]H){2|H<1>,2|O<2>,6|C<4>}	N[5,6,6](C[5,6]C[5]C[6]H)2(C[6,6]N[6]2){1|C<3>,2|C<4>,9|H<1>}	N[6](C[6,6]N[5,6,6]N[6])(C[6]C[6]CO)(H){3|C<4>,3|H<1>}	120.5610	0.000	1	120.5610	0.000	1	120.5610	0.000	1	120.2970	0.139	2	120.2970	0.139	2	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6,6]	3:3:1:	4:3:4:	3:3:4:	N[5,6]-3:N[6,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:N[6,6]-3:C[6]-4:	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH)	N[6,6](C[6]N[5,6]O)(N[6,6]C[6]2)(C[6]C[6]HH)	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,3|H<1>}	N[6,6](C[6]N[5,6]O)(N[6,6]C[6]2)(C[6]C[6]HH){1|O<1>,1|O<2>,3|C<4>,3|H<1>}	113.3060	0.000	1	113.0000	0.187	2	113.0000	0.187	2	113.0000	0.187	2	113.0000	0.187	2	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6,6]	3:3:1:	4:3:4:	3:3:4:	N[5,6]-3:N[6,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:N[6,6]-3:C[6]-4:	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH)	N[6,6](C[6]N[5,6]O)(N[6,6]C[6]2)(C[6]C[6]HH)	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O){2|C<3>,3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,3|H<1>}	N[6,6](C[6]N[5,6]O)(N[6,6]C[6]2)(C[6]C[6]HH){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	112.6940	0.000	1	113.0000	0.187	2	113.0000	0.187	2	113.0000	0.187	2	113.0000	0.187	2	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	3:4:3:	3:3:3:	N[5,6]-3:N[6]-3:S-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(S)	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]N[6]S)	N[6](C[6]N[5,6]S)(C[6a]C[6a]2)(C[6]N[6]N)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(S){1|C<4>,1|N<3>,2|C<3>,2|H<1>,2|N<2>}	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]N[6]S){2|H<1>,3|C<3>}	N[6](C[6]N[5,6]S)(C[6a]C[6a]2)(C[6]N[6]N){1|C<4>,2|H<1>,3|C<3>}	113.6630	0.000	2	113.6630	0.000	2	113.6630	0.000	2	113.6630	0.000	2	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	3:4:3:	4:3:1:	N[5,6]-3:N[6]-3:S-1:	N[5,6]-3:C[5,5]-4:C[6]-3:	C[5,6]-4:C[6]-3:H-1:	C[6](N[5,6]C[5,5]N[5,6])(N[6]C[5,6]H)(S)	N[5,6](N[5,6]C[5,6]C[5])(C[5,5]C[5]3)(C[6]N[6]S)	N[6](C[5,6]C[5,6a]C[5,6]C[5])(C[6]N[5,6]S)(H)	C[6](N[5,6]C[5,5]N[5,6])(N[6]C[5,6]H)(S){3|C<4>,4|C<3>}	N[5,6](N[5,6]C[5,6]C[5])(C[5,5]C[5]3)(C[6]N[6]S){1|C<4>,2|O<1>,4|H<1>,5|C<3>}	N[6](C[5,6]C[5,6a]C[5,6]C[5])(C[6]N[5,6]S)(H){1|C<4>,1|O<1>,2|N<3>,4|C<3>}	117.2090	0.000	1	117.2090	0.000	1	117.2090	0.000	1	117.2090	0.000	1	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:3:2:	3:3:1:	N[5,6]-3:N[6]-3:S-1:	C[5,6]-4:C[6]-3:N[5]-2:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]N[5])(N[6]C[6]H)(S)	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6]S)(N[5]C[5])	N[6](C[6]C[6a]C[6])(C[6]N[5,6]S)(H)	C[6](N[5,6]C[5,6]N[5])(N[6]C[6]H)(S){1|C<4>,1|H<1>,3|C<3>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6]S)(N[5]C[5]){1|C<4>,2|H<1>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[5,6]S)(H){1|C<4>,1|N<2>,3|C<3>}	112.6350	0.000	1	112.6350	0.000	1	112.6350	0.000	1	112.6350	0.000	1	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:3:3:	3:3:4:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O){1|C<4>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH){1|C<4>,1|H<1>,3|C<3>}	114.7040	0.000	1	114.7040	0.000	1	114.7040	0.000	1	114.7040	0.000	1	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]H)(O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]HH)(C[6]N[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]H)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]HH)(C[6]N[6]O){1|C<4>,2|C<3>,4|H<1>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(H){1|H<1>,2|C<3>,2|C<4>}	116.8850	0.000	1	116.8850	0.000	1	116.8850	0.000	1	115.5395	1.502	4	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:S[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]S[5])(N[6]C[6,6a]H)(O)	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]N[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6]S[5])(N[6]C[6,6a]H)(O){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]N[6]O){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	113.9160	0.000	1	113.9160	0.000	1	113.9160	0.000	1	115.5395	1.502	4	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:1:	N[5,6]-3:N[6]-3:S-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]H)(S)	N[5,6](C[5,6]C[5,6a]C[6]H)(C[5]C[5,6a]HO)(C[6]N[6]S)	N[6](C[6]N[5,6]S)(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]H)(S){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[5,6a]C[6]H)(C[5]C[5,6a]HO)(C[6]N[6]S){3|C<3>,3|H<1>}	N[6](C[6]N[5,6]S)(C[6]C[6]O)(H){2|C<4>,2|H<1>}	115.6785	0.151	2	115.6785	0.023	2	115.6785	0.023	2	115.5395	1.502	4	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(O)	N[5,6](C[5,6]C[3x5,6]N[6]C)(C[5]C[5,5,6]HH)(C[6]N[6]O)	N[6](C[6]N[5,6]O)(C[6a]C[6a]2)(C[6]N[6]O)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(O){1|N<3>,1|O<1>,2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6]C[3x5,6]N[6]C)(C[5]C[5,5,6]HH)(C[6]N[6]O){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	N[6](C[6]N[5,6]O)(C[6a]C[6a]2)(C[6]N[6]O){2|C<4>,2|H<1>,3|C<3>}	113.4660	0.000	1	113.4660	0.000	1	113.4660	0.000	1	113.4660	0.000	1	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:4:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]HH)(C[6]N[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]HH)(C[6]N[6]O){1|C<4>,1|H<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH){1|H<1>,2|C<3>,2|C<4>}	115.9660	0.000	2	115.9660	0.000	2	115.9660	0.000	2	114.5887	5.691	3	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:1:	4:4:3:	3:3:4:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:S-4:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]S)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]N[6]O)	N[6](C[6]N[5,6]O)(C[6]C[6]O)(SC[6a]OO)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]S)(O){1|O<1>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]N[6]O){1|C<3>,1|S<4>,2|C<4>,4|H<1>}	N[6](C[6]N[5,6]O)(C[6]C[6]O)(SC[6a]OO){2|C<4>,2|H<1>}	111.8340	0.000	1	111.8340	0.000	1	111.8340	0.000	1	114.5887	5.691	3	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:4:	4:3:2:	3:3:1:	N[5,6]-3:N[6]-3:C-4:	C[5,6]-4:C[6]-3:N[5]-2:	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)	N[5,6](C[5,6]C[6,6a]S[5]C)(C[6]N[6]C)(N[5]C[5])	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>}	N[5,6](C[5,6]C[6,6a]S[5]C)(C[6]N[6]C)(N[5]C[5]){1|H<1>,1|N<3>,2|C<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>}	119.2700	0.000	1	119.2700	0.000	1	119.2700	0.000	1	119.2700	0.000	1	115.0381	4.020	14	115.3960	6.700	18
762	542	856	6:SP2_SP2_SP3	C[6]	N[5,6]	N[6]	3:3:1:	4:3:3:	3:3:4:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O){1|C<4>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]O)(CC[6a]HH){1|C<4>,1|H<1>,3|C<3>}	115.4330	0.000	1	115.4330	0.000	1	115.4330	0.000	1	115.4330	0.000	1	115.4330	0.000	1	115.4330	0.000	1
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:3:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[5,6a]-3:C[6,6]-3:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5,6a])(C[3x6]N[6,6]S[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6a]C[5,6a]C[6a])(C[6,6]C[3x6]O)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5,6a])(C[3x6]N[6,6]S[6,6]C)(O){1|S<2>,2|C<4>,3|C<3>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6a]C[5,6a]C[6a])(C[6,6]C[3x6]O){1|C<4>,1|N<3>,1|O<1>,1|S<2>,2|C<3>,3|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	124.4820	0.000	1	124.4820	0.000	1	124.4820	0.000	1	124.1755	0.188	2	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:3:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,5,3x6]-4:C[5,6a]-3:C[6,6]-3:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,5,3x6]C[5,6a])(C[3x6]C[6,6]2H)(O)	N[5,6,6](C[5,5,3x6]N[5,6,6]C[5,5]C[6,6])(C[5,6a]C[5,6a]C[6a])(C[6,6]C[3x6]O)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,5,3x6]C[5,6a])(C[3x6]C[6,6]2H)(O){1|N<3>,1|O<1>,2|C<3>,2|C<4>,2|H<1>}	N[5,6,6](C[5,5,3x6]N[5,6,6]C[5,5]C[6,6])(C[5,6a]C[5,6a]C[6a])(C[6,6]C[3x6]O){1|O<1>,2|H<1>,4|C<3>,4|C<4>}	O(C[6,6]N[5,6,6]C[3x6])	123.8690	0.000	1	123.8690	0.000	1	123.8690	0.000	1	124.1755	0.188	2	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:4:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]N[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]N[6,6]C)(O){2|C<3>,3|H<1>,4|C<4>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	125.3510	0.000	1	125.3510	0.000	1	125.1790	0.188	4	125.0954	0.176	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:4:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]O[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]O[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]O[6,6]C)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6,6](C[5,3x6]C[6,6]O[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH){1|O<2>,2|C<4>,6|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	125.6050	0.000	1	125.6050	0.000	1	125.1790	0.188	4	125.0954	0.176	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:4:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]N[6,6]S[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]CH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]N[6,6]S[6,6]C)(O){1|H<1>,1|S<2>,2|C<3>,3|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]CH){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,1|S<2>}	O(C[6,6]N[5,6,6]C[3x6])	125.1760	0.000	1	125.1760	0.000	1	125.1790	0.188	4	125.0954	0.176	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:4:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]N[6,6]S[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]N[6,6]S[6,6]C)(O){1|C<3>,1|S<2>,2|H<1>,3|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[6,6]C[3x6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,3|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	124.5840	0.000	1	124.5840	0.000	1	125.1790	0.188	4	125.0954	0.176	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:3:4:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,5,3x6]C[5])(C[3x6]C[6,6]2H)(O)	N[5,6,6](C[5,5,3x6]N[5,6,6]C[5,5]C[6,6])(C[6,6]C[3x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,5,3x6]C[5])(C[3x6]C[6,6]2H)(O){1|N<3>,1|O<1>,3|C<4>,4|H<1>}	N[5,6,6](C[5,5,3x6]N[5,6,6]C[5,5]C[6,6])(C[6,6]C[3x6]O)(C[5]C[5]HH){1|O<1>,2|C<4>,3|H<1>,4|C<3>}	O(C[6,6]N[5,6,6]C[3x6])	124.7610	0.000	1	124.7610	0.000	1	124.7610	0.000	1	125.0954	0.176	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:4:3:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[5,5]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5,5])(C[3x6]N[6,6]S[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,5]C[5,5]N[5]H)(C[6,6]C[3x6]O)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5,5])(C[3x6]N[6,6]S[6,6]C)(O){1|C<3>,1|H<1>,1|N<3>,1|S<2>,3|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,5]C[5,5]N[5]H)(C[6,6]C[3x6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|H<1>,3|C<3>}	O(C[6,6]N[5,6,6]C[3x6])	123.9945	0.452	2	123.9357	0.815	4	123.9357	0.815	4	124.3240	1.365	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:4:3:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[5,5]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5,5])(C[3x6]N[6,6]S[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,5]C[5,5]N[5]H)(C[6,6]C[3x6]O)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5,5])(C[3x6]N[6,6]S[6,6]C)(O){1|C<3>,1|H<1>,1|N<3>,1|S<2>,3|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,5]C[5,5]N[5]H)(C[6,6]C[3x6]O){1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<3>,2|C<4>,2|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	123.8770	1.492	2	123.9357	0.815	4	123.9357	0.815	4	124.3240	1.365	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	3:4:1:	4:4:3:	3:	N[5,6,6]-3:C[3x6]-4:O-1:	C[5,3x6]-4:C[5]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]N[6,6]C)(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[3x6]O)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](N[5,6,6]C[5,3x6]C[5])(C[3x6]C[6,6]N[6,6]C)(O){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[3x6]O){1|N<2>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	125.8770	0.000	1	125.8770	0.000	1	125.8770	0.000	1	124.3240	1.365	5	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]O)(C[5]O[5]CH)	O(C[6,6]N[5,6,6]C[3x6])	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(N[5,6,6]C[5,3x6]C[5])(O){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]O)(C[5]O[5]CH){1|C<3>,1|C<4>,1|N<2>,1|O<2>,4|H<1>}	O(C[6,6]N[5,6,6]C[3x6])	126.5350	0.000	1	126.5350	0.000	1	126.5350	0.000	1	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[4x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[4x6])	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O){1|C<3>,5|C<4>,6|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]N[5,6,6]C[4x6])	125.3170	0.000	2	125.4929	0.173	7	125.4929	0.173	7	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[4x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[4x6])	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O){2|C<3>,4|C<4>,6|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]N[5,6,6]C[4x6])	125.6947	0.450	4	125.4929	0.173	7	125.4929	0.173	7	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[4x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH)	O(C[6,6]N[5,6,6]C[4x6])	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O){3|C<3>,4|C<4>,5|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[4x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]N[5,6,6]C[4x6])	125.0370	0.000	1	125.4929	0.173	7	125.4929	0.173	7	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[5,3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]N[6,6]C[5])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[5,3x6]O)(C[5]C[5]HH)	O(C[6,6]C[5,3x6]N[5,6,6])	C[6,6](C[5,3x6]C[5,6,6]N[6,6]C[5])(N[5,6,6]C[5,3x6]C[5])(O){1|C<3>,5|C<4>,6|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[5,3x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]C[5,3x6]N[5,6,6])	125.0410	0.000	1	125.4582	0.175	4	125.4582	0.175	4	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:3:4:	3:	C[5,3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]N[6,6]C[5])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[5,3x6]O)(C[5]C[5]HH)	O(C[6,6]C[5,3x6]N[5,6,6])	C[6,6](C[5,3x6]C[5,6,6]N[6,6]C[5])(N[5,6,6]C[5,3x6]C[5])(O){1|C<3>,5|H<1>,6|C<4>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[6,6]C[5,3x6]O)(C[5]C[5]HH){1|N<3>,1|O<1>,2|C<4>,6|H<1>}	O(C[6,6]C[5,3x6]N[5,6,6])	125.5973	0.383	3	125.4582	0.175	4	125.4582	0.175	4	125.5682	0.235	12	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[4x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[5]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[4x6]O)	O(C[6,6]N[5,6,6]C[4x6])	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O){1|O<2>,2|C<3>,4|C<4>,4|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[4x6]O){1|N<2>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	O(C[6,6]N[5,6,6]C[4x6])	124.0710	0.916	2	124.4460	0.842	3	124.4460	0.842	3	124.9461	0.586	8	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[4x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[5]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O)	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[4x6]O)	O(C[6,6]N[5,6,6]C[4x6])	C[6,6](C[4x6]C[3x6]N[6,6]C[6])(N[5,6,6]C[5,3x6]C[5])(O){1|O<2>,3|C<3>,3|C<4>,4|H<1>}	N[5,6,6](C[5,3x6]C[6,6]2C[5])(C[5]C[6a]O[5]H)(C[6,6]C[4x6]O){1|N<2>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	O(C[6,6]N[5,6,6]C[4x6])	125.1960	0.000	1	124.4460	0.842	3	124.4460	0.842	3	124.9461	0.586	8	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[5,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O)	O(C[6,6]C[5,3x6]N[5,6,6])	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6,6]C[5,3x6]N[5,6,6])	124.9520	0.733	2	125.2462	0.304	5	125.2462	0.304	5	124.9461	0.586	8	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[5,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O)	O(C[6,6]C[5,3x6]N[5,6,6])	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<3>,4|H<1>}	O(C[6,6]C[5,3x6]N[5,6,6])	125.5830	0.000	1	125.2462	0.304	5	125.2462	0.304	5	124.9461	0.586	8	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6,6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,3x6]-4:N[5,6,6]-3:O-1:	C[5,3x6]-4:C[5,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O)	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O)	O(C[6,6]C[5,3x6]N[5,6,6])	C[6,6](C[5,3x6]N[5,6,6]S[6,6]C[5])(N[5,6,6]C[5,3x6]C[5,6])(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,3x6]C[6,6]S[6,6]C[5])(C[5,6]C[5,6]C[6]H)(C[6,6]C[5,3x6]O){1|N<3>,1|O<1>,1|S<2>,3|C<4>,5|H<1>}	O(C[6,6]C[5,3x6]N[5,6,6])	125.3720	0.602	2	125.2462	0.304	5	125.2462	0.304	5	124.9461	0.586	8	125.0573	0.662	32	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6,6]	O	3:3:1:	4:4:3:	3:	N[5,6,6]-3:C[6,6a]-3:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6,6]C[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6,6](C[5,6,6]C[5]C[6]2)(C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)	O(C[6]N[5,6,6]C[6,6a])	C[6](N[5,6,6]C[5,6,6]C[5,6])(C[6,6a]C[6,6a]C[6a])(O){2|C<4>,2|H<1>,5|C<3>}	N[5,6,6](C[5,6,6]C[5]C[6]2)(C[5,6]C[5]C[6]H)(C[6]C[6,6a]O){1|C<4>,1|O<1>,4|C<3>,4|H<1>}	O(C[6]N[5,6,6]C[6,6a])	122.5640	0.000	1	122.5640	0.000	1	122.5640	0.000	1	122.5640	0.000	1	123.0873	0.305	6	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6,6]	O	3:4:1:	4:4:3:	3:	N[5,6,6]-3:C[5,6]-4:O-1:	C[5,5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6,6]C[5,5,6,6]C[5,6,6])(C[5,6]N[5,6]C[5]S)(O)	N[5,6,6](C[5,5,6,6]C[5,5]S[5,6]C[6])(C[5,6,6]C[5,5,6,6]C[6]H)(C[6]C[5,6]O)	O(C[6]N[5,6,6]C[5,6])	C[6](N[5,6,6]C[5,5,6,6]C[5,6,6])(C[5,6]N[5,6]C[5]S)(O){1|S<2>,2|C<3>,3|H<1>,4|C<4>}	N[5,6,6](C[5,5,6,6]C[5,5]S[5,6]C[6])(C[5,6,6]C[5,5,6,6]C[6]H)(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|S<2>,2|C<4>,2|O<2>,3|H<1>}	O(C[6]N[5,6,6]C[5,6])	122.5280	0.000	1	122.5280	0.000	1	122.5280	0.000	1	122.5280	0.000	1	123.0873	0.305	6	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6,6]-3:O-1:	C[5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]C[5,6]N[5,6]S[6])(N[5,6,6]C[5,6,6]2)(O)	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6,6])	C[6](C[5,6,6]C[5,6]N[5,6]S[6])(N[5,6,6]C[5,6,6]2)(O){1|C<3>,1|S<2>,3|H<1>,6|C<4>}	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]C[5,6,6]N[5,6,6])	123.8720	0.000	1	123.8720	0.000	1	123.8720	0.000	1	123.3580	0.216	4	123.0873	0.305	6	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6,6]-3:O-1:	C[5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O)	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O)	O(C[6]N[5,6,6]C[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]N[5,6,6]C[5,6])	123.6150	0.000	1	123.1867	0.148	3	123.1867	0.148	3	123.3580	0.216	4	123.0873	0.305	6	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6,6]-3:O-1:	C[5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O)	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O)	O(C[6]N[5,6,6]C[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O){1|S<2>,2|C<3>,3|H<1>,4|C<4>}	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]N[5,6,6]C[5,6])	122.9725	0.141	2	123.1867	0.148	3	123.1867	0.148	3	123.3580	0.216	4	123.0873	0.305	6	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	3:3:2:	3:	N[5,6]-3:C[6]-2:O-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(O)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(O){1|C<1>,1|C<2>,2|N<2>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){1|C<3>}	O(C[6]N[5,6]C[6])	119.7100	0.000	1	119.7100	0.000	1	119.7100	0.000	1	119.7100	0.000	1	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:3:2:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[6]-3:N[5]-2:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(O[6]C[6,6a])(O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]O[6]O)(N[5]C[5])	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6]N[5])(O[6]C[6,6a])(O){1|C<4>,1|H<1>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]O[6]O)(N[5]C[5]){1|C<4>,2|C<3>,2|H<1>}	O(C[6]N[5,6]O[6])	127.9600	0.000	1	127.9600	0.000	1	127.9600	0.000	1	127.9600	0.000	1	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:4:3:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6])(O[6]C[6])(O)	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6]C[5]C[6]2)(C[6]O[6]O)	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6,6]C[5,6])(O[6]C[6])(O){1|C<4>,3|H<1>,4|C<3>}	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6]C[5]C[6]2)(C[6]O[6]O){2|C<4>,3|H<1>,4|C<3>}	O(C[6]N[5,6]O[6])	124.3345	0.435	2	124.3345	0.189	2	124.3345	0.189	2	124.8894	1.523	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:4:3:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){1|O<2>,2|C<3>,3|H<1>}	O(C[6]N[5,6]O[6])	125.4250	1.106	2	124.8090	1.885	5	125.0743	1.931	6	124.8894	1.523	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:4:3:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){2|C<3>,4|H<1>}	O(C[6]N[5,6]O[6])	126.2260	0.000	1	124.8090	1.885	5	125.0743	1.931	6	124.8894	1.523	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:4:3:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O)	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]O[6]O){1|C<4>,1|I<1>,1|O<2>,4|H<1>}	O(C[6]N[5,6]O[6])	123.4845	0.209	2	124.8090	1.885	5	125.0743	1.931	6	124.8894	1.523	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:2:1:	4:4:3:	3:	N[5,6]-3:O[6]-2:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]C[5]H)(C[6]O[6]O)	O(C[6]N[5,6]O[6])	C[6](N[5,6]C[5,6]C[5])(O[6]C[6])(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]C[5]H)(C[6]O[6]O){1|O<2>,3|H<1>,4|C<3>}	O(C[6]N[5,6]O[6])	126.4010	0.000	1	126.4010	0.000	1	125.0743	1.931	6	124.8894	1.523	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:2:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){1|Pt<4>,1|C<3>,3|H<1>}	O(C[6]N[5,6]C[6])	120.2515	0.383	2	120.3350	0.180	4	120.3350	0.180	4	120.3350	0.180	4	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:2:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){2|Pd<4>,1|C<3>,2|H<1>}	O(C[6]N[5,6]C[6])	120.4185	0.606	2	120.3350	0.180	4	120.3350	0.180	4	120.3350	0.180	4	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:3:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|H<1>,1|N<3>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6])(C[6]C[6,6a]O){1|Pt<4>,1|H<1>,1|O<1>,4|C<3>}	O(C[6]C[6,6a]N[5,6])	121.0177	1.009	3	121.0177	1.019	3	121.0177	1.019	3	118.6293	7.439	6	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:3:	3:	N[5,6]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O)	O(C[6]N[5,6]2)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){1|N<3>,3|O<2>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O){1|Si<5>,1|H<1>,3|C<3>}	O(C[6]N[5,6]2)	116.6275	0.190	2	116.2410	0.466	3	116.2410	0.466	3	118.6293	7.439	6	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:3:	3:	N[5,6]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O)	O(C[6]N[5,6]2)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){2|N<3>,3|O<2>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]O[5]O[6])(C[6]N[5,6]O){1|Si<6>,1|H<1>,3|C<3>}	O(C[6]N[5,6]2)	115.4680	0.000	1	116.2410	0.466	3	116.2410	0.466	3	118.6293	7.439	6	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:3:4:	3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,6]-3:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,6]C[5])(C[6]C[5a,6]O)(C[5]C[5]HH)	O(C[6]C[5a,6]N[5,6])	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O){2|C<4>,3|C<3>,3|H<1>}	N[5,6](C[5,6]C[5,6]C[5])(C[6]C[5a,6]O)(C[5]C[5]HH){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	O(C[6]C[5a,6]N[5,6])	122.7965	0.305	2	122.7965	0.093	2	122.7965	0.093	2	122.7965	0.093	2	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:4:3:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]O[6]C)(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]O[6]C)(C[6]C[6,6a]O){1|H<1>,1|O<1>,4|C<3>}	O(C[6]C[6,6a]N[5,6])	122.9070	0.000	1	122.9070	0.000	1	122.9070	0.000	1	120.5583	10.768	3	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O){1|C<4>,1|S<1>,2|C<3>,2|H<1>,2|N<3>}	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]C[6]O){2|H<1>,4|C<3>}	O(C[6]N[5,6]C[6])	116.8090	0.000	1	116.8090	0.000	1	116.8090	0.000	1	120.5583	10.768	3	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]S)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O){1|C<4>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]S)(C[6]C[6]O){1|N<2>,1|O<1>,1|O<2>,2|H<1>,3|C<3>}	O(C[6]N[5,6]C[6])	121.9590	0.000	1	121.9590	0.000	1	121.9590	0.000	1	120.5583	10.768	3	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](C[5,6]C[6a]C[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O){1|H<1>,1|O<2>,6|C<3>}	N[5,6](C[5,6]C[6a]C[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|H<1>,7|C<3>}	O(C[6]C[6,6a]N[5,6])	122.7610	0.000	1	122.7610	0.000	1	122.7610	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6,6a]-3:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|H<1>,1|O<2>,2|C<4>,4|C<3>}	N[5,6](C[4,5,6]C[4,6]C[4]O[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,4|C<3>,4|H<1>}	O(C[6]C[6,6a]N[5,6])	120.4000	0.000	1	120.4000	0.000	1	120.8355	0.379	2	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6,6a]-3:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[4,5,6]C[4,6]C[4]S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|H<1>,1|S<2>,2|C<4>,4|C<3>}	N[5,6](C[4,5,6]C[4,6]C[4]S[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,3|H<1>,5|C<3>}	O(C[6]C[6,6a]N[5,6])	121.2710	0.000	1	121.2710	0.000	1	120.8355	0.379	2	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6,6a]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	O(C[6]C[6,6a]N[5,6])	122.9270	0.000	1	122.9840	0.006	2	122.9840	0.006	2	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6,6a]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O)	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(O){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](C[5,5,6]C[5,5]N[5,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6,6a]O){1|C<4>,2|H<1>,5|C<3>}	O(C[6]C[6,6a]N[5,6])	123.0410	0.000	1	122.9840	0.006	2	122.9840	0.006	2	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]N[6]O)(O)	N[5,6](C[5,5,6]C[5,5]C[5,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]N[6]O)(O){3|C<3>,3|C<4>}	N[5,6](C[5,5,6]C[5,5]C[5,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<1>,1|O<2>,2|H<1>,2|N<3>,5|C<3>}	O(C[6]N[5,6]C[6])	123.7145	0.168	2	123.7145	0.028	2	123.7145	0.028	2	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]O)(O)	N[5,6](C[5,5,6]C[5,6]N[5]2)(C[5]C[5]C)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]O)(O){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	N[5,6](C[5,5,6]C[5,6]N[5]2)(C[5]C[5]C)(C[6]C[6]O){1|C<4>,1|H<1>,1|O<1>,2|O<2>,3|C<3>}	O(C[6]N[5,6]C[6])	123.3140	0.000	1	123.3140	0.000	1	123.3140	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,5]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]O)(O)	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]O)(O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]O){1|N<3>,2|H<1>,2|O<1>,3|C<3>}	O(C[6]N[5,6]C[6])	123.1250	0.000	1	123.1250	0.000	1	123.1250	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<4>,2|H<1>,4|C<3>}	O(C[6]N[5,6]C[6])	122.9180	0.000	1	122.9180	0.000	1	122.9180	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O){1|C<4>,5|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|H<1>,1|N<3>,1|O<1>,6|C<3>}	O(C[6]N[5,6]C[6])	123.8650	0.000	1	123.8650	0.000	1	123.8650	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O){1|C<4>,4|C<3>}	O(C[6]N[5,6]N[6])	121.0870	0.000	1	121.0870	0.000	1	121.0870	0.000	1	122.6782	1.286	12	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O)	N[5,6](C[5,5,6]C[5,6]C[5]N[5])(C[6]C[5a,6]O)(C[5]C[5]HH)	O(C[6]C[5a,6]N[5,6])	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O){1|N<2>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,6]C[5]N[5])(C[6]C[5a,6]O)(C[5]C[5]HH){1|N<3>,1|O<2>,2|C<3>,5|H<1>}	O(C[6]C[5a,6]N[5,6])	123.4870	0.000	1	123.4870	0.000	1	123.4870	0.000	1	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]N)(C[6]C[5a,6]O)(C[5]C[5]HH)	O(C[6]C[5a,6]N[5,6])	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]N)(C[6]C[5a,6]O)(C[5]C[5]HH){1|C<3>,1|N<2>,1|N<3>,5|H<1>}	O(C[6]C[5a,6]N[5,6])	122.7430	0.000	1	122.7430	0.000	1	122.7430	0.000	1	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]C[6,6]C[6])(N[5,6]C[5,6]C[5])(O){1|O<2>,4|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<4>,3|C<3>,4|H<1>}	O(C[6]C[6,6]N[5,6])	118.6510	0.000	1	118.6510	0.000	1	118.6510	0.000	1	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]C)(C[6]C[6,6a]O)(C[5]C[5]HH)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,4|H<1>}	O(C[6]C[6,6a]N[5,6])	121.0340	0.000	1	121.0340	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,4|H<1>}	O(C[6]C[6,6a]N[5,6])	122.2820	0.378	2	122.2820	0.143	2	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|N<3>,1|S<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]N[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC){2|C<3>,3|C<4>}	O(C[6]C[6,6a]N[5,6])	123.9170	0.000	1	123.9170	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]O[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|O<2>,1|S<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]O[6]H)(C[6]C[6,6a]O)(C[5]S[5]CC){2|C<3>,2|C<4>}	O(C[6]C[6,6a]N[5,6])	123.9950	0.000	1	123.9950	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6]O[5]C)(C[6]C[6,6a]O)(C[5]C[5]CC)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){2|O<2>,3|C<3>,4|C<4>}	N[5,6](C[5,6]C[6]O[5]C)(C[6]C[6,6a]O)(C[5]C[5]CC){1|O<1>,2|C<3>,2|H<1>}	O(C[6]C[6,6a]N[5,6])	120.7530	0.000	1	120.7530	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6,6a]O)(C[5]C[5]CH)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|C<4>,1|N<3>,2|H<1>,5|C<3>}	N[5,6](C[5,6]C[6a]C[6]N[5])(C[6]C[6,6a]O)(C[5]C[5]CH){1|H<1>,2|O<1>,4|C<3>}	O(C[6]C[6,6a]N[5,6])	121.6220	0.000	1	121.6220	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]C[5,6]C[5])(O){3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|C<3>,5|H<1>}	O(C[6]C[6,6a]N[5,6])	121.8030	0.000	1	121.8030	0.000	1	122.2110	1.467	8	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	N[5,6]-3:N[6,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH)	O(C[6]N[5,6]N[6,6])	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,3|H<1>}	O(C[6]N[5,6]N[6,6])	124.6770	0.000	1	124.7030	0.001	2	124.7030	0.001	2	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	N[5,6]-3:N[6,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH)	O(C[6]N[5,6]N[6,6])	C[6](N[5,6]C[5,6]C[5])(N[6,6]N[6,6]C[6])(O){2|C<3>,3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,3|H<1>}	O(C[6]N[5,6]N[6,6])	124.7290	0.000	1	124.7030	0.001	2	124.7030	0.001	2	122.4596	3.039	13	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	C[5,6]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[3x5,6]O[6]H)(C[5]C[5,5,6]HH)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5,6]C[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[3x5,6]O[6]H)(C[5]C[5,5,6]HH)(C[6]C[5,6]O){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	O(C[6]C[5,6]N[5,6])	123.3540	0.000	1	123.3540	0.000	1	123.3540	0.000	1	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O)	N[5,6](C[5,5,6]C[5,6]2N[5])(C[5]C[5,6]HH)(C[6]C[5a,6]O)	O(C[6]C[5a,6]N[5,6])	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,5,6]C[5])(O){1|N<2>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,6]2N[5])(C[5]C[5,6]HH)(C[6]C[5a,6]O){2|C<3>,2|C<4>,2|N<3>,3|H<1>}	O(C[6]C[5a,6]N[5,6])	122.5680	0.000	2	122.5680	0.000	2	122.5680	0.000	2	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]O[6]H)(C[5]C[6a]C[5]H)(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	N[5,6](C[5,6]C[5]O[6]H)(C[5]C[6a]C[5]H)(C[6]C[6,6a]O){4|C<3>,4|H<1>}	O(C[6]C[6,6a]N[5,6])	123.6330	0.000	1	123.6330	0.000	1	123.6330	0.000	1	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6]-4:S[5]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(N[5,6]C[5,6]S[5])(O)	N[5,6](C[5,6]C[5,6a]N[5a,6]C)(S[5]C[5,6a]OO)(C[6]C[6,6a]O)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(N[5,6]C[5,6]S[5])(O){1|H<1>,1|N<3>,2|O<1>,5|C<3>}	N[5,6](C[5,6]C[5,6a]N[5a,6]C)(S[5]C[5,6a]OO)(C[6]C[6,6a]O){5|C<3>}	O(C[6]C[6,6a]N[5,6])	120.1620	0.000	1	120.1620	0.000	1	120.1620	0.000	1	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,3x6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O)	N[5,6](C[5,3x6]C[5,3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,3x6]C[5,3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	122.2000	0.000	1	122.2000	0.000	1	122.2000	0.000	1	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,2|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	120.3660	0.000	1	120.3660	0.000	1	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,7|H<1>}	O(C[6]N[5,6]C[6])	122.0850	0.372	2	122.0850	0.138	2	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|N<3>,1|O<1>,4|H<1>}	O(C[6]N[5,6]C[6])	122.7130	0.000	1	122.7130	0.000	1	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|S<2>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]HH)(C[6]C[6]O){1|N<3>,1|O<2>,2|O<1>,3|H<1>}	O(C[6]N[5,6]C[6])	123.9520	0.139	2	123.9520	0.019	2	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<2>,1|S<4>,2|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O){1|N<2>,2|H<1>,3|O<1>}	O(C[6]N[5,6]C[6])	124.3990	0.000	1	124.0415	0.256	2	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<3>,1|S<4>,2|H<1>}	N[5,6](C[5,6]C[5]N[6]C)(C[5]S[5]HH)(C[6]C[6]O){1|N<2>,3|H<1>,3|O<1>}	O(C[6]N[5,6]C[6])	123.6840	0.000	1	124.0415	0.256	2	122.9045	1.860	8	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]HH)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]HH)(C[6]N[6]O){1|C<4>,1|H<1>,3|C<3>}	O(C[6]N[5,6]N[6])	120.6530	0.000	2	120.6530	0.000	2	122.7268	6.388	5	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]H)(O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]HH)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]H)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]HH)(C[6]N[6]O){1|C<4>,2|C<3>,4|H<1>}	O(C[6]N[5,6]N[6])	121.7850	0.000	1	121.7850	0.000	1	122.7268	6.388	5	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]S)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6]S)(O){1|O<1>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]N[6]O){1|C<3>,1|S<4>,2|C<4>,4|H<1>}	O(C[6]N[5,6]N[6])	126.5190	0.000	1	126.5190	0.000	1	122.7268	6.388	5	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(O)	N[5,6](C[5,6]C[3x5,6]N[6]C)(C[5]C[5,5,6]HH)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(O){1|N<3>,1|O<1>,2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6]C[3x5,6]N[6]C)(C[5]C[5,5,6]HH)(C[6]N[6]O){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	O(C[6]N[5,6]N[6])	124.0240	0.000	1	124.0240	0.000	1	122.7268	6.388	5	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:S[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]S[5])(N[6]C[6,6a]H)(O)	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]S[5])(N[6]C[6,6a]H)(O){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]N[6]O){1|H<1>,4|C<3>}	O(C[6]N[5,6]N[6])	121.8770	0.000	1	121.8770	0.000	1	121.8770	0.000	1	122.6616	2.504	20	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	5:3:3:	3:	N[5,6]-3:N[5,6]-3:O-1:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](Si[5,6]C[6a]N[5a]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O)	O(C[6]N[5,6]2)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){1|N<3>,3|O<2>,5|C<3>}	N[5,6](Si[5,6]C[6a]N[5a]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O){1|H<1>,8|C<3>}	O(C[6]N[5,6]2)	127.8165	0.190	2	127.8165	0.036	2	127.8165	0.036	2	127.8165	0.036	2	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:1:	6:3:3:	3:	N[5,6]-3:N[5,6]-3:O-1:	Si[5,6]-6:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	N[5,6](Si[5,6]C[6a]N[5a]N[5]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O)	O(C[6]N[5,6]2)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O){2|N<3>,3|O<2>,5|C<3>}	N[5,6](Si[5,6]C[6a]N[5a]N[5]O[5]O[6])(C[5,6a]C[5,6a]C[6a])(C[6]N[5,6]O){10|C<3>,1|H<1>}	O(C[6]N[5,6]2)	130.4170	0.000	1	130.4170	0.000	1	130.4170	0.000	1	130.4170	0.000	1	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	N[5,6](C[5,6]C[5]N[6])(C[5]C[5]C)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O){1|C<4>,1|N<3>,1|O<1>,2|C<3>}	N[5,6](C[5,6]C[5]N[6])(C[5]C[5]C)(C[6]C[6]O){2|C<4>,5|C<3>}	O(C[6]N[5,6]C[6])	122.7130	0.000	1	122.7130	0.000	1	122.6745	0.003	2	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	N[5,6](C[5,6]C[5]N[6])(C[5]P[5]C)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O){1|N<3>,1|O<1>,1|P<4>,2|C<3>}	N[5,6](C[5,6]C[5]N[6])(C[5]P[5]C)(C[6]C[6]O){1|Au<2>,3|C<3>,3|C<4>}	O(C[6]N[5,6]C[6])	122.6360	0.000	1	122.6360	0.000	1	122.6745	0.003	2	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CH)(O){1|H<1>,1|N<2>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O){2|C<3>,2|C<4>,2|H<1>}	O(C[6]N[5,6]C[6])	121.9800	0.000	1	121.9800	0.000	1	121.9324	0.375	5	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CN)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CN)(O){1|H<1>,1|N<2>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	O(C[6]N[5,6]C[6])	122.0240	0.000	1	122.0240	0.000	1	121.9324	0.375	5	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){1|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]O){2|C<3>,3|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	122.5180	0.000	1	122.5180	0.000	1	121.9324	0.375	5	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]O[5])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]O[5])(C[6]C[6]O){1|C<4>,3|C<3>,3|H<1>}	O(C[6]N[5,6]C[6])	120.9050	0.000	1	120.9050	0.000	1	121.9324	0.375	5	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]S[5])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){1|C<4>,1|H<1>,1|S<2>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]S[5])(C[6]C[6]O){1|C<4>,3|C<3>,3|H<1>}	O(C[6]N[5,6]C[6])	122.2350	0.000	1	122.2350	0.000	1	121.9324	0.375	5	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O){1|C<4>,2|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	122.2770	0.000	1	122.2770	0.000	1	122.2770	0.000	1	122.1610	0.329	8	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6a]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6]HH)(O){1|C<4>,2|C<3>,4|H<1>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	121.9110	0.000	1	121.9110	0.000	1	121.9110	0.000	1	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,2|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	120.3590	0.000	1	120.6170	0.133	2	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	120.8750	0.000	1	120.6170	0.133	2	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6])(C[5]C[5,5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5,5]C[6])(C[5]C[5,5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	120.5050	0.000	1	120.5050	0.000	1	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	120.5470	0.000	1	120.5470	0.000	1	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|Si<4>,1|C<4>,1|O<2>,4|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O){3|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	118.4040	0.000	2	118.7128	0.187	5	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|Si<5>,1|C<4>,1|O<2>,4|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O){1|C<4>,3|F<1>,4|H<1>}	O(C[6]N[5,6]C[6])	119.2970	0.000	1	118.7128	0.187	5	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|Si<5>,1|C<4>,1|O<2>,4|H<1>}	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O){1|O<2>,3|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	118.7295	0.466	2	118.7128	0.187	5	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O)	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O){1|S<2>,2|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]CH)(C[6]C[6]O){1|C<3>,1|C<4>,1|N<3>,1|S<2>,2|H<1>}	O(C[6]N[5,6]C[6])	120.8880	0.000	1	120.8880	0.000	1	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O)	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O){1|C<4>,1|S<2>,3|C<3>,4|H<1>}	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|S<2>,2|C<3>,2|H<1>}	O(C[6]N[5,6]C[6])	119.8000	0.000	1	119.8000	0.000	1	119.6853	1.022	11	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]CH)(O){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O){2|C<3>,2|C<4>,2|H<1>}	O(C[6]N[5,6]C[6])	121.3350	0.000	1	121.3350	0.000	1	120.4613	0.627	3	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6a]C[6]H)(O)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6a]C[6]H)(O){1|H<1>,2|O<1>,6|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O){1|C<4>,2|H<1>,3|C<3>}	O(C[6]N[5,6]C[6])	120.0245	0.330	2	120.0245	0.109	2	120.4613	0.627	3	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CC)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CC)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O){2|C<3>,8|C<4>}	O(C[6]N[5,6]C[6])	121.1620	0.000	1	121.1620	0.000	1	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CC)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CC)(O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]N[6]H)(C[6]C[6]O){4|C<3>,5|C<4>}	O(C[6]N[5,6]C[6])	122.2510	0.000	1	122.2510	0.000	1	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|C<4>,1|O<2>,2|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	121.2090	0.000	1	121.4570	0.123	2	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|C<4>,2|C<3>,7|H<1>}	O(C[6]N[5,6]C[6])	121.7050	0.000	1	121.4570	0.123	2	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]C)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]C)(C[6]C[6]O){1|C<4>,2|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	121.1220	0.000	1	121.1220	0.000	1	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	3:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]HH)(O)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]HH)(O){1|H<1>,2|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|N<3>,1|O<1>,2|C<3>,5|H<1>}	O(C[6]N[5,6]C[6])	123.7625	0.411	2	123.7625	0.169	2	122.1391	1.416	7	120.6730	2.258	22	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[4,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[4,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[4,5,6,6]C[4,5,6]C[4,6]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[4,5,6,6]C[5,6a])(C[6]C[6]HH)(O){2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[4,5,6,6]C[4,5,6]C[4,6]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){3|C<3>,3|C<4>,6|H<1>}	O(C[6]N[5,6]C[6])	122.7230	0.000	1	122.7230	0.000	1	122.7230	0.000	1	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6,6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6,6]HH)(O){1|H<1>,1|N<3>,2|C<3>,3|C<4>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|O<2>,3|C<3>,3|H<1>,4|C<4>}	O(C[6]N[5,6]C[6])	122.2250	0.000	1	122.2250	0.000	1	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){3|H<1>,4|C<3>,4|C<4>}	O(C[6]N[5,6]C[6])	122.1690	0.000	1	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|Cl<1>,3|C<3>,3|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	120.3630	0.000	1	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<2>,2|C<3>,3|H<1>,6|C<4>}	O(C[6]N[5,6]C[6])	121.8740	0.000	1	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<2>,3|C<3>,3|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	119.9045	0.544	2	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){3|C<3>,4|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	119.9140	0.000	1	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){4|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	119.9290	0.000	1	120.5797	1.054	7	120.7854	1.242	8	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6]C[5,5]C[6]N[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6]C[5,5]C[6]N[5])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|O<2>,3|C<4>,3|H<1>,4|C<3>}	O(C[6]N[5,6]C[6])	120.2800	0.000	1	120.2800	0.000	1	120.2800	0.000	1	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	122.7703	0.680	35	122.7703	0.463	35	122.7677	0.461	39	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,6]C[6,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O){2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6,6]C[5,6]C[6,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|N<3>,2|C<4>,2|O<2>,3|H<1>,4|C<3>}	O(C[6]N[5,6]C[6])	122.1070	0.000	1	122.1070	0.000	1	122.7677	0.461	39	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[6,6]C[5]N[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N[5,6](C[5,6,6]C[6,6]C[5]N[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<1>,3|C<3>,3|H<1>,4|C<4>}	O(C[6]N[5,6]C[6])	122.4990	0.000	2	122.4990	0.000	2	122.7677	0.461	39	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]O[6]CH)(O)	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]O[6]CH)(O){1|H<1>,2|C<3>,2|C<4>}	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<4>,2|H<1>,2|O<2>,4|C<3>}	O(C[6]N[5,6]C[6])	123.8750	0.000	1	123.8750	0.000	1	122.7677	0.461	39	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O){1|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|C<4>,1|N<3>,4|H<1>,5|C<3>}	O(C[6]N[5,6]C[6])	121.3170	0.000	1	121.3170	0.000	1	121.3170	0.000	1	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]HH)(O){1|C<3>,2|H<1>,4|C<4>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]H)(C[6]C[6]O){1|C<4>,1|O<2>,6|H<1>}	O(C[6]N[5,6]C[6])	122.2700	0.000	1	122.2700	0.000	1	122.2700	0.000	1	122.3689	1.162	51	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[5,6]-4:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6])(C[5,6]N[5,6]C[5]S)(O)	N[5,6](C[5,6,6]C[5,6]C[6]S[6])(C[5,6]C[5,6,6]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](N[5,6]C[5,6,6]C[5,6])(C[5,6]N[5,6]C[5]S)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6](C[5,6,6]C[5,6]C[6]S[6])(C[5,6]C[5,6,6]C[6]H)(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,3|C<4>,4|H<1>}	O(C[6]C[5,6]N[5,6])	123.1260	0.000	1	123.1260	0.000	1	123.1260	0.000	1	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[3x5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]CH)(O){1|O<2>,3|C<4>,4|H<1>}	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,3|H<1>,6|C<4>}	O(C[6]N[5,6]C[6])	120.9080	0.000	1	120.9080	0.000	1	120.7572	0.226	8	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[3x5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]HH)(O){1|O<2>,3|C<4>,4|H<1>}	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,4|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	120.4710	0.195	5	120.4710	0.038	5	120.7572	0.226	8	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[3x5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]HO)(O)	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[3x5,6,6]C[5])(C[6]C[6]HO)(O){1|O<2>,3|C<4>,4|H<1>}	N[5,6](C[3x5,6,6]C[3x5,6]C[5,6,6]O[5,5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	121.3975	0.421	2	121.3975	0.177	2	120.7572	0.226	8	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,3x6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|O<2>,3|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	120.4040	0.000	1	120.9760	0.654	2	120.9760	0.654	2	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,3x6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O){4|C<4>,8|H<1>}	O(C[6]N[5,6]C[6])	121.5480	0.000	1	120.9760	0.654	2	120.9760	0.654	2	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5,6]C[5,6,6]O[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5])(C[6]C[6]HH)(O){1|O<2>,3|C<4>,4|H<1>}	N[5,6](C[5,5,6,6]C[5,5,6]C[5,6,6]O[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,4|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	121.2180	0.000	1	121.2180	0.000	1	121.2180	0.000	1	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]HH)(O){1|O<1>,3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	123.5370	0.000	2	123.5370	0.000	2	123.5645	0.721	6	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]N[5]H)(O)	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]N[5]H)(O){1|N<3>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|F<1>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	O(C[6]N[5,6]C[6])	122.3440	0.000	1	122.3440	0.000	1	123.5645	0.721	6	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]N[6]H)(O)	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]N[6]H)(O){1|N<3>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<3>}	O(C[6]N[5,6]C[6])	124.5080	0.000	1	124.5080	0.000	1	123.5645	0.721	6	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6a]C[6]H)(O)	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6a]C[6]H)(O){1|N<3>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,5,6]C[5,6]N[5,5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<3>}	O(C[6]N[5,6]C[6])	123.7305	1.081	2	123.7305	1.169	2	123.5645	0.721	6	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]HH)(O)	N[5,6](C[5,5]C[5,5]C[5]C)(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]HH)(O){3|H<1>,5|C<4>}	N[5,6](C[5,5]C[5,5]C[5]C)(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|O<2>,3|C<4>,8|H<1>}	O(C[6]N[5,6]C[6])	121.2720	0.000	1	121.2720	0.000	1	122.5718	0.864	4	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]CH)(O)	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]CH)(O){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|C<4>,1|N<2>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	122.5770	0.000	1	122.5770	0.000	1	122.5718	0.864	4	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]HO)(O)	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]HO)(O){1|C<3>,1|H<1>,1|N<3>,1|O<2>,3|C<4>}	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]O)(C[6]C[6]O){1|N<3>,1|O<1>,1|S<4>,2|H<1>,2|O<2>,3|C<3>}	O(C[6]N[5,6]C[6])	123.0410	0.000	1	123.0410	0.000	1	122.5718	0.864	4	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]HS)(O)	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]S)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]N[6]HS)(O){1|C<3>,1|H<1>,1|N<3>,1|S<2>,3|C<4>}	N[5,6](C[5,5]C[5,5]N[5]H)(C[5,6]C[5]C[6]S)(C[6]C[6]O){1|N<3>,1|O<1>,1|S<2>,3|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	123.3970	0.000	1	123.3970	0.000	1	122.5718	0.864	4	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	120.6530	0.000	1	120.6530	0.000	1	121.4256	0.295	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	122.0530	0.000	1	122.0530	0.000	1	121.4256	0.295	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,6]C[6]2)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6,6]C[5,6]C[6]2)(C[5]C[5]HH)(C[6]C[6]O){1|O<2>,3|C<4>,8|H<1>}	O(C[6]N[5,6]C[6])	121.1460	0.000	1	121.1460	0.000	1	121.4256	0.295	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<3>,3|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	121.5320	0.000	1	121.6380	0.022	2	121.4256	0.295	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<4>,3|C<3>,7|H<1>}	O(C[6]N[5,6]C[6])	121.7440	0.000	1	121.6380	0.022	2	121.4256	0.295	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,6]C[6]C)(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]C[6]HH)(O){3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]C)(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|C<3>,1|O<2>,2|C<4>,8|H<1>}	O(C[6]N[5,6]C[6])	122.7800	0.535	2	122.7800	0.286	2	123.2144	0.372	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]N[6]CH)(O){1|C<3>,2|H<1>,4|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|N<3>,1|O<1>,3|C<4>,6|H<1>}	O(C[6]N[5,6]C[6])	123.5675	0.742	2	123.5040	0.287	3	123.2144	0.372	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]N[6]CH)(O){2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	123.3770	0.000	1	123.5040	0.287	3	123.2144	0.372	5	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]HO)(O)	N[5,6](C[5,6]C[5,6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]HO)(O){1|C<3>,1|O<2>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5,6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,2|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	124.3500	0.000	1	124.3500	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[5a,6]HH)(O)	N[5,6](C[5,6]C[5a,6]C[6a]C[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[5a,6]HH)(O){1|S<2>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6]C[5a,6]C[6a]C[5])(C[5]C[5]HH)(C[6]C[6]O){4|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	121.8080	0.000	1	121.8080	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]HS)(O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]O[5]CC)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]HS)(O){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]O[5]CC)(C[6]C[6]O){1|S<4>,2|C<3>,3|H<1>}	O(C[6]N[5,6]C[6])	124.3230	0.000	1	124.3230	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<3>,3|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	120.3320	1.167	2	120.3320	1.361	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[5,5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	121.0020	0.000	1	121.0020	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[5,6a]C[6]C)(C[5]C[5,6a]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){2|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,6a]C[6]C)(C[5]C[5,6a]HH)(C[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	O(C[6]N[5,6]C[6])	121.2700	1.407	2	121.2700	1.980	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<3>,2|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	121.0825	0.450	2	120.8023	0.172	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<3>,3|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	120.5220	0.000	2	120.8023	0.172	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){2|H<1>,3|C<3>,3|C<4>}	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[6a]C[5]H)(C[6]C[6]O){1|C<4>,2|N<2>,5|C<3>,5|H<1>}	O(C[6]N[5,6]C[6])	122.9930	0.000	1	122.9930	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6a]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6a]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O){3|C<4>,4|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	120.8620	0.000	1	120.8620	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CN)(O)	N[5,6](C[5,6]C[6]O[5]C)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CN)(O){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,6]C[6]O[5]C)(C[5]C[5]CH)(C[6]C[6]O){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	O(C[6]N[5,6]C[6])	120.6650	0.000	1	120.6650	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,2|O<2>,5|H<1>}	O(C[6]N[5,6]C[6])	122.0560	0.000	1	121.8050	0.059	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|O<2>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,2|O<2>,5|H<1>}	O(C[6]N[5,6]C[6])	121.7880	0.000	1	121.8050	0.059	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5,5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,2|O<2>,5|H<1>}	O(C[6]N[5,6]C[6])	121.5710	0.000	1	121.8050	0.059	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<3>,2|C<4>,6|H<1>}	O(C[6]N[5,6]C[6])	120.9590	0.000	1	120.9590	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5,6a]C[6,6]H)(C[5]C[5,6a]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<4>,2|C<3>,5|H<1>}	N[5,6](C[5,6]C[5,6a]C[6,6]H)(C[5]C[5,6a]HH)(C[6]C[6]O){2|C<4>,2|H<1>,3|C<3>}	O(C[6]N[5,6]C[6])	122.7960	0.000	2	122.7960	0.000	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|H<1>,6|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|O<1>,6|H<1>}	O(C[6]N[5,6]C[6])	122.2890	0.000	1	121.1050	2.804	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|O<2>,7|H<1>}	O(C[6]N[5,6]C[6])	119.9210	0.000	1	121.1050	2.804	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,8|H<1>}	O(C[6]N[5,6]C[6])	119.7530	0.000	1	119.7530	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]2H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]2H)(C[6]C[6]O){2|C<4>,2|O<2>,8|H<1>}	O(C[6]N[5,6]C[6])	121.6700	0.000	1	121.6700	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,2|O<2>,6|H<1>}	O(C[6]N[5,6]C[6])	121.5970	0.000	1	121.5970	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,3|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	121.7560	0.000	1	121.6695	0.979	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	122.9140	0.000	1	121.6695	0.979	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,2|O<2>,6|H<1>}	O(C[6]N[5,6]C[6])	120.5060	0.000	1	121.6695	0.979	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){2|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	121.5020	0.000	1	121.6695	0.979	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[5a]S[5]S[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,2|C<4>,2|S<2>,3|H<1>}	N[5,6](C[5,6]C[5a]S[5]S[6])(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	121.6185	1.265	2	121.6185	1.600	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|O<2>,3|H<1>,4|C<4>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,6|H<1>}	O(C[6]N[5,6]C[6])	121.7235	0.688	2	121.7235	0.473	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[6]O){1|C<4>,2|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	122.7110	0.000	2	122.7110	0.000	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|I<1>,1|N<3>,6|H<1>}	O(C[6]N[5,6]C[6])	122.7235	0.124	2	122.1135	0.508	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<2>,6|H<1>}	O(C[6]N[5,6]C[6])	121.6070	0.000	1	122.1135	0.508	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|N<3>,7|H<1>}	O(C[6]N[5,6]C[6])	121.4000	0.000	1	122.1135	0.508	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,1|O<2>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|N<2>,1|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	120.7400	0.000	1	121.6120	1.322	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,1|O<2>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	121.1810	0.000	1	121.6120	1.322	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|C<3>,1|O<2>,1|S<4>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|N<2>,1|O<2>,2|O<1>,4|H<1>}	O(C[6]N[5,6]C[6])	122.9150	0.000	1	121.6120	1.322	3	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HO)(O)	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HO)(O){1|C<3>,1|O<2>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,2|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	125.5480	0.000	1	125.5480	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N[5]H)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N[5]H)(O){3|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]CH)(C[6]C[6]O){1|C<4>,1|I<1>,1|N<3>,6|H<1>}	O(C[6]N[5,6]C[6])	123.8150	0.873	5	123.8150	0.762	5	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[5,6]CH)(O)	N[5,6](C[5,6]C[5,6]C[5]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[5,6]CH)(O){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5,6]C[5]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,2|O<2>,5|H<1>}	O(C[6]N[5,6]C[6])	122.2070	0.064	2	122.2070	0.004	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,2|H<1>,4|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,5|H<1>}	O(C[6]N[5,6]C[6])	122.9300	0.000	1	122.9300	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	122.8230	0.000	1	123.0619	0.287	9	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,5|H<1>}	O(C[6]N[5,6]C[6])	123.0300	0.650	5	123.0619	0.287	9	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,5|H<1>}	O(C[6]N[5,6]C[6])	123.1947	0.493	3	123.0619	0.287	9	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]S[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]S[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,3|H<1>}	O(C[6]N[5,6]C[6])	122.6365	0.464	4	122.6365	0.215	4	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[6]N[5]C)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[6]N[5]C)(C[5]C[5]HH)(C[6]C[6]O){1|H<1>,1|N<3>,2|C<4>,2|O<1>}	O(C[6]N[5,6]C[6])	122.0740	0.000	1	122.0740	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|N<2>,2|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	121.5280	0.000	1	121.4055	0.030	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[5]CH)(C[6]C[6]O){1|N<3>,2|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	121.2830	0.000	1	121.4055	0.030	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O)	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CH)(O){1|C<3>,1|S<2>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]S[5]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,3|H<1>}	O(C[6]N[5,6]C[6])	122.6610	0.427	2	122.6610	0.182	2	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CO)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CO)(O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,4|H<1>}	O(C[6]N[5,6]C[6])	122.2910	0.000	1	122.2910	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CS)(O)	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]CS)(O){1|C<3>,2|H<1>,4|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,1|S<2>,4|H<1>}	O(C[6]N[5,6]C[6])	121.8260	0.000	1	121.8260	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|N<3>,1|O<1>,6|H<1>}	O(C[6]N[5,6]C[6])	123.1490	0.000	1	123.1490	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[6]O){1|N<2>,1|O<2>,2|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	123.3150	0.000	1	123.3150	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O)	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]CH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O){1|H<1>,1|S<2>,2|C<3>,3|C<4>}	N[5,6](C[5,6]C[5]C[6]S)(C[5]C[5]CH)(C[6]C[6]O){1|N<3>,2|O<1>,4|H<1>}	O(C[6]N[5,6]C[6])	123.3720	0.000	1	123.3720	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]O[6]CC)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]O[6]CC)(O){1|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|O<1>,1|O<2>,2|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	122.1790	0.000	1	122.1790	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]O[6]CH)(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]O[6]CH)(O){3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|O<2>,7|H<1>}	O(C[6]N[5,6]C[6])	122.5850	0.000	1	122.5850	0.000	1	122.2166	1.415	77	122.1826	1.481	109	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6,6]C[5,6]N[6,6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6,6]O)(C[5]O[5]HH)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]C[5,6]N[6,6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,4|C<3>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6,6]O)(C[5]O[5]HH){1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<4>}	O(C[6]C[5,6,6]N[5,6])	122.3890	0.000	1	122.3890	0.000	1	122.3890	0.000	1	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]HH){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>}	O(C[6]C[5,6]N[5,6])	123.6580	0.000	1	123.6580	0.000	1	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]S[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|S<2>,3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]S[5]CH){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	O(C[6]C[5,6]N[5,6])	125.2890	0.000	1	125.2890	0.000	1	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){2|C<3>,4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]CH){1|C<3>,1|C<4>,1|N<3>,1|O<1>,4|H<1>}	O(C[6]C[5,6]N[5,6])	123.1975	0.415	2	124.0883	1.140	4	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){3|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]CH){1|C<3>,1|C<4>,1|N<3>,1|O<1>,3|H<1>}	O(C[6]C[5,6]N[5,6])	124.9790	0.274	2	124.0883	1.140	4	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,4|H<1>}	O(C[6]C[5,6]N[5,6])	122.9495	0.271	2	123.0442	0.080	6	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,5|H<1>}	O(C[6]C[5,6]N[5,6])	123.0915	0.316	4	123.0442	0.080	6	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]O)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]O)(C[6]C[5,6]O)(C[5]C[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]O)(N[5,6]C[5,6]C[5])(O){1|O<2>,3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]O)(C[6]C[5,6]O)(C[5]C[5]CH){1|C<3>,1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	O(C[6]C[5,6]N[5,6])	124.2130	0.451	2	124.2130	0.204	2	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]S)(C[6]C[5,6]O)(C[5]C[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]C[5])(O){1|S<2>,3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]S)(C[6]C[5,6]O)(C[5]C[5]CH){1|C<3>,1|C<4>,1|N<3>,1|O<1>,1|S<2>,2|H<1>}	O(C[6]C[5,6]N[5,6])	122.0870	0.197	2	122.0870	0.039	2	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]S)(C[6]C[5,6]O)(C[5]C[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]C[5])(O){1|C<3>,1|S<2>,4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]S)(C[6]C[5,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|S<2>,4|H<1>}	O(C[6]C[5,6]N[5,6])	123.0140	0.598	2	123.0140	0.358	2	123.4552	0.925	18	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]C[6,6]C[6]C)(N[5,6]C[5,6]C[5])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<4>,2|C<3>,6|H<1>}	O(C[6]C[6,6]N[5,6])	122.7380	0.000	1	122.6535	0.014	2	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]C[6,6]C[6]C)(N[5,6]C[5,6]C[5])(O){5|C<4>,6|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<2>,1|O<2>,2|C<4>,5|H<1>}	O(C[6]C[6,6]N[5,6])	122.5690	0.000	1	122.6535	0.014	2	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]C[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O){5|C<4>,6|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|O<2>,2|C<4>,6|H<1>}	O(C[6]C[6,6]N[5,6])	120.3320	0.000	1	120.3320	0.000	1	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]N[6,6]C[6]H)(N[5,6]C[5,6]C[5])(O){2|C<3>,3|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,5|H<1>}	O(C[6]C[6,6]N[5,6])	122.7200	0.000	1	122.7200	0.000	1	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6,6]C[5]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]N[6,6]C[6]H)(N[5,6]C[5,6]C[5])(O){1|C<3>,3|C<4>,6|H<1>}	N[5,6](C[5,6]C[6,6]C[5]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|Cl<1>,1|C<3>,1|C<4>,1|N<3>,5|H<1>}	O(C[6]C[6,6]N[5,6])	121.4340	0.000	1	121.4340	0.000	1	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]N[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<3>,1|N<3>,1|O<1>,1|O<2>,4|H<1>}	O(C[6]C[6,6]N[5,6])	124.3130	0.000	1	123.6825	0.795	2	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]N[6,6]C[6]O)(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6,6]O)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<1>,1|O<2>,4|H<1>}	O(C[6]C[6,6]N[5,6])	123.0520	0.000	1	123.6825	0.795	2	122.4511	1.587	7	123.1438	1.237	26	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6,6]C[5,6])(O)	N[5,6](C[5,6,6]C[5,6]C[6]S[6])(C[5,6]C[5,6,6]C[6]H)(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6,6]C[5,6])(O){1|C<3>,1|S<2>,3|H<1>,6|C<4>}	N[5,6](C[5,6,6]C[5,6]C[6]S[6])(C[5,6]C[5,6,6]C[6]H)(C[6]C[5,6,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,3|C<4>,4|H<1>}	O(C[6]C[5,6,6]N[5,6])	122.3180	0.000	1	122.3180	0.000	1	122.3180	0.000	1	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]C[5,6]N[5,6]S[6])(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]C[5,6]N[5,6]S[6])(N[5,6]C[5,6]2)(O){1|C<3>,1|S<2>,3|H<1>,6|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]C[5,6,6]N[5,6])	123.1380	0.000	1	123.1380	0.000	1	123.2846	0.300	5	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6]2)(O){1|C<3>,1|S<2>,3|H<1>,6|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]C[5,6,6]N[5,6])	123.4050	1.069	2	123.3212	0.391	4	123.2846	0.300	5	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]N[5,6,6]C[5]S[6])(N[5,6]C[5,6]2)(O){1|S<2>,2|C<3>,3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6,6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<3>,3|H<1>}	O(C[6]C[5,6,6]N[5,6])	123.2375	0.022	2	123.3212	0.391	4	123.2846	0.300	5	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6,6]C[5,6]N[6,6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[5,6,6]O)	O(C[6]C[5,6,6]N[5,6])	C[6](C[5,6,6]C[5,6]N[6,6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|H<1>,5|C<3>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[5,6,6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	O(C[6]C[5,6,6]N[5,6])	123.3860	0.000	1	123.3860	0.000	1	123.3860	0.000	1	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[3,5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O){1|C<3>,4|H<1>,5|C<4>}	N[5,6](C[5,6]C[3,5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O){1|N<3>,1|O<1>,2|O<2>,3|C<4>,4|H<1>}	O(C[6]C[5,6]N[5,6])	123.2510	0.161	2	123.2510	0.026	2	123.6396	1.118	14	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O){1|C<3>,4|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O){1|N<3>,1|O<1>,3|C<4>,6|H<1>}	O(C[6]C[5,6]N[5,6])	125.0165	0.896	2	124.3375	0.530	8	123.6396	1.118	14	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O){3|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	O(C[6]C[5,6]N[5,6])	124.3438	0.577	4	124.3375	0.530	8	123.6396	1.118	14	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]2)(O){3|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,4|H<1>}	O(C[6]C[5,6]N[5,6])	123.6460	0.174	2	124.3375	0.530	8	123.6396	1.118	14	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]2)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6]O){1|N<3>,1|O<1>,1|S<2>,3|C<4>,5|H<1>}	O(C[6]C[5,6]N[5,6])	122.4382	0.524	4	122.4382	0.274	4	123.6396	1.118	14	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){1|C<3>,1|O<2>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[6]O[5]H)(C[5]C[6a]C[5]H)(C[6]C[5,6]O){2|C<3>,3|C<4>,4|H<1>}	O(C[6]C[5,6]N[5,6])	121.5570	0.000	1	121.5570	0.000	1	124.5250	3.365	8	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|H<1>,4|C<3>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[6a]O[5]H)(C[6]C[5,6]O){1|N<3>,1|O<1>,1|O<2>,2|H<1>,3|C<3>}	O(C[6]C[5,6]N[5,6])	123.9110	0.000	1	123.9110	0.000	1	124.5250	3.365	8	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,6]C[5]H)(C[5]C[5]S[5]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){2|S<2>,4|C<4>,4|H<1>}	N[5,6](C[5,6]C[5,6]C[5]H)(C[5]C[5]S[5]H)(C[6]C[5,6]O){1|N<2>,1|N<3>,1|S<2>,2|C<4>,5|H<1>}	O(C[6]C[5,6]N[5,6])	123.2730	1.168	2	123.2730	1.365	2	124.5250	3.365	8	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5,5]HH)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){1|C<3>,4|C<4>,5|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5,5]HH)(C[6]C[5,6]O){1|C<3>,1|C<4>,1|O<1>,2|N<3>,3|H<1>}	O(C[6]C[5,6]N[5,6])	126.0465	0.450	4	126.0465	0.202	4	124.5250	3.365	8	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5]C[5,5]C[6a]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]H)(N[5,6]C[5,6]C[5])(O){2|C<3>,4|C<4>,4|H<1>}	N[5,6](C[5]C[5,5]C[6a]H)(C[5,6]C[5]C[6]H)(C[6]C[5,6]O){1|C<4>,1|N<3>,1|O<1>,3|H<1>,4|C<3>}	O(C[6]C[5,6]N[5,6])	124.2450	0.000	1	124.2450	0.000	1	124.2450	0.000	1	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP2	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6]C[6a])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5,5,6]C[6]H)(C[5]C[5,5,6]HH)(C[6]C[6,6]O)	O(C[6]C[6,6]N[5,6])	C[6](C[6,6]C[6,6a]N[6,6]C[6a])(N[5,6]C[5,6]C[5])(O){3|C<4>,3|H<1>,5|C<3>}	N[5,6](C[5,6]C[5,5,6]C[6]H)(C[5]C[5,5,6]HH)(C[6]C[6,6]O){1|N<3>,1|O<1>,2|C<3>,2|C<4>,2|H<1>}	O(C[6]C[6,6]N[5,6])	122.8880	0.000	1	122.8880	0.000	1	122.8880	0.000	1	123.7553	1.617	31	122.4361	3.083	320	122.6813	3.379	358
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6,6]	O	3:4:1:	4:4:3:	3:	N[5,6,6]-3:C[5,6]-4:O-1:	C[5,5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](N[5,6,6]C[5,5,6,6]C[5,6,6])(C[5,6]N[5,6]C[5]S)(O)	N[5,6,6](C[5,5,6,6]C[5,5]S[5,6]C[6])(C[5,6,6]C[5,5,6,6]C[6]H)(C[6]C[5,6]O)	O(C[6]N[5,6,6]C[5,6])	C[6](N[5,6,6]C[5,5,6,6]C[5,6,6])(C[5,6]N[5,6]C[5]S)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,5,6,6]C[5,5]S[5,6]C[6])(C[5,6,6]C[5,5,6,6]C[6]H)(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|S<2>,2|C<4>,2|O<2>,3|H<1>}	O(C[6]N[5,6,6]C[5,6])	122.0900	0.000	1	122.0900	0.000	1	122.0900	0.000	1	122.0900	0.000	1	122.8090	1.034	2	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6,6]-3:O-1:	C[5,6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O)	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O)	O(C[6]N[5,6,6]C[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6,6]C[5,6,6]2)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6,6](C[5,6,6]C[5,6]C[6,6]H)(C[5,6,6]C[5]C[6]S[6])(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]N[5,6,6]C[5,6])	123.5280	0.000	1	123.5280	0.000	1	123.5280	0.000	1	123.5280	0.000	1	122.8090	1.034	2	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	N[5,6](C[5,6]C[5,5]C[6a]O[6])(C[5]C[5]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O){1|O<1>,1|O<2>,2|C<4>,4|C<3>}	N[5,6](C[5,6]C[5,5]C[6a]O[6])(C[5]C[5]O)(C[6]C[6]O){8|C<3>}	O(C[6]N[5,6]C[6])	120.6950	0.000	1	120.6950	0.000	1	120.6950	0.000	1	120.5205	0.061	2	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:3:1:	4:3:3:	3:	N[5,6]-3:N[6]-3:O-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	O(C[6]N[5,6]N[6])	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O){1|C<4>,4|C<3>}	O(C[6]N[5,6]N[6])	120.3460	0.000	1	120.3460	0.000	1	120.3460	0.000	1	120.5205	0.061	2	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:3:1:	4:3:4:	3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6,6]C[5])(O)	N[5,6](C[5,6,6]C[5,6,6]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH)	O(C[6]C[6,6a]N[5,6])	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6,6]C[5])(O){2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,6,6]C[5,6,6]C[6]H)(C[6]C[6,6a]O)(C[5]C[5]HH){1|C<4>,2|H<1>,4|C<3>}	O(C[6]C[6,6a]N[5,6])	120.6340	0.000	1	120.6340	0.000	1	120.6340	0.000	1	120.6340	0.000	1	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:3:1:	4:4:3:	3:	N[5,6]-3:C[6]-3:O-1:	C[5,5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6]C)(O)	N[5,6](C[5,5,6]C[5,5]C[6]O[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]N[6]C)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[5,5]C[6]O[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|N<3>,1|O<1>,2|C<4>,3|H<1>}	O(C[6]N[5,6]C[6])	123.1370	0.000	1	123.1370	0.000	1	123.1370	0.000	1	123.1370	0.000	1	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	3:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-3:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HO)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HO)(O){1|C<4>,2|H<1>,3|C<3>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<2>,2|C<3>,2|H<1>,4|C<4>}	O(C[6]N[5,6]C[6])	123.2230	0.000	1	123.2230	0.000	1	123.2230	0.000	1	123.2230	0.000	1	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[3,5,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[3,5,6]C[5,6])(C[6]C[6]CC)(O)	N[5,6](C[3,5,6]C[3,6]P[3,5]C[6])(C[5,6]C[5]N[6])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[3,5,6]C[5,6])(C[6]C[6]CC)(O){1|C<4>,1|N<3>,1|O<1>,1|P<3>,2|C<3>}	N[5,6](C[3,5,6]C[3,6]P[3,5]C[6])(C[5,6]C[5]N[6])(C[6]C[6]O){4|C<3>,5|C<4>}	O(C[6]N[5,6]C[6])	121.6140	0.000	1	121.6140	0.000	1	121.6140	0.000	1	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[4,5,6]C[4,5]C[4,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6]C[6]HH)(O){2|C<4>,2|H<1>,3|C<3>}	N[5,6](C[4,5,6]C[4,5]C[4,6]C[6a])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|N<3>,2|C<4>,4|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	121.4870	0.000	1	121.4870	0.000	1	122.1370	0.845	2	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[4,5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[4,5,6]C[4,5]C[4,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[4,5,6]C[5,6a])(C[6]C[6]HH)(O){2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[4,5,6]C[4,5]C[4,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<3>,2|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	122.7870	0.000	1	122.7870	0.000	1	122.1370	0.845	2	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){1|O<2>,3|C<3>,3|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	119.8268	0.216	5	119.8987	0.076	12	119.8987	0.076	12	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,5,6,6]C[5,5]C[6,6]N[5,6])(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){3|C<3>,4|H<1>,5|C<4>}	O(C[6]N[5,6]C[6])	119.9500	0.318	7	119.8987	0.076	12	119.8987	0.076	12	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HH)(O){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	N[5,6](C[5,6,6]C[5,5,6]C[6,6]H)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]O){2|C<3>,4|C<4>,4|H<1>}	O(C[6]N[5,6]C[6])	122.6284	0.537	27	122.6284	0.289	27	122.6284	0.289	27	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:3:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[5]O[5]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	N[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[5]O[5]O)(C[6]C[6]O){1|C<3>,2|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	120.4400	0.000	1	120.4400	0.000	1	120.4400	0.000	1	121.7693	1.742	43	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,3x6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]HH)(O){4|C<4>,4|H<1>}	N[5,6](C[5,3x6]C[3x6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]O){2|Cl<1>,1|C<3>,3|C<4>,6|H<1>}	O(C[6]N[5,6]C[6])	121.3580	0.000	1	121.3580	0.000	1	121.3580	0.000	1	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6,6]HH)(O)	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6,6]HH)(O){1|C<3>,3|C<4>,4|H<1>}	N[5,6](C[5,6,6]C[5,6]C[6,6]H)(C[5]C[5]HH)(C[6]C[6]O){1|C<3>,1|C<4>,7|H<1>}	O(C[6]N[5,6]C[6])	122.0700	0.000	1	122.0700	0.000	1	121.6495	0.354	2	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6](C[5,6,6]C[6,6]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<4>,3|C<3>,7|H<1>}	O(C[6]N[5,6]C[6])	121.2290	0.000	1	121.2290	0.000	1	121.6495	0.354	2	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6]O[5]C)(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[6]O[5]C)(C[5]C[6a]C[5]H)(C[6]C[6]O){2|C<3>,2|C<4>,5|H<1>}	O(C[6]N[5,6]C[6])	120.6550	0.000	1	120.6550	0.000	1	122.1375	2.968	4	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	N[5,6](C[5,6]C[6a]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6a]C[6]O[5])(C[5]C[6a]C[5]H)(C[6]C[6]O){3|C<4>,4|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	120.6560	0.000	1	120.6560	0.000	1	122.1375	2.968	4	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O)	N[5,6](C[5,6]C[6a]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HN)(O){1|N<3>,2|C<3>,2|C<4>,3|H<1>}	N[5,6](C[5,6]C[6a]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O){1|C<4>,1|N<3>,2|C<3>,6|H<1>}	O(C[6]N[5,6]C[6])	123.3770	0.000	1	123.3770	0.000	1	122.1375	2.968	4	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	3:4:1:	4:4:3:	3:	N[5,6]-3:C[6]-4:O-1:	C[5,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O)	N[5,6](C[5,6]C[5,5]C[6]C)(C[5]C[5,5]C[6a]H)(C[6]C[6]O)	O(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]HH)(O){1|H<1>,2|C<3>,4|C<4>}	N[5,6](C[5,6]C[5,5]C[6]C)(C[5]C[5,5]C[6a]H)(C[6]C[6]O){1|N<3>,1|O<1>,4|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])	123.8620	0.000	1	123.8620	0.000	1	122.1375	2.968	4	121.8867	1.650	7	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]CH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,3|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]CH){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>}	O(C[6]C[5,6]N[5,6])	125.3610	0.000	1	125.3610	0.000	1	123.8700	1.115	4	123.8700	1.115	4	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|O<2>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]O[5]HH){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	O(C[6]C[5,6]N[5,6])	123.1230	0.081	2	123.1230	0.006	2	123.8700	1.115	4	123.8700	1.115	4	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:3:4:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[6]-3:C[5]-4:	C[6]-3:	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]S[5]HH)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]C[5]N[6]O[5])(N[5,6]C[5,6]C[5])(O){1|S<2>,2|C<4>,3|C<3>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[5,6]O)(C[5]S[5]HH){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	O(C[6]C[5,6]N[5,6])	123.8730	0.000	1	123.8730	0.000	1	123.8700	1.115	4	123.8700	1.115	4	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,5,6,6]N[5,6,6]C[5,5]S[5,6])(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,5,6,6]O)	O(C[6]C[5,5,6,6]N[5,6])	C[6](C[5,5,6,6]N[5,6,6]C[5,5]S[5,6])(N[5,6]C[5,6]2)(O){1|C<3>,1|S<2>,3|H<1>,6|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,5,6,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]C[5,5,6,6]N[5,6])	121.3210	0.000	1	121.7530	0.373	2	121.7530	0.373	2	122.1465	0.354	4	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,5,6,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,5,6,6]N[5,6,6]C[5,5]S[5,6])(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,5,6,6]O)	O(C[6]C[5,5,6,6]N[5,6])	C[6](C[5,5,6,6]N[5,6,6]C[5,5]S[5,6])(N[5,6]C[5,6]2)(O){1|S<2>,2|C<3>,3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,5,6,6]O){1|C<4>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<3>,3|H<1>}	O(C[6]C[5,5,6,6]N[5,6])	122.1850	0.000	1	121.7530	0.373	2	121.7530	0.373	2	122.1465	0.354	4	121.9268	1.817	63	121.9539	1.800	65
762	542	863	0:SP2_SP2_SP3	C[6]	N[5,6]	O	4:3:1:	4:4:3:	3:	C[5,6]-4:N[5,6]-3:O-1:	C[5,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]2)(O)	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6]O)	O(C[6]C[5,6]N[5,6])	C[6](C[5,6]N[5,6]C[5]S)(N[5,6]C[5,6]2)(O){1|C<3>,1|S<2>,3|H<1>,5|C<4>}	N[5,6](C[5,6]C[5,6]C[6]H)(C[5,6]C[5]C[6]S)(C[6]C[5,6]O){1|C<3>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,2|C<4>,4|H<1>}	O(C[6]C[5,6]N[5,6])	122.5400	0.266	2	122.5400	0.071	2	122.5400	0.071	2	122.1465	0.354	4	121.9268	1.817	63	121.9539	1.800	65
762	542	893	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:2:	3:3:3:	3:4:	N[5,6]-3:C[6]-3:O-2:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:Si-4:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])(SiC3)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O){1|C<4>,3|C<3>,4|H<1>}	O(C[6]N[5,6]C[6])(SiC3)	113.5050	0.041	2	113.5050	0.002	2	113.5050	0.002	2	113.5050	0.002	2	115.2245	3.983	4	115.2245	3.983	4
762	542	893	0:SP2_SP2_SP2	C[6]	N[5,6]	O	3:3:2:	4:3:3:	3:4:	N[5,6]-3:C[6]-3:O-2:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:C-4:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC)	N[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]O)	O(C[6]N[5,6]C[6])(CH3)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC){1|C<3>,1|O<1>,1|O<2>,2|C<4>}	N[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]O){1|H<1>,1|N<2>,1|O<2>,2|C<4>}	O(C[6]N[5,6]C[6])(CH3)	116.9440	0.349	2	116.9440	0.122	2	116.9440	0.122	2	116.9440	0.122	2	115.2245	3.983	4	115.2245	3.983	4
762	542	899	0:SP2_SP-NON_SP2	C[6]	N[5,6]	C	3:2:1:	3:3:2:	3:	N[5,6]-3:C[6]-2:C-1:	C[5,6]-3:C[6]-3:N[5]-2:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(C)	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(C){1|C<1>,1|C<2>,2|N<2>}	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|C<3>}	C(C[6]N[5,6]C[6])	117.3060	0.000	1	117.3060	0.000	1	117.3060	0.000	1	117.3060	0.000	1	117.3060	0.000	1	117.3060	0.000	1
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:2:	3:3:3:	3:2:	N[5]-3:N[6]-2:N[6]-2:	C[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-2:	C[6](N[5]C[5,6]C[5])(N[6]C[6])2	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]O)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6])	C[6](N[5]C[5,6]C[5])(N[6]C[6])2{1|O<2>,2|C<2>,2|C<3>}	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]O)(C[6]N[6]2){1|O<1>,4|C<2>}	N[6](C[6]N[5]N[6])(C[6]C[6]){1|C<2>,2|C<3>}	115.9935	0.894	2	115.9935	0.800	2	115.9935	0.800	2	115.9935	0.800	2	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:2:	3:3:3:	3:3:	N[5]-3:N[6]-2:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]2)(N[6]C[6])2	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]O)	C[6](N[5]C[5]2)(N[6]C[6])2{1|C<3>,1|N<2>,1|O<1>,2|H<1>,2|N<3>}	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]O){3|C<3>}	116.5930	0.000	2	114.4587	2.757	6	114.0815	2.457	8	114.0815	2.457	8	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:2:	3:3:3:	3:3:	N[5]-3:N[6]-2:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]2)(N[6]C[6])2	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]O)	C[6](N[5]C[5]2)(N[6]C[6])2{1|C<3>,2|H<1>,2|N<3>,2|O<1>}	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]O){1|H<1>,3|C<3>}	113.3915	0.198	4	114.4587	2.757	6	114.0815	2.457	8	114.0815	2.457	8	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:2:	3:3:3:	3:3:	N[5]-3:N[6]-2:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]2)(N[6]C[6])2	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])2	C[6](N[5]C[5]2)(N[6]C[6])2{1|C<3>,1|N<2>,1|O<1>,2|H<1>,2|N<3>}	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	N[6](C[6]N[5]N[6])2{5|C<3>}	112.9500	0.000	2	112.9500	0.000	2	114.0815	2.457	8	114.0815	2.457	8	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:2:3:	4:4:3:	3:3:	N[6]-3:N[6]-2:N[5]-3:	C[5]-4:C[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(N[5]C[5]2)	N[5](C[5]C[5]HH)2(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5]N[6])	C[6](N[6]C[6a]C[6])(N[6]C[6,6a])(N[5]C[5]2){1|N<2>,2|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5]HH)2(C[6]N[6]2){3|C<3>,4|H<1>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5]N[6]){1|H<1>,2|C<4>,4|C<3>}	120.1550	0.000	1	120.1550	0.000	1	120.1550	0.000	1	120.1550	0.000	1	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:2:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-2:	C[6](N[5]C[5]N[5])(N[6]N[6]Co)(N[6]N[6])	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(N[6]C[6])	C[6](N[5]C[5]N[5])(N[6]N[6]Co)(N[6]N[6]){1|C<4>,3|C<3>}	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|N<2>}	N[6](C[6]N[5]N[6])(N[6]C[6]){1|Co<6>,1|C<3>,1|N<2>,2|N<3>}	119.2075	0.411	2	119.2075	0.169	2	120.2300	0.926	5	120.2300	0.926	5	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:2:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[6]-2:	C[6](N[5]C[5]N[5])(N[6]N[6]Fe)(N[6]N[6])	N[5](N[5]C[5]Fe)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(N[6]C[6])	C[6](N[5]C[5]N[5])(N[6]N[6]Fe)(N[6]N[6]){1|C<4>,3|C<3>}	N[5](N[5]C[5]Fe)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|N<2>}	N[6](C[6]N[5]N[6])(N[6]C[6]){1|Fe<6>,1|C<3>,1|N<2>,2|N<3>}	120.9117	0.155	3	120.9117	0.024	3	120.2300	0.926	5	120.2300	0.926	5	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Mn)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Mn)(C[6]N[6]2){1|C<4>,1|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Mn<6>,1|H<1>,3|C<3>}	119.1360	0.000	1	119.1360	0.000	1	120.2840	8.792	7	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ni)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Ni)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ni)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Ni)(C[6]N[6]2){1|C<4>,1|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ni<6>,1|H<1>,3|C<3>}	117.8035	0.636	2	117.8035	0.404	2	120.2840	8.792	7	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Pd)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(N[6]C[6]){1|N<2>,2|C<3>,3|N<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Pd)(C[6]N[6]2){1|C<4>,1|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Pd<4>,3|C<3>}	124.3835	0.588	2	124.3835	0.345	2	120.2840	8.792	7	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Re)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Re)(C[6]N[6]2){1|C<4>,1|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Re<6>,1|H<1>,3|C<3>}	118.1020	0.000	1	118.1020	0.000	1	120.2840	8.792	7	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Ru)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(N[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Ru)(C[6]N[6]2){3|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<9>,1|H<1>,3|C<3>}	120.3760	0.000	1	120.3760	0.000	1	120.2840	8.792	7	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5]-3:C[6]-3:N[5]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]V)(N[6]C[6])	N[5](C[5]C[5]C)(C[6]N[6]2)(N[5]C[5]V)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]V)(N[6]C[6]){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	N[5](C[5]C[5]C)(C[6]N[6]2)(N[5]C[5]V){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|N<3>,1|V<7>,2|C<3>}	121.1530	0.028	2	121.1530	0.001	2	121.1530	0.001	2	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(N[6]C[6])	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(N[6]C[6]){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Co<5>,1|N<3>,2|C<3>}	120.3333	0.442	3	120.3333	0.195	3	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6])	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6]){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Cu<5>,1|N<3>,2|C<3>}	121.6915	0.101	2	120.1893	1.490	6	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6])	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6]){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Cu<6>,1|N<3>,2|C<3>}	119.4383	0.473	4	120.1893	1.490	6	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6])	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6]){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Ni<6>,1|N<3>,2|C<3>}	120.3990	0.040	2	120.8990	0.337	4	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6])	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]N[6]N)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6]){1|C<4>,1|N<3>,2|C<3>,2|N<2>}	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]N[6]N){1|Ni<6>,1|N<3>,2|C<3>}	121.3990	0.098	2	120.8990	0.337	4	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]C[6])	N[5](N[5]C[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]C[6]){3|C<3>,3|H<1>}	N[5](N[5]C[5]Pd)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	116.4100	0.000	1	116.4100	0.000	1	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Rh)(N[6]C[6])	N[5](N[5]C[5]Rh)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Rh)(N[6]C[6]){3|C<3>,3|H<1>}	N[5](N[5]C[5]Rh)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	116.6575	0.340	2	116.6575	0.116	2	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(N[6]C[6])	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(N[6]C[6]){3|C<3>,3|H<1>}	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	116.5090	0.811	4	116.5090	0.658	4	119.0746	4.294	20	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cu)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]C[5]H)(C[5]N[5]O)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Cu)(N[5]C[5]2)(N[6]C[6]){1|N<3>,1|O<2>,2|C<3>,3|H<1>}	N[5](C[5]C[5]H)(C[5]N[5]O)(C[6]N[6]2){1|Cu<6>,1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Cu<6>,1|H<1>,3|C<3>}	115.1760	0.000	1	115.1760	0.000	1	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ir<8>,1|H<1>,3|C<3>}	118.9020	0.000	1	118.7750	0.032	2	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ir<8>,1|H<1>,3|C<3>}	118.6480	0.000	1	118.7750	0.032	2	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,3|C<3>}	119.4668	0.579	8	118.9613	0.625	15	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,3|C<3>}	118.3836	0.582	7	118.9613	0.625	15	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Re)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Re)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Re)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Re)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Re<6>,1|H<1>,3|C<3>}	118.5863	0.758	3	118.5863	0.574	3	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Rh)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Rh)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<8>,1|H<1>,3|C<3>}	120.5930	2.755	2	120.5930	7.589	2	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:N[5]-3:N[6]-2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ru)(N[5]C[5]2)(N[6]C[6])	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ru)(N[5]C[5]2)(N[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]N[6]2){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<6>,1|H<1>,3|C<3>}	119.3708	0.799	4	119.3708	0.638	4	118.9471	1.548	27	119.2386	3.498	56	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:3:3:	4:3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C[6]-3:	P[6]-4:C[6]-3:	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]P[6])	N[5](N[5]C[5]Pd)(C[5]C[5]C)(C[6]N[6]2)	N[6](P[6]N[5a]N[6]O)(C[6]N[5]N[6])	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]P[6]){1|C<4>,1|N<2>,1|O<1>,2|C<3>,2|N<3>}	N[5](N[5]C[5]Pd)(C[5]C[5]C)(C[6]N[6]2){1|C<3>,1|C<4>,1|H<1>,1|P<4>}	N[6](P[6]N[5a]N[6]O)(C[6]N[5]N[6]){1|Pd<4>,1|N<2>,1|N<3>,3|C<3>}	121.1105	0.243	2	121.1105	0.059	2	121.1105	0.059	2	121.1105	0.059	2	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:4:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(N[6]C[6]){1|C<4>,3|C<3>,4|H<1>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(C[6]N[6]2){1|Ir<8>,2|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ir<8>,1|C<4>,1|H<1>,2|C<3>}	116.9440	0.000	1	116.9440	0.000	1	116.9560	0.000	2	116.9560	0.000	2	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP2	C[6]	N[5]	N[6]	3:3:2:	3:4:3:	3:3:	N[5]-3:N[6]-3:N[6]-2:	C[5,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(N[6]C[6])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(C[6]N[6]2)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(N[6]C[6]){1|C<4>,3|C<3>,4|H<1>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(C[6]N[6]2){1|Rh<8>,2|H<1>,4|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	116.9680	0.000	1	116.9680	0.000	1	116.9560	0.000	2	116.9560	0.000	2	118.6768	5.962	76	118.6768	5.962	76
762	542	914	0:SP2_SP2_SP3	C[6]	N[5]	N[6]	3:3:2:	3:4:4:	3:3:	C[6,6a]-3:N[5]-3:N[6]-2:	C[6]-3:C[5]-4:C[5]-4:	C[6]-3:C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(N[5]C[5]2)(N[6]C[6])	N[5](C[6]C[6,6a]N[6])(C[5]C[5]HH)2	N[6](C[6]C[6,6a]N[5])(C[6]C[6]N)	C[6](C[6,6a]C[6,6a]C[6a])(N[5]C[5]2)(N[6]C[6]){1|N<2>,2|C<3>,3|C<4>,5|H<1>}	N[5](C[6]C[6,6a]N[6])(C[5]C[5]HH)2{3|C<3>,4|H<1>}	N[6](C[6]C[6,6a]N[5])(C[6]C[6]N){2|C<3>,4|C<4>}	117.5870	0.000	1	117.5870	0.000	1	117.5870	0.000	1	117.5870	0.000	1	117.5870	0.000	1	117.5870	0.000	1
762	542	914	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:2:1:	4:3:3:	3:3:	N[5,6]-3:N[6]-2:H-1:	C[5,6]-4:N[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(H)	N[5,6](C[5,6]C[6,6a]C[5,6]H)(N[5]C[5,6]S)(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5,6]H)(N[5]C[5,6]S)(C[6]N[6]H){1|H<1>,2|C<4>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	125.4060	0.000	1	125.4060	0.000	1	125.4060	0.000	1	125.4060	0.000	1	123.4110	1.873	4	123.4110	1.873	4
762	542	914	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:2:3:	4:3:3:	3:3:	N[5,6]-3:N[6]-2:C-3:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(N[6]C[6,6a])(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[6a]C[5])(C[5,6a]C[5,6a]C[6a])(C[6]N[6]C)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)	C[6](N[5,6]C[5,6a]C[5,6])(N[6]C[6,6a])(CC[6a]O){6|C<3>}	N[5,6](C[5,6]C[6,6a]C[6a]C[5])(C[5,6a]C[5,6a]C[6a])(C[6]N[6]C){1|H<1>,1|O<1>,6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C){1|C<4>,1|H<1>,3|C<3>}	122.7860	0.000	1	122.7860	0.000	1	122.7860	0.000	1	122.5595	0.103	2	123.4110	1.873	4	123.4110	1.873	4
762	542	914	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:2:3:	4:3:3:	3:3:	N[5,6]-3:N[6]-2:N-3:	C[5,6]-4:C[6]-3:N[5]-3:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(NCH)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]N)	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(NCH){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]N){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.3330	0.000	1	122.3330	0.000	1	122.3330	0.000	1	122.5595	0.103	2	123.4110	1.873	4	123.4110	1.873	4
762	542	914	6:SP2_SP2_SP2	C[6]	N[5,6]	N[6]	3:3:2:	3:3:4:	3:3:	N[5,6]-3:C[6a]-3:N[6]-2:	C[5,6]-3:C[6]-3:C[5]-4:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(N[6]C[6,6a])	N[5,6](C[5,6]C[6,6a]N[5])(C[6]C[6a]N[6])(C[5]C[5]HH)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(N[6]C[6,6a]){1|C<4>,1|N<2>,4|C<3>,4|H<1>}	N[5,6](C[5,6]C[6,6a]N[5])(C[6]C[6a]N[6])(C[5]C[5]HH){2|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a]){1|C<4>,1|H<1>,5|C<3>}	123.1190	0.000	1	123.1190	0.000	1	123.1190	0.000	1	123.1190	0.000	1	123.4110	1.873	4	123.4110	1.873	4
762	542	914	6:SP2_SP2_SP3	C[6]	N[5,6]	N[6]	3:2:3:	4:3:3:	3:3:	N[5,6]-3:N[6]-2:N-3:	C[5,6]-4:C[6]-3:N[5]-3:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(NCH)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]N)	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a])(NCH){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]N){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.5450	0.000	1	122.5450	0.000	1	122.5450	0.000	1	122.5450	0.000	1	122.6973	0.077	3	122.6973	0.077	3
762	542	914	6:SP2_SP2_SP3	C[6]	N[5,6]	N[6]	3:3:2:	4:4:3:	3:3:	N[5,6]-3:C[6a]-3:N[6]-2:	C[5,6]-4:S[5]-4:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[5,6]C[5,6]S[5])(C[6a]C[6a]2)(N[6]C[6,6a])	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]C[6a]N[6])	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])	C[6](N[5,6]C[5,6]S[5])(C[6a]C[6a]2)(N[6]C[6,6a]){2|O<1>,3|H<1>,6|C<3>}	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]C[6a]N[6]){6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a]){1|C<4>,1|H<1>,1|S<4>,4|C<3>}	122.7735	0.344	2	122.7735	0.119	2	122.7735	0.119	2	122.7735	0.119	2	122.6973	0.077	3	122.6973	0.077	3
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:2:3:	4:3:3:	3:3:1:	N[5,6]-3:N[6]-2:C-3:	C[5,6]-4:C[5,6a]-3:C[6]-3:	C[6]-3:C[6a]-3:O-1:	C[6](N[5,6]C[5,6a]C[5,6])(N[6]C[6,6a])(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[6a]C[5])(C[5,6a]C[5,6a]C[6a])(C[6]N[6]C)	C(C[6]N[5,6]N[6])(C[6a]C[6a]2)(O)	C[6](N[5,6]C[5,6a]C[5,6])(N[6]C[6,6a])(CC[6a]O){6|C<3>}	N[5,6](C[5,6]C[6,6a]C[6a]C[5])(C[5,6a]C[5,6a]C[6a])(C[6]N[6]C){1|H<1>,1|O<1>,6|C<3>}	C(C[6]N[5,6]N[6])(C[6a]C[6a]2)(O)	118.2460	0.000	1	118.2460	0.000	1	118.2460	0.000	1	118.2460	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:2:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:O[5]-2:C[6]-3:	C[6]-3:N-3:O-1:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO)	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C)	C(C[6]N[5,6]C[6])(NCH)(O)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO){1|In<6>,1|O<2>,2|C<3>}	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C){1|H<1>,2|C<3>,4|O<2>}	C(C[6]N[5,6]C[6])(NCH)(O)	122.9650	0.000	1	122.9650	0.000	1	122.9650	0.000	1	122.9650	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:3:2:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:C[6]-3:P[5]-2:	C[6]-3:N-2:H-1:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN)	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5])	C(C[6]N[5,6]C[6])(NC[6a])(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN){1|H<1>,1|N<3>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5]){2|C<3>,3|H<1>}	C(C[6]N[5,6]C[6])(NC[6a])(H)	111.9405	0.158	2	111.9405	0.025	2	111.9405	0.025	2	111.9405	0.025	2	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:3:3:	3:4:1:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[6]-3:C[5]-3:	C[6]-3:C-4:H-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C(C[6]C[6,6a]N[5,6])(CCHH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C(C[6]C[6,6a]N[5,6])(CCHH)(H)	120.8690	0.000	1	121.2705	0.322	2	121.2705	0.322	2	121.2705	0.322	2	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:3:3:	3:4:1:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[6]-3:C[5]-3:	C[6]-3:C-4:H-1:	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C(C[6]C[6,6a]N[5,6])(CCHH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O){2|C<3>,3|C<4>,3|H<1>}	C(C[6]C[6,6a]N[5,6])(CCHH)(H)	121.6720	0.000	1	121.2705	0.322	2	121.2705	0.322	2	121.2705	0.322	2	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:1:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:H-1:O-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]C[5]C)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(H)(O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO){6|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]C[5]C)(C[6]C[6]C){1|N<3>,1|O<1>,2|H<1>,3|C<3>}	C(C[6]N[5,6]C[6])(H)(O)	120.6380	0.000	1	120.6380	0.000	1	120.6380	0.000	1	120.6380	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C-2:H-1:	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CN)(H)	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH){1|C<4>,2|H<1>,5|C<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C){2|H<1>,4|C<3>}	C(C[6]N[5,6]C[6])(CN)(H)	124.1965	0.064	2	124.0430	0.073	3	124.0430	0.073	3	120.4702	23.983	5	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6,6a]-3:C[5]-4:C[6]-3:	C[6]-3:C-2:H-1:	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CN)(H)	C[6](N[5,6]C[5,6,6a]C[5])(C[6]C[6a]C[6])(CCH){2|C<4>,2|H<1>,4|C<3>}	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[5]C[5]HH)(C[6]C[6]C){2|H<1>,4|C<3>}	C(C[6]N[5,6]C[6])(CN)(H)	123.7360	0.000	1	124.0430	0.073	3	124.0430	0.073	3	120.4702	23.983	5	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:O-2:O-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5,6]C)(COO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]H)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(OC)(O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5,6]C)(COO){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]N[5]H)(C[6]C[6]C){1|H<1>,2|C<2>,2|C<4>,3|C<3>}	C(C[6]N[5,6]C[6])(OC)(O)	115.2680	0.000	1	115.2680	0.000	1	115.1110	0.049	2	120.4702	23.983	5	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:O-2:O-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(COO)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]N[5]H)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(OC)(O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(COO){1|C<4>,1|H<1>,1|N<3>,2|C<2>,2|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]N[5]H)(C[6]C[6]C){1|H<1>,2|C<4>,5|C<3>}	C(C[6]N[5,6]C[6])(OC)(O)	114.9540	0.000	1	114.9540	0.000	1	115.1110	0.049	2	120.4702	23.983	5	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	3:4:3:	3:4:2:	N[5,6]-3:C[6]-3:C-3:	C[5,6]-3:In[5]-4:C[6]-3:	C[6]-3:C-4:N-2:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN)	N[5,6](C[5,6]C[5]C[6])(In[5]N[5]ClS)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CH3)(NN)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN){1|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	N[5,6](C[5,6]C[5]C[6])(In[5]N[5]ClS)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C(C[6]N[5,6]C[6])(CH3)(NN)	116.5810	0.000	1	116.5810	0.000	1	116.5810	0.000	1	116.5810	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	6:3:3:	3:1:1:	N[5,6]-3:C[6]-3:C-3:	In[3x5]-6:C[5,6]-3:C[6]-3:	C[6]-3:O-1:O-1:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO)	N[5,6](In[3x5]N[5,6]2O[5]3)(C[5,6]C[5]C[6])(C[6]C[6]C)	C(C[6]N[5,6]C[6])(O)2	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	N[5,6](In[3x5]N[5,6]2O[5]3)(C[5,6]C[5]C[6])(C[6]C[6]C){1|O<1>,2|H<1>,7|C<3>}	C(C[6]N[5,6]C[6])(O)2	115.2117	0.785	3	115.2117	0.616	3	115.2117	0.616	3	115.2117	0.616	3	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:3:3:	6:3:3:	3:4:2:	N[5,6]-3:C[6]-3:C-3:	In[5,5]-6:C[5,6]-3:C[6]-3:	C[6]-3:C-4:N-2:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN)	N[5,6](In[5,5]N[5,5]S[5]Cl2S)(C[5,6]C[5]C[6])(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CH3)(NN)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	N[5,6](In[5,5]N[5,5]S[5]Cl2S)(C[5,6]C[5]C[6])(C[6]C[6]C){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C(C[6]N[5,6]C[6])(CH3)(NN)	116.3235	0.012	2	116.3235	0.000	2	116.3235	0.000	2	116.3235	0.000	2	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:4:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-4:C-3:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-3:C-3:H-1:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(COO)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C){1|C<4>,2|C<3>,3|H<1>}	C(C[6]N[5,6]C[6])(COO)(H)	120.8810	0.000	1	120.8810	0.000	1	120.8810	0.000	1	120.8810	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP2	C[6]	N[5,6]	C	3:4:3:	4:4:3:	3:3:4:	N[5,6]-3:C[6]-4:C-3:	C[4,5,6]-4:S[5]-4:C[6]-3:	C[6]-3:C-3:C-4:	C[6](N[5,6]C[4,5,6]S[5])(C[6]C[6]HH)(CCC)	N[5,6](C[4,5,6]C[4,6a]C[5,6a]C[4,6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CC[6a]O)(CH3)	C[6](N[5,6]C[4,5,6]S[5])(C[6]C[6]HH)(CCC){1|C<4>,1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[4,5,6]C[4,6a]C[5,6a]C[4,6])(S[5]C[5,6a]OO)(C[6]C[6]C){1|C<4>,3|H<1>,4|C<3>}	C(C[6]N[5,6]C[6])(CC[6a]O)(CH3)	119.7670	0.000	1	119.7670	0.000	1	119.7670	0.000	1	119.7670	0.000	1	118.3066	15.527	20	118.3066	15.527	20
762	542	930	0:SP2_SP2_SP3	C[6]	N[5,6]	C	3:3:3:	3:3:3:	3:2:1:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:O-2:O-1:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(OC)(O)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<2>,5|H<1>}	C(C[6]N[5,6]C[6])(OC)(O)	116.6450	0.000	1	116.6450	0.000	1	116.6450	0.000	1	116.6450	0.000	1	121.5440	11.655	4	121.5440	11.655	4
762	542	930	0:SP2_SP2_SP3	C[6]	N[5,6]	C	3:3:3:	3:3:3:	3:3:1:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6a]-3:H-1:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(CC[6a]H)	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(C[6a]C[6a]2)(H)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(CC[6a]H){1|O<1>,2|H<1>,3|C<4>}	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|O<1>,5|H<1>}	C(C[6]N[5,6]C[6])(C[6a]C[6a]2)(H)	124.2020	0.000	1	124.2020	0.000	1	124.2020	0.000	1	124.2020	0.000	1	121.5440	11.655	4	121.5440	11.655	4
762	542	930	0:SP2_SP2_SP3	C[6]	N[5,6]	C	3:4:3:	3:4:3:	3:3:1:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:C[5,6]-4:C[6]-3:	C[6]-3:C[6a]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]HH)(CC[6a]H)	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]N[5]H)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(C[6a]C[6a]2)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]HH)(CC[6a]H){1|H<1>,1|N<3>,4|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5a,6]N[5]H)(C[6]C[6]C){1|N<3>,1|S<4>,3|C<3>,3|H<1>}	C(C[6]N[5,6]C[6])(C[6a]C[6a]2)(H)	123.4980	0.000	1	123.4980	0.000	1	123.4980	0.000	1	123.4980	0.000	1	121.5440	11.655	4	121.5440	11.655	4
762	542	930	0:SP2_SP2_SP3	C[6]	N[5,6]	C	3:4:3:	3:4:3:	3:4:3:	N[5,6]-3:C[6]-4:C-3:	C[5,6]-3:S[5]-4:C[6]-3:	C[6]-3:C-4:C-3:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC)	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C(C[6]N[5,6]C[6])(CC[6a]HH)(CCO)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC){1|H<1>,2|O<1>,4|C<3>}	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C){1|C<4>,2|C<3>,3|H<1>}	C(C[6]N[5,6]C[6])(CC[6a]HH)(CCO)	121.8310	0.000	1	121.8310	0.000	1	121.8310	0.000	1	121.8310	0.000	1	121.5440	11.655	4	121.5440	11.655	4