542	727	955	5:SP2_SP2_SP3	N[5,5]	C[5,6a]	P[5,5]	3:3:4:	3:3:3:	3:3:3:1:	C[5,6a]-3:C[5,6a]-3:P[5,5]-4:	N[5,5]-3:C[5,6a]-3:C[6a]-3:	N[5,5]-3:N[5]-3:N[5]-3:Se-1:	N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2Se)	C[5,6a](N[5,5]C[5,6a]P[5,5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H)	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se)	N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2Se){2|C<4>,2|H<1>,4|C<3>}	C[5,6a](N[5,5]C[5,6a]P[5,5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H){1|Se<1>,1|C<4>,1|N<3>,2|H<1>,3|C<3>}	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se){4|C<3>}	110.0045	0.320	2	110.0045	0.103	2	110.0045	0.103	2	110.0045	0.103	2	110.0045	0.103	2	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5,6]	C[5,6,6a]	P[5]	3:4:4:	3:3:3:	3:4:2:1:	C[5,6,6a]-3:C[6]-4:P[5]-4:	C[5,6a]-3:C[6,6a]-3:N[5,6]-3:	N[5,6]-3:C[5]-4:O-2:O-1:	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[6]C[6]HH)(P[5]C[5]OO)	C[5,6,6a](C[5,6a]C[6a]C[5])(C[6,6a]C[6a]C[6])(N[5,6]C[6]P[5])	P[5](N[5,6]C[5,6,6a]C[6])(C[5]C[5,6a]CH)(OC)(O)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(C[6]C[6]HH)(P[5]C[5]OO){1|C<4>,3|C<3>,3|H<1>}	C[5,6,6a](C[5,6a]C[6a]C[5])(C[6,6a]C[6a]C[6])(N[5,6]C[6]P[5]){1|C<4>,1|O<1>,1|O<2>,2|C<3>,7|H<1>}	P[5](N[5,6]C[5,6,6a]C[6])(C[5]C[5,6a]CH)(OC)(O){1|C<4>,2|C<3>,2|H<1>}	113.0260	0.000	1	113.0260	0.000	1	113.0260	0.000	1	113.0260	0.000	1	113.0260	0.000	1	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5,5]	3:4:4:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5,5]-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:N[5]-3:N[5]-3:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]Se)(CH3)	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C)	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]Se)(CH3){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C){1|Se<1>,1|N<3>,2|C<3>,2|H<1>}	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se){4|C<3>}	111.4380	0.000	1	111.4380	0.000	1	111.4380	0.000	1	111.4380	0.000	1	111.9587	0.328	3	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5,5]	3:4:4:	3:3:3:	3:3:3:2:	C[5,6a]-3:P[5,5]-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:N[5]-3:N[5]-3:N-2:	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]N)(CH3)	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C)	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(NC[6a])	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]N)(CH3){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(NC[6a]){4|C<3>}	112.2190	0.499	2	112.2190	0.249	2	112.2190	0.249	2	112.2190	0.249	2	111.9587	0.328	3	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5,6]	3:4:1:	3:3:3:	3:3:2:2:	C[5,6a]-3:P[5,6]-4:H-1:	C[6a,6a]-3:C[5,6a]-3:N[5]-3:	N[5]-3:N[5]-3:N[6]-2:N[6]-2:	N[5](C[5,6a]C[6a,6a]C[5,6a])(P[5,6]N[5]N[6]2)(H)	C[5,6a](C[6a,6a]C[6a,6a]C[6a])(C[5,6a]C[6a,6a]N[5])(N[5]P[5,6]H)	P[5,6](N[5]C[5,6a]H)2(N[6]P[6])2	N[5](C[5,6a]C[6a,6a]C[5,6a])(P[5,6]N[5]N[6]2)(H){1|H<1>,2|P<4>,3|C<3>}	C[5,6a](C[6a,6a]C[6a,6a]C[6a])(C[5,6a]C[6a,6a]N[5])(N[5]P[5,6]H){2|H<1>,2|N<2>,4|C<3>}	P[5,6](N[5]C[5,6a]H)2(N[6]P[6])2{4|Cl<1>,1|N<2>,2|C<3>}	113.1550	0.000	1	113.1550	0.000	1	113.1550	0.000	1	113.1550	0.000	1	113.1550	0.000	1	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:1:	3:3:3:	3:3:1:1:	C[5,6a]-3:P[5]-4:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:S-1:S-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]SS)(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a,6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]H)2(S)2	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]SS)(H){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a,6a]H)(N[5]P[5]H){2|C<3>,2|H<1>,2|S<1>}	P[5](N[5]C[5,6a]H)2(S)2{2|C<3>}	114.8450	0.000	1	114.8450	0.000	1	114.8450	0.000	1	114.8450	0.000	1	113.8839	4.068	7	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:1:	3:3:3:	3:3:2:1:	C[5,6a]-3:P[5]-4:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C[6a]-3:S[5]-2:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]S[5]Se)(H)	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]H)(C[6a]C[6a]2)(S[5]C[5,6a])(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]S[5]Se)(H){1|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]P[5]H){1|Se<1>,2|C<3>,2|H<1>}	P[5](N[5]C[5,6a]H)(C[6a]C[6a]2)(S[5]C[5,6a])(Se){2|H<1>,4|C<3>}	117.9350	0.000	1	117.9350	0.000	1	117.9350	0.000	1	117.9350	0.000	1	113.8839	4.068	7	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:1:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5]-4:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:N-3:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]NO)(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]H)2(NC[6a]H)(O)	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]NO)(H){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H){1|C<3>,1|N<3>,1|O<1>,3|H<1>}	P[5](N[5]C[5,6a]H)2(NC[6a]H)(O){2|C<3>}	112.4815	0.019	2	112.4815	0.000	2	112.4815	0.000	2	112.4815	0.000	2	113.8839	4.068	7	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:3:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5]-4:C[6a]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5]-3:N[5]-3:C[6a]-3:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[6a]N[5])(N[5]C[6a]P[5])(C[6a]C[6a]H)	P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]H)(C[6a]C[6a]2)(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(C[6a]C[6a]2){4|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5]C[6a]P[5])(C[6a]C[6a]H){1|Se<1>,3|H<1>,4|C<3>}	P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]H)(C[6a]C[6a]2)(Se){2|H<1>,6|C<3>}	112.1510	0.000	1	112.1510	0.000	1	112.1510	0.000	1	112.1510	0.000	1	113.8839	4.068	7	112.8038	3.948	14
542	727	955	5:SP2_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:4:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5]-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:C[6a]-3:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(CC[6a]HH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]C)	P[5](N[5]C[5,6a]C)2(C[6a]C[6a]2)(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(CC[6a]HH){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]C){1|Se<1>,1|C<4>,2|C<3>,2|H<1>}	P[5](N[5]C[5,6a]C)2(C[6a]C[6a]2)(Se){2|H<1>,4|C<3>}	113.6465	0.146	2	113.6465	0.021	2	113.6465	0.021	2	113.6465	0.021	2	113.8839	4.068	7	112.8038	3.948	14
542	727	955	5:SP3_SP2_SP3	N[5,5]	C[5,6a]	P[5,5]	3:3:4:	3:3:3:	3:3:3:2:	C[5,6a]-3:C[5,6a]-3:P[5,5]-4:	N[5,5]-3:C[5,6a]-3:C[6a]-3:	N[5,5]-3:N[5]-3:N[5]-3:N-2:	N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2N)	C[5,6a](N[5,5]C[5,6a]P[5,5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H)	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(NC[6a])	N[5,5](C[5,6a]C[5,6a]C[6a])2(P[5,5]N[5]2N){2|C<4>,2|H<1>,4|C<3>}	C[5,6a](N[5,5]C[5,6a]P[5,5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,1|N<2>,1|N<3>,2|H<1>,3|C<3>}	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(NC[6a]){4|C<3>}	110.6325	0.124	2	110.6325	0.015	2	110.6325	0.015	2	110.6325	0.015	2	110.6325	0.015	2	111.7228	2.884	5
542	727	955	5:SP3_SP2_SP3	N[5]	C[5,6a]	P[5,5]	3:4:4:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5,5]-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:N[5]-3:N[5]-3:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]Se)(CH3)	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C)	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5,5]N[5,5]N[5]Se)(CH3){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]N[5,5]C[6a])(C[6a]C[6a]H)(N[5]P[5,5]C){1|Se<1>,1|N<3>,2|C<3>,2|H<1>}	P[5,5](N[5,5]C[5,6a]2)(N[5]C[5,6a]C)2(Se){4|C<3>}	110.2630	0.000	1	110.2630	0.000	1	110.2630	0.000	1	110.2630	0.000	1	110.2630	0.000	1	111.7228	2.884	5
542	727	955	5:SP3_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:1:	3:3:3:	3:3:1:1:	C[5,6a]-3:P[5]-4:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:S-1:S-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]SS)(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a,6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]H)2(S)2	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5]SS)(H){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a,6a]H)(N[5]P[5]H){2|C<3>,2|H<1>,2|S<1>}	P[5](N[5]C[5,6a]H)2(S)2{2|C<3>}	113.9820	0.000	1	113.9820	0.000	1	113.9820	0.000	1	113.9820	0.000	1	113.5430	0.385	2	111.7228	2.884	5
542	727	955	5:SP3_SP2_SP3	N[5]	C[5,6a]	P[5]	3:4:1:	3:3:3:	3:3:3:1:	C[5,6a]-3:P[5]-4:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:C[6a]-3:Se-1:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]H)(C[6a]C[6a]2)(Se)	N[5](C[5,6a]C[5,6a]C[6a])(P[5]C[6a]N[5]Se)(H){1|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H){1|Se<1>,2|H<1>,3|C<3>}	P[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]H)(C[6a]C[6a]2)(Se){2|H<1>,6|C<3>}	113.1040	0.000	1	113.1040	0.000	1	113.1040	0.000	1	113.1040	0.000	1	113.5430	0.385	2	111.7228	2.884	5
542	727	956	0:SP2_SP2_SP2	N[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:1:1:	C[5,6a]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:O-1:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(NOO)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N)	N(N[5]C[5,6a]C[5])(O)2	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(NOO){2|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N){1|C<3>,6|H<1>}	N(N[5]C[5,6a]C[5])(O)2	126.1893	0.334	3	126.1893	0.111	3	126.1893	0.111	3	126.1893	0.111	3	121.8158	23.009	6	121.8158	23.009	6
542	727	956	0:SP2_SP2_SP2	N[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:3:1:	C[5,6a]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]CH)(NCH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N)	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]CH)(NCH){2|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N){1|C<3>,1|C<4>,5|H<1>}	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	117.3900	0.198	2	117.3900	0.039	2	117.4423	0.028	3	117.4423	0.028	3	121.8158	23.009	6	121.8158	23.009	6
542	727	956	0:SP2_SP2_SP2	N[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:3:1:	C[5,6a]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5]H)(NCH)	C[5,6a](C[5,6a]C[6a,6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N)	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5]H)(NCH){2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a,6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N){3|H<1>,4|C<3>}	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	117.5470	0.000	1	117.5470	0.000	1	117.4423	0.028	3	117.4423	0.028	3	121.8158	23.009	6	121.8158	23.009	6
542	727	956	0:SP2_SP2_SP3	N[5]	C[5,5a]	N	3:3:3:	3:2:3:	3:1:1:	C[5,5a]-3:C[5]-3:N-3:	N[5,5a]-3:N[5a]-2:N[5]-3:	N[5]-3:H-1:H-1:	N[5](C[5,5a]N[5,5a]N[5a])(C[5]N[5]H)(NHH)	C[5,5a](N[5,5a]C[5a]N[5])(N[5a]N[5a])(N[5]C[5]N)	N(N[5]C[5,5a]C[5])(H)2	N[5](C[5,5a]N[5,5a]N[5a])(C[5]N[5]H)(NHH){1|C<3>,1|N<3>}	C[5,5a](N[5,5a]C[5a]N[5])(N[5a]N[5a])(N[5]C[5]N){1|N<3>,2|H<1>}	N(N[5]C[5,5a]C[5])(H)2	129.8165	1.660	2	129.8165	2.754	2	130.3020	1.219	5	130.3020	1.219	5	130.3020	1.219	5	130.3020	1.219	5
542	727	956	0:SP2_SP2_SP3	N[5]	C[5,5a]	N	3:3:3:	3:2:3:	3:1:1:	C[5,5a]-3:C[5]-3:N-3:	N[5,5a]-3:N[5a]-2:N[5]-3:	N[5]-3:H-1:H-1:	N[5](C[5,5a]N[5,5a]N[5a])(C[5]N[5]N)(NHH)	C[5,5a](N[5,5a]C[5a]N[5])(N[5a]N[5a])(N[5]C[5]N)	N(N[5]C[5,5a]C[5])(H)2	N[5](C[5,5a]N[5,5a]N[5a])(C[5]N[5]N)(NHH){1|C<3>,1|N<3>}	C[5,5a](N[5,5a]C[5a]N[5])(N[5a]N[5a])(N[5]C[5]N){1|H<1>,2|N<3>}	N(N[5]C[5,5a]C[5])(H)2	130.6257	0.817	3	130.6257	0.668	3	130.3020	1.219	5	130.3020	1.219	5	130.3020	1.219	5	130.3020	1.219	5
542	727	956	0:SP3_SP2_SP2	N[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:3:1:	C[5,6a]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]CH)(NCH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N)	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]CH)(NCH){2|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N){1|C<3>,1|C<4>,5|H<1>}	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	115.0960	0.178	3	115.0960	0.032	3	115.6524	5.090	5	115.6524	5.090	5	115.6524	5.090	5	115.6524	5.090	5
542	727	956	0:SP3_SP2_SP2	N[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:3:1:	C[5,6a]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5]H)(NCH)	C[5,6a](C[5,6a]C[6a,6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N)	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5]H)(NCH){2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a,6a]C[5])(C[6a]C[6a]H)(N[5]C[5]N){3|H<1>,4|C<3>}	N(N[5]C[5,6a]C[5])(CC[6a]O)(H)	116.4870	4.240	2	116.4870	17.976	2	115.6524	5.090	5	115.6524	5.090	5	115.6524	5.090	5	115.6524	5.090	5
542	727	959	0:SP2_SP2_SP3	N[5]	C[5a]	S[5]	4:3:4:	3:3:2:	3:4:1:1:	C[5,5,6]-4:C[5a]-3:S[5]-4:	N[5]-3:C[5a]-3:N[5a]-2:	N[5]-3:C[5]-4:O-1:O-1:	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(C[5a]C[5a]N[5a])(S[5]C[5]OO)	C[5a](N[5]C[5,5,6]S[5])(C[5a]C[5a]H)(N[5a]N[5a])	S[5](N[5]C[5,5,6]C[5a])(C[5]C[3x5,6]HH)(O)2	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(C[5a]C[5a]N[5a])(S[5]C[5]OO){1|C<3>,1|N<3>,3|C<4>,5|H<1>}	C[5a](N[5]C[5,5,6]S[5])(C[5a]C[5a]H)(N[5a]N[5a]){2|H<1>,2|O<1>,4|C<4>}	S[5](N[5]C[5,5,6]C[5a])(C[5]C[3x5,6]HH)(O)2{1|C<3>,1|H<1>,1|N<2>,3|C<4>}	116.8550	0.000	1	116.8550	0.000	1	116.8550	0.000	1	116.8550	0.000	1	116.8550	0.000	1	116.8550	0.000	1
542	727	959	0:SP3_SP2_SP3	N[5,5]	C[5,6a]	S[5]	3:4:4:	3:3:3:	3:3:1:1:	C[5,6a]-3:C[5,5]-4:S[5]-4:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	C[5,6a]-3:N[5,5]-3:O-1:O-1:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]C[5]C)(S[5]C[5,6a]OO)	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]S[5])(C[6a]C[6a]H)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(O)2	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5,6a]C[5]C)(S[5]C[5,6a]OO){3|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]S[5])(C[6a]C[6a]H){2|O<1>,4|C<3>,4|H<1>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(O)2{1|C<4>,1|H<1>,5|C<3>}	120.8360	0.000	1	120.8360	0.000	1	120.8360	0.000	1	120.8360	0.000	1	120.8360	0.000	1	118.8300	8.048	2
542	727	959	0:SP3_SP2_SP3	N[5]	C[5a]	S[5]	4:3:4:	3:3:2:	3:4:1:1:	C[5,5,6]-4:C[5a]-3:S[5]-4:	N[5]-3:C[5a]-3:N[5a]-2:	N[5]-3:C[5]-4:O-1:O-1:	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(C[5a]C[5a]N[5a])(S[5]C[5]OO)	C[5a](N[5]C[5,5,6]S[5])(C[5a]C[5a]H)(N[5a]N[5a])	S[5](N[5]C[5,5,6]C[5a])(C[5]C[3x5,6]HH)(O)2	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(C[5a]C[5a]N[5a])(S[5]C[5]OO){1|C<3>,1|N<3>,3|C<4>,5|H<1>}	C[5a](N[5]C[5,5,6]S[5])(C[5a]C[5a]H)(N[5a]N[5a]){2|H<1>,2|O<1>,4|C<4>}	S[5](N[5]C[5,5,6]C[5a])(C[5]C[3x5,6]HH)(O)2{1|C<3>,1|H<1>,1|N<2>,3|C<4>}	116.8240	0.000	1	116.8240	0.000	1	116.8240	0.000	1	116.8240	0.000	1	116.8240	0.000	1	118.8300	8.048	2
542	727	959	5:SP2_SP2_SP3	N[5]	C[5,6a]	S[5]	3:4:1:	3:3:3:	3:2:1:1:	C[5,6a]-3:S[5]-4:H-1:	C[5,6a]-3:C[6,6a]-3:N[5]-3:	N[5]-3:N[5]-2:O-1:O-1:	N[5](C[5,6a]C[5,6a]C[6,6a])(S[5]N[5]OO)(H)	C[5,6a](C[5,6a]C[6a,6a]N[5])(C[6,6a]C[6,6a]C[6])(N[5]S[5]H)	S[5](N[5]C[5,6a]H)(N[5]C[5,6a])(O)2	N[5](C[5,6a]C[5,6a]C[6,6a])(S[5]N[5]OO)(H){3|C<3>}	C[5,6a](C[5,6a]C[6a,6a]N[5])(C[6,6a]C[6,6a]C[6])(N[5]S[5]H){1|H<1>,1|N<3>,2|O<1>,3|C<3>}	S[5](N[5]C[5,6a]H)(N[5]C[5,6a])(O)2{2|C<3>}	109.4590	0.000	1	109.4590	0.000	1	109.4590	0.000	1	109.3080	0.046	2	109.3080	0.046	2	109.3080	0.046	2
542	727	959	5:SP2_SP2_SP3	N[5]	C[5,6a]	S[5]	3:4:1:	3:3:3:	3:2:1:1:	C[5,6a]-3:S[5]-4:H-1:	C[6a,6a]-3:C[5,6a]-3:N[5]-3:	N[5]-3:N[5]-2:O-1:O-1:	N[5](C[5,6a]C[6a,6a]C[5,6a])(S[5]N[5]OO)(H)	C[5,6a](C[6a,6a]C[6a,6a]C[6a])(C[5,6a]C[6,6a]N[5])(N[5]S[5]H)	S[5](N[5]C[5,6a]H)(N[5]C[5,6a])(O)2	N[5](C[5,6a]C[6a,6a]C[5,6a])(S[5]N[5]OO)(H){3|C<3>}	C[5,6a](C[6a,6a]C[6a,6a]C[6a])(C[5,6a]C[6,6a]N[5])(N[5]S[5]H){1|H<1>,1|N<2>,2|O<1>,3|C<3>}	S[5](N[5]C[5,6a]H)(N[5]C[5,6a])(O)2{2|C<3>}	109.1570	0.000	1	109.1570	0.000	1	109.1570	0.000	1	109.3080	0.046	2	109.3080	0.046	2	109.3080	0.046	2
542	727	959	5:SP3_SP2_SP3	N[5]	C[5,6a]	S[5]	3:4:4:	3:3:3:	4:3:1:1:	C[5,6a]-3:S[5]-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5,5]-4:N[5]-3:O-1:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(S[5]C[5,5]OO)(CH3)	C[5,6a](C[5,6a]C[5,5]C[6a])(C[6a]C[6a]H)(N[5]S[5]C)	S[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5,6a]C)(O)2	N[5](C[5,6a]C[5,6a]C[6a])(S[5]C[5,5]OO)(CH3){1|H<1>,2|C<3>,2|C<4>}	C[5,6a](C[5,6a]C[5,5]C[6a])(C[6a]C[6a]H)(N[5]S[5]C){1|C<3>,2|C<4>,2|H<1>,2|O<1>}	S[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5,6a]C)(O)2{1|C<4>,1|N<3>,2|H<1>,4|C<3>}	107.5660	0.000	1	107.5660	0.000	1	107.5660	0.000	1	107.5660	0.000	1	107.5660	0.000	1	107.5660	0.000	1
542	727	960	0:SP2_SP2_SP2	N[5,5]	C[5,6a]	N[5]	3:3:2:	3:3:3:	3:3:	C[5,6a]-3:C[5,5]-3:N[5]-2:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	N[5,5]-3:C[5]-3:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5]2)(N[5]C[5])	C[5,6a](C[5,6a]C[6a]N[5])(N[5,5]C[5,5]N[5])(C[6a]C[6a]H)	N[5](N[5,5]C[5,6a]C[5,5])(C[5]N[5]H)	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5]2)(N[5]C[5]){1|Cu<5>,1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5,5]C[5,5]N[5])(C[6a]C[6a]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](N[5,5]C[5,6a]C[5,5])(C[5]N[5]H){1|Cu<5>,1|N<3>,2|C<3>}	139.0580	0.000	1	139.0580	0.000	1	139.0580	0.000	1	139.0580	0.000	1	129.7075	174.864	2	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5,5]	C[5,6a]	N[5]	6:3:2:	3:3:3:	3:3:	In[5,5]-6:C[5,6a]-3:N[5]-2:	N[5,5]-3:C[5,6a]-3:C[6a]-3:	N[5,5]-3:C[5,6]-3:	N[5,5](In[5,5]N[5,6]N[5]Cl3)(C[5,6a]C[5,6a]C[6a])(N[5]C[5,6])	C[5,6a](N[5,5]In[5,5]N[5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H)	N[5](N[5,5]C[5,6a]In[5,5])(C[5,6]N[5,6]C[6])	N[5,5](In[5,5]N[5,6]N[5]Cl3)(C[5,6a]C[5,6a]C[6a])(N[5]C[5,6]){1|H<1>,5|C<3>}	C[5,6a](N[5,5]In[5,5]N[5])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H){3|Cl<1>,1|N<3>,2|H<1>,3|C<3>}	N[5](N[5,5]C[5,6a]In[5,5])(C[5,6]N[5,6]C[6]){3|Cl<1>,1|H<1>,1|N<3>,4|C<3>}	120.3570	0.000	1	120.3570	0.000	1	120.3570	0.000	1	120.3570	0.000	1	129.7075	174.864	2	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:3:2:	3:2:2:	3:3:	C[5a]-3:C[5]-3:N[5]-2:	N[5]-3:N[5a]-2:N[5a]-2:	N[5]-3:C[5]-3:	N[5](C[5a]N[5a]2)(C[5]N[5]N)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]N[5a])2	N[5](N[5]C[5a]C[5])(C[5]N[5]N)	N[5](C[5a]N[5a]2)(C[5]N[5]N)(N[5]C[5]){1|N<2>,3|N<3>}	C[5a](N[5]C[5]N[5])(N[5a]N[5a])2{1|C<3>,1|H<1>,2|N<3>}	N[5](N[5]C[5a]C[5])(C[5]N[5]N){2|N<2>,2|N<3>}	119.6790	0.000	1	119.6790	0.000	1	119.6790	0.000	1	119.6790	0.000	1	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:3:2:	3:3:2:	3:2:	C[5a]-3:C[5]-3:N[5]-2:	N[5]-3:C[5a]-3:N[5a]-2:	N[5]-3:O[5]-2:	N[5](C[5a]C[5a]N[5a])(C[5]C[6a]N[5])(N[5]O[5])	C[5a](N[5]C[5]N[5])(C[5a]N[5a]H)(N[5a]N[5a])	N[5](N[5]C[5a]C[5])(O[5]N[5])	N[5](C[5a]C[5a]N[5a])(C[5]C[6a]N[5])(N[5]O[5]){1|H<1>,1|N<2>,1|N<3>,1|O<1>,2|C<3>}	C[5a](N[5]C[5]N[5])(C[5a]N[5a]H)(N[5a]N[5a]){1|C<3>,1|C<4>,1|N<3>,1|O<2>}	N[5](N[5]C[5a]C[5])(O[5]N[5]){1|N<2>,1|O<1>,2|C<3>}	118.6160	0.000	1	118.6160	0.000	1	118.6160	0.000	1	118.6160	0.000	1	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:3:2:	3:3:3:	3:3:	C[5a]-3:C[5]-3:N[5]-2:	C[5a]-3:C[5a]-3:N[5]-3:	N[5]-3:C[5]-3:	N[5](C[5a]C[5a]2)(C[5]N[5]Se)(N[5]C[5])	C[5a](C[5a]C[5a]C[6a])(C[5a]C[6a]N[5a])(N[5]C[5]N[5])	N[5](N[5]C[5a]C[5])(C[5]N[5]H)	N[5](C[5a]C[5a]2)(C[5]N[5]Se)(N[5]C[5]){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[5a](C[5a]C[5a]C[6a])(C[5a]C[6a]N[5a])(N[5]C[5]N[5]){1|Se<1>,1|N<3>,2|H<1>,5|C<3>}	N[5](N[5]C[5a]C[5])(C[5]N[5]H){1|Se<1>,1|C<4>,2|C<3>}	119.9610	0.000	1	119.9610	0.000	1	119.9610	0.000	1	119.9610	0.000	1	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	2:2:3:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5a]-2:S[5a]-2:N[5]-3:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[5]HH)(N[5]C[5])	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[5]HH)(N[5]C[5]){2|H<1>,3|C<3>}	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(N[5]C[5]N[5]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,2|C<3>,4|H<1>}	120.4610	0.000	1	120.4610	0.000	1	120.2745	0.070	2	120.2745	0.070	2	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	2:2:3:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5a]-2:S[5a]-2:N[5]-3:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(N[5]C[5]N[5]){1|C<4>,1|H<1>,4|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	120.0880	0.000	1	120.0880	0.000	1	120.2745	0.070	2	120.2745	0.070	2	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[5a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[5a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	119.5620	0.133	3	119.5620	0.018	3	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5,5a])(S[5a]C[5,5a])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5,5a])(S[5a]C[5,5a]){1|H<1>,2|C<4>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	119.3020	0.000	1	119.3020	0.000	1	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[5a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5]C[5a]C[5])(N[5]C[5a]C[5]){1|S<2>,2|C<3>,2|N<2>,3|H<1>}	118.0340	1.789	2	118.5277	2.331	3	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[5a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	N[5](C[5]C[5a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|O<2>,1|S<2>,2|C<3>,3|H<1>}	119.5150	0.000	1	118.5277	2.331	3	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	118.3654	1.742	10	118.6113	3.397	11	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|H<1>,2|C<4>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	121.0700	0.000	1	118.6113	3.397	11	118.7942	2.428	18	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP2_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	N[5]-3:C[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](N[5]C[5a]C[5])(C[5]C[5]2)	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){1|C<4>,2|H<1>,4|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|C<4>,2|H<1>,3|C<3>}	N[5](N[5]C[5a]C[5])(C[5]C[5]2){1|Fe<10>,1|C<3>,1|N<2>,1|S<2>,2|C<4>,3|H<1>}	119.2370	0.000	1	119.2370	0.000	1	119.2370	0.000	1	118.8175	2.304	19	119.0140	2.041	24	119.8366	17.317	26
542	727	960	0:SP3_SP2_SP2	N[5]	C[5a]	N[5]	3:4:2:	3:2:2:	3:3:	C[5a]-3:C[5]-4:N[5]-2:	N[5]-3:N[5a]-2:S[5a]-2:	C[5]-3:N[5]-3:	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5])	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a])	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5])	N[5](C[5a]N[5a]S[5a])(C[5]C[6a]C[5]H)(N[5]C[5]){2|H<1>,5|C<3>}	C[5a](N[5]C[5]N[5])(N[5a]C[5a])(S[5a]C[5a]){1|C<4>,2|H<1>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5a]C[5]){1|N<2>,1|S<2>,3|C<3>,3|H<1>}	115.1350	0.000	1	115.1350	0.000	1	115.1350	0.000	1	115.1350	0.000	1	115.1350	0.000	1	115.1350	0.000	1
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|C<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|C<3>,1|C<4>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]H){2|C<3>}	112.8240	0.000	1	112.8240	0.000	1	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|Co<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|Co<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]H){2|C<3>}	112.0998	0.699	4	112.0184	0.400	5	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|Co<6>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|Co<6>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]H){2|C<3>}	111.6930	0.000	1	112.0184	0.400	5	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]H)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|H<1>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|C<3>,1|O<2>,2|H<1>}	N[5](N[5]C[5,6a]H)(N[5]C[5,6a]O){2|C<3>}	112.4650	0.000	1	112.4650	0.000	1	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]H)2	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|C<3>,3|H<1>}	N[5](N[5]C[5,6a]H)2{2|C<3>}	112.4808	0.644	33	112.4808	0.415	33	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]Ni)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|Ni<6>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|Ni<6>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Ni)(N[5]C[5,6a]H){2|C<3>}	111.1997	0.114	3	111.1997	0.013	3	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H)	N[5](N[5]C[5,6a]Zn)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(H){1|Zn<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]H){1|Zn<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Zn)(N[5]C[5,6a]H){2|C<3>}	112.0865	0.444	4	112.0865	0.197	4	112.3233	0.458	47	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(O){1|C<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O){1|C<3>,1|C<4>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O){2|C<3>}	112.1783	0.350	3	112.3275	0.098	8	112.3275	0.098	8	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(O){1|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O){2|C<3>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O){2|C<3>}	112.4170	0.290	5	112.3275	0.098	8	112.3275	0.098	8	112.3239	0.403	55	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:2:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:O-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(OFe)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O)	N[5](N[5]C[5,6a]H)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(OFe){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]O){1|C<3>,3|H<1>}	N[5](N[5]C[5,6a]H)(N[5]C[5,6a]O){2|C<3>}	113.0210	0.000	1	113.0210	0.000	1	113.0210	0.000	1	113.0210	0.000	1	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:3:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCO)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCO){1|H<1>,1|O<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,1|O<1>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O){2|C<3>}	111.2495	0.274	4	111.2495	0.075	4	111.3528	0.110	5	111.3528	0.110	5	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:3:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CN[6]N)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CN[6]N){1|H<1>,1|O<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,1|O<1>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O){2|C<3>}	111.7660	0.000	1	111.7660	0.000	1	111.3528	0.110	5	111.3528	0.110	5	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(BH3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]B)	N[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(BH3){1|C<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]B){1|C<3>,1|C<4>,2|H<1>}	N[5](N[5]C[5,6a]B)(N[5]C[5,6a]C){2|C<3>}	109.9440	0.000	1	109.9440	0.000	1	109.9440	0.000	1	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)2	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH){1|C<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,1|C<4>,2|H<1>}	N[5](N[5]C[5,6a]C)2{2|C<3>}	111.9373	0.133	3	111.9373	0.018	3	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH){1|Co<6>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|Co<6>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Co)(N[5]C[5,6a]C){2|C<3>}	111.0090	0.000	1	111.0090	0.000	1	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]Cu)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH){1|Cu<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|Cu<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Cu)(N[5]C[5,6a]C){2|C<3>}	110.5475	0.112	2	110.5475	0.013	2	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]Ni)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH){1|Ni<6>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|Ni<6>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Ni)(N[5]C[5,6a]C){2|C<3>}	110.9980	0.000	1	110.9980	0.000	1	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]Zn)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CCHH){1|Zn<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|Zn<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Zn)(N[5]C[5,6a]C){2|C<3>}	111.4985	0.185	4	111.4985	0.034	4	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CH3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CH3){1|B<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|B<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]B)(N[5]C[5,6a]C){2|C<3>}	111.5060	0.000	1	111.5060	0.000	1	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CH3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)2	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CH3){1|C<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,1|C<4>,2|H<1>}	N[5](N[5]C[5,6a]C)2{2|C<3>}	112.3687	0.960	9	112.3687	0.921	9	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CHHO)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CHHO){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,3|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]H){2|C<3>}	111.8250	0.000	1	111.8250	0.000	1	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:N[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CHHO)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]Cu)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(CHHO){1|Cu<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|Cu<4>,1|C<3>,2|H<1>}	N[5](N[5]C[5,6a]Cu)(N[5]C[5,6a]C){2|C<3>}	111.1450	0.000	1	111.1450	0.000	1	111.7697	0.716	23	111.6936	0.824	24	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:3:2:	3:3:3:	3:3:	C[5,6a]-3:C[6a]-3:N[5]-2:	N[5,6a]-3:N[5]-3:C[6a]-3:	N[5]-3:C[5]-3:	N[5](C[5,6a]N[5,6a]C[6a])(C[6a]C[6a]N[6a])(N[5]C[5])	C[5,6a](N[5,6a]C[6a]C[5])(N[5]C[6a]N[5])(C[6a]C[6a]H)	N[5](N[5]C[5,6a]C[6a])(C[5]N[5,6a]N)	N[5](C[5,6a]N[5,6a]C[6a])(C[6a]C[6a]N[6a])(N[5]C[5]){1|N<3>,2|H<1>,4|C<3>}	C[5,6a](N[5,6a]C[6a]C[5])(N[5]C[6a]N[5])(C[6a]C[6a]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	N[5](N[5]C[5,6a]C[6a])(C[5]N[5,6a]N){1|N<2>,3|C<3>}	111.9300	0.000	1	111.9300	0.000	1	111.9300	0.000	1	111.9300	0.000	1	112.0810	0.592	89	112.0810	0.592	89
542	727	960	5:SP2_SP2_SP2	N[5]	C[5,6a]	N[5]	3:4:2:	3:3:3:	3:3:	C[5,6a]-3:C-4:N[5]-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(CC[6a]HH)(N[5]N[5])	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C)	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O)	N[5](C[5,6a]C[5,6a]C[6a])(CC[6a]HH)(N[5]N[5]){1|H<1>,1|O<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]C){1|C<3>,1|O<1>,2|H<1>}	N[5](N[5]C[5,6a]C)(N[5]C[5,6a]O){2|C<3>}	111.6767	0.170	3	111.6767	0.029	3	111.6767	0.029	3	111.6767	0.029	3	112.0810	0.592	89	112.0810	0.592	89
542	727	961	0:SP2_SP2_SP3	N[5,6]	C[5,6a]	S[6]	3:3:4:	3:3:3:	3:3:1:1:	C[5,6a]-3:C[5,6]-3:S[6]-4:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[6,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5]N[6])(S[6]C[6,6a]OO)	C[5,6a](C[5,6a]C[6a]N[5])(N[5,6]C[5,6]S[6])(C[6a]C[6a,6a]H)	S[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)2	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5]N[6])(S[6]C[6,6a]OO){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5,6]C[5,6]S[6])(C[6a]C[6a,6a]H){1|C<4>,1|H<1>,1|N<2>,2|O<1>,3|C<3>}	S[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)2{1|H<1>,1|N<2>,1|N<3>,4|C<3>}	124.1990	0.000	1	124.1990	0.000	1	124.7285	0.561	2	124.7285	0.561	2	124.7285	0.561	2	124.7285	0.561	2
542	727	961	0:SP2_SP2_SP3	N[5,6]	C[5,6a]	S[6]	3:3:4:	3:3:3:	3:3:1:1:	C[5,6a]-3:C[5,6]-3:S[6]-4:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[6,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5]N[6])(S[6]C[6,6a]OO)	C[5,6a](C[5,6a]C[6a]N[5])(N[5,6]C[5,6]S[6])(C[6a]C[6a]H)	S[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)2	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[5]N[6])(S[6]C[6,6a]OO){1|C<4>,1|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5,6]C[5,6]S[6])(C[6a]C[6a]H){1|C<4>,1|H<1>,1|N<2>,2|O<1>,3|C<3>}	S[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)2{1|Cl<1>,1|N<2>,1|N<3>,4|C<3>}	125.2580	0.000	1	125.2580	0.000	1	124.7285	0.561	2	124.7285	0.561	2	124.7285	0.561	2	124.7285	0.561	2
542	727	964	5:SP2_SP2_SPD6	N[5,6]	C[5,6,6a]	Si[4,5,5]	3:6:3:	3:3:3:	3:2:2:2:3:3:	C[5,6,6a]-3:Si[4,5,5]-6:C[6]-3:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:N[4]-3:N[4]-3:	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[5,6,6a](N[5,6]Si[4,5,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	Si[4,5,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])3(N[4]C[4]C)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[5,6,6a](N[5,6]Si[4,5,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|C<3>,2|N<3>,2|O<2>,4|H<1>}	Si[4,5,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])3(N[4]C[4]C)2{1|H<1>,6|C<3>}	109.8520	0.000	1	109.8520	0.000	1	109.8520	0.000	1	109.8520	0.000	1	109.8520	0.000	1	109.3140	0.156	6
542	727	964	5:SP2_SP2_SPD6	N[5,6]	C[5,6,6a]	Si[4,5]	3:6:3:	3:3:3:	3:2:3:3:1:1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:Br-1:Br-1:	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Br)2	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|Br<1>,2|C<3>,2|N<3>,4|H<1>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Br)2{1|H<1>,4|C<3>}	109.5100	0.000	1	109.5100	0.000	1	109.5100	0.000	1	109.2500	0.135	2	109.2064	0.108	5	109.3140	0.156	6
542	727	964	5:SP2_SP2_SPD6	N[5,6]	C[5,6,6a]	Si[4,5]	3:6:3:	3:3:3:	3:2:3:3:1:1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:Cl-1:Cl-1:	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Cl)2	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|Cl<1>,2|C<3>,2|N<3>,4|H<1>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Cl)2{1|H<1>,4|C<3>}	108.9900	0.000	1	108.9900	0.000	1	108.9900	0.000	1	109.2500	0.135	2	109.2064	0.108	5	109.3140	0.156	6
542	727	964	5:SP2_SP2_SPD6	N[5,6]	C[5,6,6a]	Si[4,5]	3:6:3:	3:3:3:	3:2:3:3:2:2:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:N-2:N-2:	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NC)2	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|C<3>,2|N<2>,2|N<3>,4|H<1>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NC)2{1|H<1>,4|C<3>}	109.1510	0.535	2	109.1510	0.286	2	109.1773	0.145	3	109.1773	0.145	3	109.2064	0.108	5	109.3140	0.156	6
542	727	964	5:SP2_SP2_SPD6	N[5,6]	C[5,6,6a]	Si[4,5]	3:6:3:	3:3:3:	3:2:3:3:2:2:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:N-2:N-2:	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NN)2	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[5,6,6a](N[5,6]Si[4,5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|C<3>,2|N<2>,2|N<3>,4|H<1>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NN)2{1|H<1>,4|C<3>}	109.2300	0.000	1	109.2300	0.000	1	109.1773	0.145	3	109.1773	0.145	3	109.2064	0.108	5	109.3140	0.156	6
542	727	976	0:SP2_SP2_SP2	N[5,5]	C[5,6a]	O[5]	3:4:2:	3:3:3:	3:3:	C[5,6a]-3:C[5,5]-4:O[5]-2:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	N[5,5]-3:C[5]-3:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[3]C[5]2)(O[5]C[5])	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]O[5])(C[6a]C[6a]H)	O[5](N[5,5]C[5,6a]C[5,5])(C[5]C[5]O)	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[3]C[5]2)(O[5]C[5]){1|N<3>,2|C<3>,2|H<1>,2|O<1>,3|C<4>}	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]O[5])(C[6a]C[6a]H){1|Cl<1>,1|H<1>,1|O<1>,2|C<3>,2|C<4>}	O[5](N[5,5]C[5,6a]C[5,5])(C[5]C[5]O){1|N<3>,2|C<4>,3|C<3>}	104.5070	0.000	1	104.5070	0.000	1	104.5070	0.000	1	104.5070	0.000	1	104.5070	0.000	1	104.5070	0.000	1
542	727	976	0:SP2_SP2_SP3	N[5,5]	C[5,6a]	O[5]	3:4:2:	3:3:3:	3:4:	C[5,6a]-3:C[3x5]-4:O[5]-2:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	N[5,5]-3:C[5]-4:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[3x5]C[5,5]C[5]2)(O[5]C[5])	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[3x5]O[5])(C[6a]C[6a]H)	O[5](N[5,5]C[5,6a]C[3x5])(C[5]C[5,5]CC)	N[5,5](C[5,6a]C[5,6a]C[6a])(C[3x5]C[5,5]C[5]2)(O[5]C[5]){1|N<3>,1|O<1>,2|C<3>,3|C<4>,4|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[3x5]O[5])(C[6a]C[6a]H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,3|C<4>}	O[5](N[5,5]C[5,6a]C[3x5])(C[5]C[5,5]CC){1|H<1>,2|C<4>,3|C<3>}	112.2130	0.000	1	112.2130	0.000	1	112.2130	0.000	1	111.0150	2.870	2	111.0150	2.870	2	111.0150	2.870	2
542	727	976	0:SP2_SP2_SP3	N[5,5]	C[5,6a]	O[5]	3:4:2:	3:3:3:	3:4:	C[5,6a]-3:C[5,5]-4:O[5]-2:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	N[5,5]-3:C[5]-4:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5]2C)(O[5]C[5])	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]O[5])(C[6a]C[6a]H)	O[5](N[5,5]C[5,6a]C[5,5])(C[5]C[5]CH)	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]C[5]2C)(O[5]C[5]){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(N[5,5]C[5,5]O[5])(C[6a]C[6a]H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	O[5](N[5,5]C[5,6a]C[5,5])(C[5]C[5]CH){1|C<4>,2|H<1>,3|C<3>}	109.8170	0.000	1	109.8170	0.000	1	109.8170	0.000	1	111.0150	2.870	2	111.0150	2.870	2	111.0150	2.870	2
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6,6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6,6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6,6a]N[5])(C[6,6a]C[6,6a]C[6])(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6,6a])(O[5]N[5])(O){3|C<3>}	C[5,6a](C[5,6a]C[6,6a]N[5])(C[6,6a]C[6,6a]C[6])(N[5]O[5]O){1|H<1>,1|N<3>,3|C<3>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	106.3205	0.781	2	106.3205	0.611	2	106.3205	0.611	2	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[5a]C[6a])(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O){3|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[5a]C[6a])(N[5]O[5]O){2|N<3>,3|C<3>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	106.3190	0.000	1	106.3190	0.000	1	106.0103	0.084	15	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]Br)(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O){1|Br<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]Br)(N[5]O[5]O){1|Br<1>,1|C<3>,1|H<1>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	106.0627	0.418	4	106.0627	0.175	4	106.0103	0.084	15	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]Cl)(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O){1|Cl<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]Cl)(N[5]O[5]O){1|Cl<1>,1|C<3>,1|H<1>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	105.7655	0.053	4	105.7655	0.003	4	106.0103	0.084	15	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]O[5]O){1|C<2>,1|C<3>,1|N<3>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	106.0033	0.242	3	106.0870	0.052	6	106.0103	0.084	15	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:1:	3:3:3:	3:2:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]O[5]O)	O[5](N[5]C[5,6a]O)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(O[5]N[5])(O){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]O[5]O){1|C<3>,2|H<1>}	O[5](N[5]C[5,6a]O)(N[5]C[5,6a]){2|C<3>}	106.1707	0.227	3	106.0870	0.052	6	106.0103	0.084	15	106.0468	0.122	17	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP2	N[5]	C[5,6a]	O[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:O[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]O[5]C)	O[5](C[5]C[5,6a]N)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(CC3){1|H<1>,1|N<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]O[5]C){1|C<3>,1|N<2>,2|H<1>}	O[5](C[5]C[5,6a]N)(N[5]C[5,6a]C){2|C<3>}	106.9435	1.862	2	106.9435	3.466	2	106.9435	3.466	2	106.9435	3.466	2	106.1412	0.381	19	106.1412	0.381	19
542	727	976	5:SP2_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6]){1|C<4>,3|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){1|C<3>,3|H<1>,4|C<4>}	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6]){2|C<3>,5|C<4>}	101.0780	0.000	1	101.2740	0.077	2	101.1344	0.042	5	101.1344	0.042	5	101.1344	0.042	5	101.6182	1.438	6
542	727	976	5:SP2_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6]){1|C<4>,3|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){1|C<3>,3|H<1>,4|C<4>}	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6]){3|C<3>,4|C<4>}	101.4700	0.000	1	101.2740	0.077	2	101.1344	0.042	5	101.1344	0.042	5	101.1344	0.042	5	101.6182	1.438	6
542	727	976	5:SP2_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[6a]C[6]H)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[6a]C[6]H)(O[5,6]C[5,6]){1|C<4>,4|C<3>,4|H<1>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){2|C<3>,2|C<4>,4|H<1>}	O[5,6](C[5,6]C[5,6a]C[6]H)(N[5,6]C[5,6a]C[6]){1|C<4>,1|H<1>,5|C<3>}	101.0413	0.115	3	101.0413	0.013	3	101.1344	0.042	5	101.1344	0.042	5	101.1344	0.042	5	101.6182	1.438	6
542	727	976	5:SP2_SP2_SP3	N[5]	C[5,6a]	O[5]	3:2:4:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(CCHH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]O[5]C)	O[5](C[5]C[5,6a]CH)(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(CCHH){1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]O[5]C){1|C<3>,1|C<4>,3|H<1>}	O[5](C[5]C[5,6a]CH)(N[5]C[5,6a]C){2|C<3>}	104.0370	0.000	1	104.0370	0.000	1	104.0370	0.000	1	104.0370	0.000	1	104.0370	0.000	1	101.6182	1.438	6
542	727	976	5:SP3_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6]){1|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){2|C<3>,3|C<4>,3|H<1>}	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6]){1|H<1>,2|C<4>,4|C<3>}	100.1250	0.000	1	100.5620	0.382	2	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4
542	727	976	5:SP3_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[5,6]CC)(O[5,6]C[5,6]){1|C<4>,3|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){1|C<3>,3|H<1>,4|C<4>}	O[5,6](C[5,6]C[5,6a]C[5,6]H)(N[5,6]C[5,6a]C[6]){3|C<3>,4|C<4>}	100.9990	0.000	1	100.5620	0.382	2	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4
542	727	976	5:SP3_SP2_SP3	N[5,6]	C[5,6a]	O[5,6]	3:4:2:	3:3:3:	4:3:	C[5,6a]-3:C[6]-4:O[5,6]-2:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	C[5,6]-4:N[5,6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[6a]C[6]H)(O[5,6]C[5,6])	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H)	O[5,6](C[5,6]C[5,6a]C[6]H)(N[5,6]C[5,6a]C[6])	N[5,6](C[5,6a]C[5,6a]C[6a])(C[6]C[6a]C[6]H)(O[5,6]C[5,6]){1|C<4>,4|C<3>,4|H<1>}	C[5,6a](C[5,6a]C[5,6]C[6a])(N[5,6]O[5,6]C[6])(C[6a]C[6a]H){2|C<3>,2|C<4>,4|H<1>}	O[5,6](C[5,6]C[5,6a]C[6]H)(N[5,6]C[5,6a]C[6]){1|C<4>,1|H<1>,5|C<3>}	101.0225	0.861	2	101.0225	0.741	2	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4	100.7922	0.445	4
542	727	983	0:SP2_SP1_SP2	N[5]	C[5,6a]	C	3:3:2:	3:3:3:	3:2:	C[5,6a]-3:C[5]-3:C-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]Se[5]S)(CC)	C[5,6a](C[5,6a]C[6a]Se[5])(C[6a]C[6a]H)(N[5]C[5]C)	C(N[5]C[5,6a]C[5])(CN[5])	N[5](C[5,6a]C[5,6a]C[6a])(C[5]Se[5]S)(CC){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]Se[5])(C[6a]C[6a]H)(N[5]C[5]C){1|C<3>,1|S<1>,2|H<1>}	C(N[5]C[5,6a]C[5])(CN[5])	121.9610	0.000	1	121.9610	0.000	1	121.9610	0.000	1	121.9610	0.000	1	123.8020	6.779	2	123.8020	6.779	2
542	727	983	0:SP2_SP1_SP2	N[5]	C[5,6a]	C	3:3:2:	3:3:3:	3:4:	C[5,6a]-3:C[5]-3:C-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-4:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]C)(CC)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]C)	C(N[5]C[5,6a]C[5])(CH3)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]C)(CC){1|Ge<5>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]C){1|Ge<5>,1|C<3>,1|C<4>,2|H<1>}	C(N[5]C[5,6a]C[5])(CH3)	125.6430	0.000	1	125.6430	0.000	1	125.6430	0.000	1	125.6430	0.000	1	123.8020	6.779	2	123.8020	6.779	2
542	727	984	0:SP2_SP-NON_SP2	N[5]	C[5,6a]	Ga	3:3:4:	3:3:3:	3:3:4:4:	C[5,6a]-3:C[5]-3:Ga-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:C-4:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]C)(GaN[5]CC)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]Ga)	Ga(N[5]C[5,6a]C[5])2(CH3)2	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]C)(GaN[5]CC){1|Ga<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]Ga){1|Ga<4>,1|C<3>,1|C<4>,2|H<1>}	Ga(N[5]C[5,6a]C[5])2(CH3)2	126.5465	1.425	2	126.5465	2.030	2	127.9832	4.048	6	127.9832	4.048	6	127.9832	4.048	6	127.9832	4.048	6
542	727	984	0:SP2_SP-NON_SP2	N[5]	C[5,6a]	Ga	3:3:4:	3:3:3:	3:3:4:4:	C[5,6a]-3:C[5]-3:Ga-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:C-4:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(GaN[5]CC)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]Ga)	Ga(N[5]C[5,6a]C[5])2(CH3)2	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(GaN[5]CC){1|Ga<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]Ga){1|Ga<4>,1|C<3>,3|H<1>}	Ga(N[5]C[5,6a]C[5])2(CH3)2	128.7015	2.001	4	128.7015	4.006	4	127.9832	4.048	6	127.9832	4.048	6	127.9832	4.048	6	127.9832	4.048	6
542	727	987	0:SP2_SP-NON_SP2	N[5,5]	C[5,6a]	P[5]	3:3:2:	3:3:3:	3:3:	C[5,6a]-3:C[5,5]-3:P[5]-2:	C[5,6a]-3:N[5,5]-3:C[6a]-3:	N[5,5]-3:C[5,5]-3:	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]S[5])(P[5]C[5,5])	C[5,6a](C[5,6a]C[6a]S[5])(N[5,5]C[5,5]P[5])(C[6a]C[6a]H)	P[5](N[5,5]C[5,6a]C[5,5])(C[5,5]N[5,5]S[5])	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]S[5])(P[5]C[5,5]){1|H<1>,1|S<2>,3|C<3>}	C[5,6a](C[5,6a]C[6a]S[5])(N[5,5]C[5,5]P[5])(C[6a]C[6a]H){1|N<3>,2|C<3>,2|H<1>}	P[5](N[5,5]C[5,6a]C[5,5])(C[5,5]N[5,5]S[5]){1|S<2>,4|C<3>}	132.5390	0.000	1	132.5390	0.000	1	132.5390	0.000	1	132.5390	0.000	1	132.5390	0.000	1	132.5390	0.000	1
542	727	987	5:SP2_SP-NON_SP2	N[5]	C[5,5a]	P[5]	3:3:2:	3:3:3:	3:3:	C[5,5a]-3:C[6a]-3:P[5]-2:	C[5a,6a]-3:C[5,5a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,5a]C[5a,6a]C[5,5a])(C[6a]C[6a]2)(P[5]N[5])	C[5,5a](C[5a,6a]C[5a,6a,6a]C[6a])(C[5,5a]C[5a,6a]N[5])(N[5]C[6a]P[5])	P[5](N[5]C[5,5a]C[6a])2	N[5](C[5,5a]C[5a,6a]C[5,5a])(C[6a]C[6a]2)(P[5]N[5]){2|C<4>,6|C<3>}	C[5,5a](C[5a,6a]C[5a,6a,6a]C[6a])(C[5,5a]C[5a,6a]N[5])(N[5]C[6a]P[5]){1|H<1>,6|C<3>}	P[5](N[5]C[5,5a]C[6a])2{6|C<3>}	113.4705	0.695	2	113.4705	0.483	2	113.4705	0.483	2	113.4705	0.483	2	113.4705	0.483	2	114.3276	0.663	7
542	727	987	5:SP2_SP-NON_SP2	N[5]	C[5,6a]	P[5]	3:2:1:	3:3:3:	3:3:	C[5,6a]-3:P[5]-2:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5])(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H)	P[5](N[5]C[5,6a]H)2	N[5](C[5,6a]C[5,6a]C[6a])(P[5]N[5])(H){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]P[5]H){1|C<3>,3|H<1>}	P[5](N[5]C[5,6a]H)2{2|C<3>}	115.0893	0.244	3	115.0893	0.059	3	115.0893	0.059	3	115.0893	0.059	3	114.6704	0.359	5	114.3276	0.663	7
542	727	987	5:SP2_SP-NON_SP2	N[5]	C[5,6a]	P[5]	3:3:2:	3:3:3:	3:3:	C[5,6a]-3:C[6a]-3:P[5]-2:	C[5a,6a]-3:C[5,6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5])	C[5,6a](C[5a,6a]C[5a,6a]C[5a])(C[5,6a]C[5a,6a]N[5])(N[5]C[6a]P[5])	P[5](N[5]C[5,6a]C[6a])2	N[5](C[5,6a]C[5a,6a]C[5,6a])(C[6a]C[6a]2)(P[5]N[5]){2|H<1>,6|C<3>}	C[5,6a](C[5a,6a]C[5a,6a]C[5a])(C[5,6a]C[5a,6a]N[5])(N[5]C[6a]P[5]){1|H<1>,1|S<2>,6|C<3>}	P[5](N[5]C[5,6a]C[6a])2{6|C<3>}	114.0420	0.030	2	114.0420	0.001	2	114.0420	0.001	2	114.0420	0.001	2	114.6704	0.359	5	114.3276	0.663	7
542	727	992	0:SP2_SP2_SP3	N[5]	C[5,6a]	P	3:3:4:	3:3:3:	3:3:3:1:	C[5,6a]-3:C[5,6]-3:P-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N-3:N-3:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]C[6])(PNNO)	C[5,6a](C[5,6a]C[5,6]C[6a])(C[6a]C[6a]H)(N[5]C[5,6]P)	P(N[5]C[5,6a]C[5,6])(NCC)2(O)	N[5](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5,6]C[6])(PNNO){2|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6]C[6a])(C[6a]C[6a]H)(N[5]C[5,6]P){2|C<3>,2|C<4>,2|H<1>}	P(N[5]C[5,6a]C[5,6])(NCC)2(O)	122.0420	0.747	2	122.0420	0.558	2	122.0420	0.558	2	122.0420	0.558	2	121.7473	0.539	3	121.7473	0.539	3
542	727	992	0:SP2_SP2_SP3	N[5]	C[5,6a]	P	3:3:4:	3:3:3:	3:4:4:4:	C[5,6a]-3:N[5]-3:P-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-4:C-4:C-4:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(PC3)	C[5,6a](C[5,6a]C[5,5]C[6a])(C[6a]C[6a]H)(N[5]N[5]P)	P(N[5]C[5,6a]N[5])(CH3)3	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(PC3){1|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,5]C[6a])(C[6a]C[6a]H)(N[5]N[5]P){1|C<4>,2|H<1>,3|C<3>}	P(N[5]C[5,6a]N[5])(CH3)3	121.1580	0.000	1	121.1580	0.000	1	121.1580	0.000	1	121.1580	0.000	1	121.7473	0.539	3	121.7473	0.539	3
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BBr3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BBr3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a]){2|C<3>}	109.6550	0.000	1	109.6550	0.000	1	109.8017	0.673	4	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BC[6a]3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BC[6a]3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a]){2|C<3>}	108.7000	0.000	1	108.7000	0.000	1	109.8017	0.673	4	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a]){2|C<3>}	110.3740	0.000	1	110.3740	0.000	1	109.8017	0.673	4	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BF3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BF3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]B)(N[5]C[5,6a]){2|C<3>}	110.4780	0.000	1	110.4780	0.000	1	109.8017	0.673	4	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CC3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CC3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a]){2|C<3>}	109.9250	0.000	1	109.9250	0.000	1	111.0213	0.320	15	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CCCH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CCCH){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a]){2|C<3>}	110.7695	0.284	2	110.7695	0.080	2	111.0213	0.320	15	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CCHH){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a]){2|C<3>}	111.2282	0.619	6	111.2282	0.383	6	111.0213	0.320	15	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CC[6a]HH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CC[6a]HH){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a]){2|C<3>}	110.8080	0.420	3	110.8080	0.177	3	111.0213	0.320	15	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:2:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CH3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(CH3){1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]C){1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]C)(N[5]C[5,6a]){2|C<3>}	111.3543	0.204	3	111.3543	0.042	3	111.0213	0.320	15	110.7646	0.622	19	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:Se[5]-2:B-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	Se[5](N[5]C[5,6a]B)2	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3){1|B<4>,1|H<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|B<4>,1|C<3>,2|H<1>}	Se[5](N[5]C[5,6a]B)2{2|C<3>}	113.4170	0.000	1	113.4170	0.000	1	113.4170	0.000	1	114.3095	1.593	2	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:2:4:	3:3:3:	3:3:	C[5,6a]-3:Se[5]-2:C-4:	C[5,6a,6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a,6a]C[6a])(Se[5]C[5,6a])(CH3)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(N[5]Se[5]C)	Se[5](C[5,6a]C[5,6a,6a]C[6a])(N[5]C[5,6a]C)	N[5](C[5,6a]C[5,6a,6a]C[6a])(Se[5]C[5,6a])(CH3){1|H<1>,3|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(N[5]Se[5]C){1|H<1>,3|C<3>}	Se[5](C[5,6a]C[5,6a,6a]C[6a])(N[5]C[5,6a]C){1|H<1>,3|C<3>}	115.2020	0.000	1	115.2020	0.000	1	115.2020	0.000	1	114.3095	1.593	2	111.0690	1.629	23	111.0690	1.629	23
542	727	997	5:SP2_SP2_SP3	N[5]	C[5,6a]	Se[5]	3:4:2:	3:3:3:	3:2:	C[5,6a]-3:C[6]-4:Se[5]-2:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5]-3:N[5]-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]2H)(Se[5]N[5])	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Se[5]C[6])(C[6a]C[6a]H)	Se[5](N[5]C[5,6a]C[6])(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]2H)(Se[5]N[5]){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Se[5]C[6])(C[6a]C[6a]H){1|C<3>,2|C<4>,3|H<1>}	Se[5](N[5]C[5,6a]C[6])(N[5]C[5,6a]){1|H<1>,2|C<3>,2|C<4>}	110.7200	0.180	2	110.7200	0.032	2	110.7200	0.032	2	110.7200	0.032	2	111.0690	1.629	23	111.0690	1.629	23
542	742	762	0:SP2_SP2_SP3	N[5,6]	B[4,5]	C[6]	4:3:3:	4:3:3:2:	3:3:1:	B[4,5]-4:C[5,6]-3:C[6]-3:	C[4,5]-4:N[5,6]-3:C[6a]-3:O[4]-2:	N[5,6]-3:C[6]-3:H-1:	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)	B[4,5](C[4,5]C[6a]C[4]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(O[4]C[4])	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){2|H<1>,6|C<3>}	B[4,5](C[4,5]C[6a]C[4]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(O[4]C[4]){1|O<1>,3|H<1>,7|C<3>}	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>}	128.8630	0.000	1	128.8630	0.000	1	128.8630	0.000	1	128.8630	0.000	1	128.8630	0.000	1	128.8630	0.000	1
542	742	818	5:SP2_SP2_SP3	N[5,6]	B[4,5]	C[5,6]	4:3:3:	4:3:3:2:	3:3:3:	B[4,5]-4:C[5,6]-3:C[6]-3:	C[4,5]-4:N[5,6]-3:C[6a]-3:O[4]-2:	N[5,6]-3:C[5]-3:C[6]-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)	B[4,5](C[4,5]C[6a]C[4]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(O[4]C[4])	C[5,6](N[5,6]B[4,5]C[6])(C[5]C[4,5]C[6a])(C[6]C[6]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){2|H<1>,6|C<3>}	B[4,5](C[4,5]C[6a]C[4]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(O[4]C[4]){1|O<1>,3|H<1>,7|C<3>}	C[5,6](N[5,6]B[4,5]C[6])(C[5]C[4,5]C[6a])(C[6]C[6]H){1|O<2>,2|H<1>,6|C<3>}	109.4840	0.000	1	109.4840	0.000	1	109.4840	0.000	1	109.4840	0.000	1	109.4840	0.000	1	110.3660	1.419	3
542	742	818	5:SP2_SP2_SP3	N[5]	B[4,5]	C[5]	4:3:3:	3:3:3:2:	3:3:4:	B[4,5]-4:C[6a]-3:C[5]-3:	N[4]-3:N[5]-3:C[5]-3:O[4]-2:	N[5]-3:C[5]-3:C-4:	N[5](B[4,5]C[5]N[4]O[4])(C[6a]C[6a]2)(C[5]C[5]C)	B[4,5](N[4]C[6a]C[4])(N[5]C[6a]C[5])(C[5]C[5]C)(O[4]C[4])	C[5](N[5]B[4,5]C[6a])(C[5]C[5]H)(CC3)	N[5](B[4,5]C[5]N[4]O[4])(C[6a]C[6a]2)(C[5]C[5]C){1|H<1>,3|C<4>,4|C<3>}	B[4,5](N[4]C[6a]C[4])(N[5]C[6a]C[5])(C[5]C[5]C)(O[4]C[4]){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[5](N[5]B[4,5]C[6a])(C[5]C[5]H)(CC3){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	109.8930	0.000	1	109.8930	0.000	1	109.8930	0.000	1	109.8930	0.000	1	110.8070	1.671	2	110.3660	1.419	3
542	742	818	5:SP2_SP2_SP3	N[5]	B[4,5]	C[5]	4:3:3:	3:4:2:2:	3:3:3:	B[4,5]-4:C[5]-3:C[6a]-3:	N[5]-3:C[4]-4:O[4]-2:O[5]-2:	N[5]-3:B[5]-3:C[6a]-3:	N[5](B[4,5]C[4]O[4]O[5])(C[5]C[6a]B[5])(C[6a]C[6a]2)	B[4,5](N[5]C[6a]C[5])(C[4]C[4]CC)(O[4]C[4])(O[5]B[5])	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2)	N[5](B[4,5]C[4]O[4]O[5])(C[5]C[6a]B[5])(C[6a]C[6a]2){5|C<3>,5|C<4>}	B[4,5](N[5]C[6a]C[5])(C[4]C[4]CC)(O[4]C[4])(O[5]B[5]){2|C<4>,4|C<3>}	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2){1|O<2>,3|C<4>,6|C<3>}	111.7210	0.000	1	111.7210	0.000	1	111.7210	0.000	1	111.7210	0.000	1	110.8070	1.671	2	110.3660	1.419	3
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,5]	3:4:3:	3:3:1:	3:2:2:2:	C[5,6]-3:B[5,5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:	N[5,6](C[5,6]C[5]C[6])(B[5,5]O[5]3)(C[6]C[6]H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	B[5,5](N[5,6]C[5,6]C[6])(O[5]C[5])3	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](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>}	B[5,5](N[5,6]C[5,6]C[6])(O[5]C[5])3{2|C<3>,2|H<1>,5|C<4>}	128.6490	0.319	4	128.6490	0.102	4	128.6490	0.102	4	128.6490	0.102	4	128.0238	1.627	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,5]	3:4:3:	3:3:1:	3:3:3:3:	C[5,6]-3:B[5,5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:N[5,6]-3:	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5,6]C[5,6]C[6])	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5,6]C[5,6]C[6]){4|H<1>,8|C<3>}	128.0260	0.000	1	128.0260	0.000	1	128.0260	0.000	1	128.0260	0.000	1	128.0238	1.627	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,5]	4:3:3:	3:3:1:	3:4:2:2:	B[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:O[5]-2:O[5]-2:	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	B[5,5](N[5,6]C[5,6]C[6])(C[5]B[5]2C[5])(O[5]C[5])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](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>}	B[5,5](N[5,6]C[5,6]C[6])(C[5]B[5]2C[5])(O[5]C[5])2{2|C<3>,3|H<1>,4|C<4>,4|O<2>}	125.5210	0.000	1	125.5210	0.000	1	125.5210	0.000	1	125.5210	0.000	1	128.0238	1.627	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,6,6]	4:3:3:	3:3:1:	3:3:4:4:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6,6]-4:C[6,6]-4:	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](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	B[5,6,6](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6,6]C[6]2H)2	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](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>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6,6]C[6]2H)2{10|H<1>,2|C<4>,4|C<3>}	131.3810	0.065	2	131.3810	0.004	2	131.3810	0.004	2	131.3810	0.004	2	131.2018	0.158	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,6,6]	4:3:3:	3:3:1:	3:4:4:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]2)	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](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>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]2){1|Fe<10>,10|H<1>,2|C<3>,4|C<4>}	131.3605	0.107	2	131.3605	0.011	2	131.3497	0.006	3	131.3497	0.006	3	131.2018	0.158	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,6,6]	4:3:3:	3:3:1:	3:4:4:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]Si)	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](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>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]Si){10|H<1>,2|C<3>,2|C<4>}	131.3280	0.000	1	131.3280	0.000	1	131.3497	0.006	3	131.3497	0.006	3	131.2018	0.158	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5,6,6]	4:3:3:	3:3:1:	3:4:4:4:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]N[5]HH)	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](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>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]N[5]HH){2|C<3>,3|C<4>,9|H<1>}	130.4000	0.000	1	130.4000	0.000	1	130.4000	0.000	1	130.4000	0.000	1	131.2018	0.158	6	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:3:4:	3:3:1:	3:2:1:1:	N[5,6]-3:C[6]-3:B[5]-4:	C[5a,6]-3:N[5,6]-3:H-1:	N[5,6]-3:O[5]-2:F-1:F-1:	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H)	B[5](N[5,6]N[5,6]C[6])(O[5]C[5])(F)2	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[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>}	B[5](N[5,6]N[5,6]C[6])(O[5]C[5])(F)2{1|B<4>,1|C<3>,1|C<4>,1|H<1>}	131.8190	0.000	1	130.8257	0.478	4	130.8257	0.478	4	130.8257	0.478	4	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:3:4:	3:3:1:	3:2:1:1:	N[5,6]-3:C[6]-3:B[5]-4:	C[5a,6]-3:N[5,6]-3:H-1:	N[5,6]-3:O[5]-2:F-1:F-1:	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]N[5,6]B[5])(H)	B[5](N[5,6]N[5,6]C[6])(O[5]C[5])(F)2	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[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>}	B[5](N[5,6]N[5,6]C[6])(O[5]C[5])(F)2{1|B<4>,1|H<1>,2|C<3>}	130.4947	0.243	3	130.8257	0.478	4	130.8257	0.478	4	130.8257	0.478	4	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:1:	3:3:1:1:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,6]-3:N[5,6]-3:H-1:	C[5,6a]-3:N[5,6]-3:Cl-1:Cl-1:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]Cl2)(C[6]C[5,6]H)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(Cl)2	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[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>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(Cl)2{2|H<1>,4|C<3>}	128.2070	0.000	1	128.2070	0.000	1	128.2070	0.000	1	128.3790	0.059	2	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:1:	3:3:1:1:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5a]-3:N[5,6]-3:Br-1:Br-1:	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]Br2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(Br)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){2|Br<1>,1|H<1>,3|C<3>}	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(Br)2{1|H<1>,1|S<2>,4|C<3>}	128.5510	0.000	1	128.5510	0.000	1	128.5510	0.000	1	128.3790	0.059	2	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:1:	3:3:4:4:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:N[5,6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C-4:C-4:	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[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(N[5,6]C[5,6]C[6])(CH3)2	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[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>}	B[5](C[5,5a]C[5a,6a]C[5,5a])(N[5,6]C[5,6]C[6])(CH3)2{1|H<1>,1|S<2>,4|C<3>}	127.2570	0.000	1	127.2570	0.000	1	127.2570	0.000	1	127.2570	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:3:	3:3:4:4:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:N-3:	C[5,6a]-3:N[5,6]-3:C-4:C-4:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)(C[6]C[6]N)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(CCHH)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH){1|H<1>,2|C<4>,3|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(CCHH)2{1|H<1>,1|N<3>,4|C<3>}	127.9490	0.000	1	127.9490	0.000	1	127.9490	0.000	1	127.9490	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:4:	3:3:1:1:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:H-1:H-1:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(H)2	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](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>}	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(H)2{1|C<4>,2|H<1>,4|C<3>}	125.9500	0.000	1	125.9500	0.000	1	125.9500	0.000	1	125.9500	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	3:4:3:	3:3:4:	3:3:2:1:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:O-2:H-1:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(OC)(H)	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](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>}	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(OC)(H){1|C<4>,2|H<1>,4|C<3>}	127.0150	0.000	1	127.0150	0.000	1	127.0150	0.000	1	127.0150	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:1:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6a]-3:Cl-1:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl){3|H<1>,7|C<3>}	128.0810	0.000	1	128.0810	0.000	1	128.0810	0.000	1	128.0810	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6]-3:N[5,6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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[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>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	126.4440	0.000	1	126.4440	0.000	1	126.4440	0.000	1	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{1|S<2>,2|H<1>,4|C<4>,7|C<3>}	129.0500	0.000	1	129.0500	0.000	1	129.0500	0.000	1	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H){1|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	126.4705	0.291	2	126.4705	0.084	2	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	126.9610	0.000	1	126.9610	0.000	1	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|C<4>,4|H<1>,8|C<3>}	127.9963	0.511	3	128.2130	0.454	7	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	129.0360	0.294	2	128.2130	0.454	7	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{6|H<1>,8|C<3>}	127.7150	0.349	2	128.2130	0.454	7	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	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](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H){1|H<1>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	126.7640	0.000	1	126.7640	0.000	1	127.6506	0.907	11	127.6655	1.040	13	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	3:3:3:4:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6a]-3:C-4:	N[5,6](B[5]C[6a]C[5]C)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(CH3)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(CH3){3|H<1>,7|C<3>}	127.9310	0.000	1	127.9310	0.000	1	127.9310	0.000	1	127.9310	0.000	1	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:1:	4:3:3:1:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-4:N[5,6]-3:C[6a]-3:Cl-1:	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	B[5](C[5,5]C[5,5]C[5]Fe)(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(Cl)	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](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>}	B[5](C[5,5]C[5,5]C[5]Fe)(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(Cl){2|C<4>,4|C<3>,4|H<1>}	125.0650	0.293	2	125.0650	0.086	2	125.0650	0.086	2	125.0650	0.086	2	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:4:	3:3:3:1:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6]-3:N[5,6]-3:C-4:	N[5,6]-3:C[5]-3:C[6a]-3:Cl-1:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[5,6]C)	C[6](C[5,6]N[5,6]C[5])(N[5,6]C[5,6]B[5])(CH3)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl)	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[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>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl){1|C<4>,2|H<1>,7|C<3>}	127.5307	0.062	3	127.5307	0.004	3	127.5307	0.004	3	127.5307	0.004	3	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:4:	3:3:4:1:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6a]-3:P[5]-4:Cl-1:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl)	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](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>}	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl){1|Ga<4>,1|C<4>,3|H<1>,4|C<3>}	122.6160	0.000	1	123.1155	0.499	2	123.1155	0.499	2	123.1155	0.499	2	127.5890	3.683	32	128.1410	4.399	44
542	762	786	0:SP2_SP2_SP3	N[5,6]	C[6]	B[5]	4:3:3:	3:3:4:	3:3:4:1:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6a]-3:P[5]-4:Cl-1:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl)	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](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>}	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl){1|C<4>,4|C<3>,4|H<1>}	123.6150	0.000	1	123.1155	0.499	2	123.1155	0.499	2	123.1155	0.499	2	127.5890	3.683	32	128.1410	4.399	44
542	762	786	6:SP2_SP2_SP3	N[5,6]	C[6]	B[5,6]	4:3:4:	3:3:3:	3:3:2:2:	B[5,6]-4:C[6]-3:C[5]-4:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	N[5,6]-3:C[6a]-3:O[6]-2:O[5]-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](C[6,6a]C[6a,6a]C[6,6a])(N[5,6]B[5,6]C[5])(C[6a]C[6a]2)	B[5,6](N[5,6]C[5]C[6])(C[6a]C[6a]2)(O[6]C[6,6a])(O[5]C[5])	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](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>}	B[5,6](N[5,6]C[5]C[6])(C[6a]C[6a]2)(O[6]C[6,6a])(O[5]C[5]){1|O<1>,4|H<1>,5|C<3>}	121.7295	0.644	2	121.7295	0.415	2	121.7295	0.415	2	121.7295	0.415	2	121.7295	0.415	2	121.7295	0.415	2
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6,6]-3:C[5,6]-3:C[5]-3:	N[5,6]-3:C[6,6]-3:C[6]-3:	N[5,6]-3:C[5]-3:H-1:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O)	C[5](N[5,6]C[5,6]C[6,6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5,6]C[5,6]C[6,6])(C[5]N[5]H)(H){2|C<3>,2|C<4>}	131.3620	0.000	1	131.3620	0.000	1	131.3620	0.000	1	131.3620	0.000	1	129.0990	10.242	2	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5]	3:3:3:	4:3:3:	3:3:1:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[5,6,6]-4:N[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-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)	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)	C[5](N[5,6]C[5,6]C[6,6])(C[5]N[5]H)(H)	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[6,6](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>}	C[5](N[5,6]C[5,6]C[6,6])(C[5]N[5]H)(H){1|C<4>,1|N<2>,2|C<3>}	126.8360	0.000	1	126.8360	0.000	1	126.8360	0.000	1	126.8360	0.000	1	129.0990	10.242	2	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H)	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>,4|F<1>}	122.7660	0.000	1	124.0607	1.257	3	124.0607	1.257	3	124.0607	1.257	3	124.0607	1.257	3	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H)	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>}	124.7080	0.000	2	124.0607	1.257	3	124.0607	1.257	3	124.0607	1.257	3	124.0607	1.257	3	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:2:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:P[5]-2:O-2:	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(P[5]P[5])(OP)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|P<2>}	C[5](N[5,6]C[5,6]C[6])(P[5]P[5])(OP){1|H<1>,2|C<3>}	122.7530	0.000	1	122.7530	0.000	1	122.7530	0.000	1	122.7530	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-3:N[5,6]-3:O-1:	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H)	C[5](C[5,5]C[5,5]C[5])(N[5,6]C[5,6]C[6])(O)	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H){1|O<1>,4|C<3>}	C[5](C[5,5]C[5,5]C[5])(N[5,6]C[5,6]C[6])(O){1|H<1>,1|N<3>,4|C<3>}	126.1530	0.000	1	126.1530	0.000	1	126.1530	0.000	1	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]Ru)(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]Ru)(H){1|H<1>,1|O<1>,2|C<3>}	128.4345	0.265	2	128.0703	0.433	3	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]Ru)(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]Ru)(H){1|H<1>,1|O<2>,3|C<3>}	127.3420	0.000	1	128.0703	0.433	3	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[6]N[5])(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[6]N[5])(H){1|Ru<6>,1|H<1>,1|N<3>,3|C<3>}	130.7620	1.471	2	130.7620	2.163	2	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[6a]N[5])(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[6a]N[5])(H){1|Pt<4>,1|H<1>,4|C<3>}	129.2500	0.000	1	129.7800	0.562	2	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[6a]N[5])(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[6a]N[5])(H){1|Pt<5>,1|H<1>,4|C<3>}	130.3100	0.000	1	129.7800	0.562	2	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:1:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)(H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)(H){1|Co<4>,1|H<1>,2|C<3>}	131.6610	0.000	1	131.6610	0.000	1	129.6195	2.517	8	129.2343	3.538	9	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:P[5]-3:O-2:	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(P[5]P[5]Mo)(OB)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|P<2>,1|P<3>}	C[5](N[5,6]C[5,6]C[6])(P[5]P[5]Mo)(OB){1|H<1>,2|C<3>}	122.4033	0.779	3	122.4033	0.607	3	122.4033	0.607	3	122.4033	0.607	3	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]Se)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]Se){1|Se<2>,1|H<1>,2|C<3>}	129.8120	0.054	2	129.8120	0.003	2	129.8120	0.003	2	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Cd)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Cd){1|C<4>,2|H<1>,4|C<3>}	132.9010	0.995	3	132.5643	1.114	4	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Cd)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Cd){1|C<4>,3|H<1>,4|C<3>}	131.5540	0.000	1	132.5643	1.114	4	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Co)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Co){1|C<4>,2|H<1>,4|C<3>}	131.7430	0.000	1	132.2513	0.208	3	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Co)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Co){1|C<4>,2|H<1>,4|C<3>}	132.5055	0.170	2	132.2513	0.208	3	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe){1|C<4>,2|H<1>,4|C<3>}	132.1050	1.165	2	132.1496	0.879	5	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe){2|H<1>,5|C<3>}	130.9860	0.000	1	132.1496	0.879	5	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Fe){1|C<4>,2|H<1>,4|C<3>}	132.7760	0.119	2	132.1496	0.879	5	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Zn)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Zn){1|C<4>,2|H<1>,4|C<3>}	131.9960	0.000	1	132.0350	0.423	4	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Zn)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]C[5]Zn){1|C<4>,2|H<1>,4|C<3>}	132.0480	0.796	3	132.0350	0.423	4	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]N[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6]C[6]N[6])(N[5]N[5]Fe){2|H<1>,4|C<3>}	135.5740	0.000	1	135.5740	0.000	1	132.4396	1.226	17	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]Fe){1|C<4>,1|O<2>,3|H<1>,4|C<3>}	128.0420	0.000	1	128.0420	0.000	1	128.2915	0.125	2	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]Ru)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]Ru){1|O<1>,3|H<1>,4|C<3>}	128.5410	0.000	1	128.5410	0.000	1	128.2915	0.125	2	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Co)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Co){1|O<2>,2|H<1>,5|C<3>}	131.4165	0.062	2	131.4165	0.004	2	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Cu)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Cu){3|H<1>,5|C<3>}	130.1230	0.109	2	130.1230	0.012	2	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Fe)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Fe){1|O<2>,2|H<1>,5|C<3>}	131.0860	0.000	1	131.0860	0.000	1	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Pt)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Pt){3|H<1>,5|C<3>}	128.5190	0.000	1	128.5190	0.000	1	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Re)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Re){3|H<1>,5|C<3>}	128.7920	0.000	1	128.7920	0.000	1	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Ru)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]C[5]Ru){3|H<1>,5|C<3>}	128.9740	0.109	2	128.9740	0.012	2	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(N[5]C[5]Cu)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]N[6a])(N[5]C[5]Cu){1|C<4>,2|H<1>,4|C<3>}	131.5615	0.144	2	131.5615	0.021	2	130.2315	1.532	11	131.2571	2.973	32	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:4:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C-4:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]N[5])(CCHH)	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](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]N[5])(CCHH){1|Re<6>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	127.8760	0.000	1	127.8760	0.000	1	127.8760	0.000	1	128.0770	0.081	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:3:4:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C-4:	N[5,6](C[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(N[5]C[5]Pt)(CC[6a]HH)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5](N[5,6]C[5,6]C[6])(N[5]C[5]Pt)(CC[6a]HH){1|H<1>,3|C<3>}	128.2780	0.000	1	128.2780	0.000	1	128.2780	0.000	1	128.0770	0.081	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<3>,1|C<4>,3|H<1>}	126.9710	0.000	1	126.9710	0.000	1	126.9710	0.000	1	126.9710	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:2:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-2:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](N[5,6]N[5,6]C[5])(C[6]C[6]C)(OSi){1|O<1>,2|H<1>,3|C<4>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	126.1475	0.309	2	126.1475	0.095	2	126.1475	0.095	2	126.1475	0.095	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:3:	3:4:1:	N[5,6]-3:C[6]-3:C[5]-3:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](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>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){2|C<3>,3|C<4>}	128.6950	0.000	1	127.4515	3.093	2	127.4515	3.093	2	127.4515	3.093	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:3:	3:4:1:	N[5,6]-3:C[6]-3:C[5]-3:	C[6,6a]-3:N[5,6]-3:C-3:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(C[5]C[5]O)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]N[5,6]C[5])(CCH)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](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>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){2|C<3>,3|C<4>}	126.2080	0.000	1	127.4515	3.093	2	127.4515	3.093	2	127.4515	3.093	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:4:	3:3:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:H-1:	N[5,6](N[5,6]C[6,6a]C[5])(C[5]C[5]H)(C[6]C[6]C)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6,6a]C)(CCHH)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]H)(H)	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](N[5,6]N[5,6]C[5])(C[6]C[6,6a]C)(CCHH){1|H<1>,4|C<3>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]H)(H){1|C<4>,1|H<1>,2|C<3>}	130.7320	0.000	1	130.7320	0.000	1	130.7320	0.000	1	130.7320	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:4:1:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]O)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]HH)(O)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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>}	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>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	128.9910	0.000	1	128.9910	0.000	1	128.9910	0.000	1	128.9910	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:4:1:	3:4:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[5]-4:C-3:	N[5,6](C[5,6]C[5]N[6])(C[5]C[5]C)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]CC)(CCC)	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>}	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>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]CC)(CCC){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	125.3790	0.000	1	125.3790	0.000	1	125.3790	0.000	1	123.1925	9.562	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:4:1:	3:4:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:P[5]-4:C-3:	N[5,6](C[5,6]C[5]N[6])(C[5]P[5]C)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	C[5](N[5,6]C[5,6]C[6])(P[5]C[5]AuC)(CCC)	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>}	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>}	C[5](N[5,6]C[5,6]C[6])(P[5]C[5]AuC)(CCC){1|N<3>,1|O<1>,2|C<4>}	121.0060	0.000	1	121.0060	0.000	1	121.0060	0.000	1	123.1925	9.562	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:2:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:N[6]-3:O-1:	N[5,6]-3:N[5]-2:H-1:	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	C[5](N[5,6]C[5,6]C[6])(N[5]C[5])(H)	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>}	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>}	C[5](N[5,6]C[5,6]C[6])(N[5]C[5])(H){1|C<4>,1|N<3>,1|O<1>,3|C<3>}	122.9720	0.000	1	122.9720	0.000	1	122.9720	0.000	1	122.9720	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:O-1:	N[5,6](C[5,6]C[6a]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]H)(O)	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](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H){1|C<4>,1|O<1>,4|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]H)(O){1|H<1>,4|C<3>}	127.8930	0.000	1	127.8930	0.000	1	127.8930	0.000	1	127.8930	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:3:	C[5,5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:C[5]-3:C-3:	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](N[5,6]C[5,5,6]C[5])(C[6]C[6]O)(O)	C[5](N[5,6]C[5,5,6]C[6])(C[5]N[5]O)(CC[5a]H)	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](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>}	C[5](N[5,6]C[5,5,6]C[6])(C[5]N[5]O)(CC[5a]H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>}	127.6390	0.000	1	127.6390	0.000	1	127.6390	0.000	1	128.2460	5.670	3	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:3:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C-3:	N[5,6](C[5,6]C[6,6a]C[5]H)(C[5]C[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)(CN[6]O)	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)(CN[6]O){3|C<3>,3|H<1>}	130.8720	0.000	1	130.8720	0.000	1	130.8720	0.000	1	128.2460	5.670	3	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:3:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[5]-3:	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]H){1|Cl<1>,1|O<1>,2|H<1>,5|C<3>}	126.2270	0.000	1	126.2270	0.000	1	126.2270	0.000	1	128.2460	5.670	3	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:4:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:O-1:	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]C[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]CC)(O)	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<2>,1|O<1>,2|C<3>,2|C<4>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]CC)(O){1|C<2>,2|H<1>,3|C<3>}	125.7810	0.000	1	125.7810	0.000	1	125.7810	0.000	1	125.7810	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:2:	3:2:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-2:	N[5,6]-3:O[5]-2:O-1:	N[5,6](C[5,6]C[5]C[6]C)(C[5]O[5]O)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC)	C[5](N[5,6]C[5,6]C[6])(O[5]C[5])(O)	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](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>}	C[5](N[5,6]C[5,6]C[6])(O[5]C[5])(O){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	127.1630	0.587	2	127.1630	0.344	2	127.1630	0.344	2	127.1630	0.344	2	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:4:1:	3:3:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[5]-3:H-1:	N[5,6](C[5,6]C[5]C[6]H)(C[5]C[5]H)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]HH)(O)	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(H)	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>}	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>}	C[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(H){1|O<1>,2|C<4>,3|H<1>}	124.6940	0.000	1	124.6940	0.000	1	124.6940	0.000	1	124.6940	0.000	1	129.0790	10.174	65	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6,6]	C[5]	3:4:3:	4:3:3:	3:2:1:	C[6,6]-3:C[5]-4:C[5]-3:	C[3x6]-4:C[6,6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	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]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O)	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]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>}	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O){1|C<3>,2|C<4>,3|H<1>}	124.9780	0.000	1	124.0245	2.383	4	124.3908	2.789	6	124.3908	2.789	6	124.3908	2.789	6	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6,6]	C[5]	3:4:3:	4:3:3:	3:2:1:	C[6,6]-3:C[5]-4:C[5]-3:	C[3x6]-4:C[6,6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	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]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O)	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]2H)(C[6,6]C[3x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O){1|C<3>,2|C<4>,3|H<1>}	123.7067	1.723	3	124.0245	2.383	4	124.3908	2.789	6	124.3908	2.789	6	124.3908	2.789	6	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6,6]	C[5]	3:4:3:	4:3:3:	3:2:1:	C[6,6]-3:C[5]-4:C[5]-3:	C[3x6]-4:C[6,6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	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]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O)	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]2H)(C[6,6]C[4x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O){1|C<3>,2|C<4>,3|H<1>}	123.5130	0.000	1	123.5130	0.000	1	124.3908	2.789	6	124.3908	2.789	6	124.3908	2.789	6	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6,6]	C[5]	3:4:3:	4:3:3:	3:2:1:	C[6,6]-3:C[5]-4:C[5]-3:	C[3x6]-4:C[6,6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	N[5](C[6,6]C[3x6]C[6,6])(C[5]C[5]HH)(C[5]O[5]O)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O)	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[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>}	C[5](N[5]C[6,6]C[5])(O[5]C[5])(O){1|C<3>,1|C<4>,4|H<1>}	126.7340	0.000	1	126.7340	0.000	1	124.3908	2.789	6	124.3908	2.789	6	124.3908	2.789	6	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5,6]	3:3:3:	3:2:2:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	C[5,6]-3:N[5]-3:C[6]-2:	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]O)(C[6]N[6]2)	C[6](N[5]C[5,6]C[5])(N[6]C[6])2	C[5,6](C[5,6]C[5]C[6])(N[5]C[5]C[6])(C[6]C[6])	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>}	C[6](N[5]C[5,6]C[5])(N[6]C[6])2{1|O<2>,2|C<2>,2|C<3>}	C[5,6](C[5,6]C[5]C[6])(N[5]C[5]C[6])(C[6]C[6]){1|C<3>,1|O<1>,1|O<2>,2|N<2>}	128.9690	0.000	1	128.9690	0.000	1	128.9690	0.000	1	128.9690	0.000	1	129.9520	1.933	2	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5,6]	3:4:3:	3:3:2:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5]-3:C[6]-3:C[6]-2:	C[5,6]-3:N[5]-3:C[6]-2:	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]HH)(C[6]C[6]2)	C[6](N[5]C[5,6]C[5])(C[6]C[6]H)(C[6]C[6])	C[5,6](C[5,6]C[5]C[6])(N[5]C[5]C[6])(C[6]C[6])	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](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>}	C[5,6](C[5,6]C[5]C[6])(N[5]C[5]C[6])(C[6]C[6]){1|C<2>,2|C<3>,6|H<1>}	130.9350	0.000	1	130.9350	0.000	1	130.9350	0.000	1	130.9350	0.000	1	129.9520	1.933	2	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:2:	3:3:3:	3:2:1:	C[5]-3:C[6]-3:N[5]-2:	N[5]-3:C[6]-3:C[6]-3:	N[5]-3:C[5]-2:H-1:	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5])	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	C[5](N[5]C[6]N[5])(C[5]C[5])(H)	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](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5])(H){1|N<3>,2|C<3>}	128.0730	0.000	1	128.0730	0.000	1	128.0730	0.000	1	128.0730	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:2:	3:3:3:	3:3:1:	C[5]-3:C[6]-3:N[5]-2:	N[5]-3:C[6]-3:C[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5])	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	C[5](C[5]C[6]N[5])(N[5]C[6]N[5])(H)	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](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>}	C[5](C[5]C[6]N[5])(N[5]C[6]N[5])(H){1|C<4>,4|C<3>}	128.2420	0.000	1	128.2420	0.000	1	128.2420	0.000	1	128.2420	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:2:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	C[6](N[5]C[5]2)(N[6]C[6])2	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	C[6](N[5]C[5]2)(N[6]C[6])2{1|C<3>,2|H<1>,2|N<3>,2|O<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<4>,1|H<1>,2|N<2>}	126.2330	0.000	2	126.8770	0.553	4	126.8770	0.553	4	125.5143	2.791	8	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:2:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	C[6](N[5]C[5]2)(N[6]C[6])2	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<3>,1|H<1>,2|N<2>}	127.5210	0.000	2	126.8770	0.553	4	126.8770	0.553	4	125.5143	2.791	8	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:2:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	C[6](N[5]C[5]2)(N[6]C[6])2	C[5](N[5]C[5]C[6])(N[5]C[5]C)(H)	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>}	C[6](N[5]C[5]2)(N[6]C[6])2{1|C<3>,2|H<1>,2|N<3>,2|O<1>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(H){2|H<1>,2|N<2>}	125.0210	0.000	2	125.0210	0.000	2	124.1515	1.008	4	125.5143	2.791	8	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:2:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2)	C[6](N[5]C[5]2)(N[6]C[6])2	C[5](N[5]C[6a]C[5])(N[5]C[5]C[6])(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	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>}	C[5](N[5]C[6a]C[5])(N[5]C[5]C[6])(H){2|C<3>,2|H<1>,2|N<2>}	123.2820	0.000	2	123.2820	0.000	2	124.1515	1.008	4	125.5143	2.791	8	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:2:2:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-2:N[6]-2:	N[5]-3:C[5]-3:O-2:	N[5](C[5,6]C[5,6]C[6])(C[5]C[5]O)(C[6]N[6]2)	C[6](N[5]C[5,6]C[5])(N[6]C[6])2	C[5](N[5]C[5,6]C[6])(C[5]C[5,6]O)(OC)	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>}	C[6](N[5]C[5,6]C[5])(N[6]C[6])2{1|O<2>,2|C<2>,2|C<3>}	C[5](N[5]C[5,6]C[6])(C[5]C[5,6]O)(OC){2|C<2>,2|N<2>}	119.9510	0.000	1	119.9510	0.000	1	119.9510	0.000	1	119.9510	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:N[5]-3:C[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Ir)(N[5]C[5]2)(C[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]Ir)(N[5]C[5]2)(C[6]C[6]){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<2>,1|C<3>,1|C<4>}	132.6120	0.000	1	132.6120	0.000	1	132.6120	0.000	1	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]O)(C[6]N[6]2)	C[6](N[6]C[6]Cu)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<4>,1|N<2>,1|N<3>,1|O<2>}	123.8000	0.000	1	123.8000	0.000	1	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<4>,1|N<2>,1|N<3>}	129.6170	0.000	1	129.7515	0.036	2	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Ir)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<3>,1|N<2>,1|N<3>}	129.8860	0.000	1	129.7515	0.036	2	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<4>,1|N<2>,1|N<3>}	128.3480	1.411	8	128.1615	1.275	15	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Pd)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	N[5](C[5]N[5]Pd)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|N<2>,1|N<3>}	127.9484	0.742	7	128.1615	1.275	15	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Re)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Re)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	N[5](C[5]N[5]Re)(C[5]C[5]H)(C[6]N[6]2){1|H<1>,3|C<3>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Re<6>,1|C<3>,1|N<2>,1|N<3>}	128.2343	0.532	3	128.2343	0.283	3	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Rh)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<8>,1|C<4>,1|N<2>,1|N<3>}	129.3265	0.435	2	129.3265	0.189	2	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[6]C[6]Ru)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<4>,1|N<2>,1|N<3>}	129.1887	0.778	4	129.1887	0.605	4	128.3643	1.937	27	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](N[5]C[5]Pd)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	N[5](N[5]C[5]Pd)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]C[6]){3|C<3>,3|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Pd<4>,1|H<1>,1|N<2>,1|N<3>}	129.4450	0.000	1	129.4450	0.000	1	130.6434	1.583	7	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Rh)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	C[6](N[5]C[5]N[5])(N[6]C[6]Rh)(N[6]C[6]){3|C<3>,3|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Rh<6>,1|H<1>,1|N<2>,1|N<3>}	131.4830	0.298	2	131.4830	0.089	2	130.6434	1.583	7	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]N[6]2){2|C<3>,2|H<1>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(N[6]C[6]){3|C<3>,3|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ru<6>,1|H<1>,1|N<2>,1|N<3>}	130.5232	1.473	4	130.5232	2.168	4	130.6434	1.583	7	128.9415	3.018	35	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:2:	C[5]-3:C[5]-3:C[6]-3:	N[6]-3:N[5]-3:N[6]-2:	N[5]-3:N[5]-3:O-2:	N[5](C[5]C[5]H)(C[5]N[5]O)(C[6]N[6]2)	C[6](N[6]C[6]Cu)(N[5]C[5]2)(N[6]C[6])	C[5](N[5]C[5]C[6])(N[5]C[5]C)(OCu)	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>}	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>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(OCu){1|N<2>,1|N<3>,2|H<1>}	126.8870	0.000	1	126.8870	0.000	1	126.8870	0.000	1	126.8870	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	C[5]-3:C[6]-3:N[5]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](C[5]C[5]C)(C[6]N[6]2)(N[5]C[5]V)	C[6](N[5]C[5]N[5])(N[6]C[6]V)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|C<4>,1|N<2>,1|N<3>,1|V<7>}	132.0375	1.067	2	132.0375	1.139	2	132.0375	1.139	2	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Co<5>,1|C<4>,1|N<2>,1|N<3>}	131.8720	0.370	3	131.8720	0.137	3	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]N[6]Co)(N[6]N[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	C[6](N[5]C[5]N[5])(N[6]N[6]Co)(N[6]N[6]){1|C<4>,3|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Co<6>,1|C<4>,1|N<2>,1|N<3>}	131.9700	0.383	2	131.9700	0.147	2	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cu<5>,1|C<4>,1|N<2>,1|N<3>}	132.4410	0.134	2	131.5067	0.582	6	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Cu)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cu<6>,1|C<4>,1|N<2>,1|N<3>}	131.0395	0.301	4	131.5067	0.582	6	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]N[6]Fe)(N[6]N[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	C[6](N[5]C[5]N[5])(N[6]N[6]Fe)(N[6]N[6]){1|C<4>,3|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Fe<6>,1|C<4>,1|N<2>,1|N<3>}	132.7623	0.470	3	132.7623	0.221	3	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ni<6>,1|C<4>,1|N<2>,1|N<3>}	131.2215	0.401	2	131.5433	0.196	4	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(N[6]C[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ni<6>,1|C<4>,1|N<2>,1|N<3>}	131.8650	0.113	2	131.5433	0.196	4	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:2:	3:3:4:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:N[6]-2:	N[5]-3:C[5]-3:C-4:	N[5](N[5]C[5]Pd)(C[5]C[5]C)(C[6]N[6]2)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(N[6]P[6])	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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>}	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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Pd<4>,1|C<4>,1|N<2>,1|N<3>}	131.4530	0.219	2	131.4530	0.048	2	131.7981	0.436	20	131.8199	0.453	22	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[5]N[5]H)2(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]N[5])(H)	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]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>}	C[5](N[5]C[5]C[6])(N[5]N[5])(H){1|H<1>,3|C<3>}	128.8970	0.000	1	128.8970	0.000	1	128.8970	0.000	1	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]H)2(N[5]C[5]2)	C[5](N[5]C[5]C[6])(O[5]C[5])(O)	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]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	C[5](N[5]C[5]C[6])(O[5]C[5])(O){2|C<4>,3|C<3>}	122.8620	0.000	1	122.8620	0.000	1	122.8620	0.000	1	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]N[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]N[5])(H)	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](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>}	C[5](N[5]C[5]C[6])(N[5]N[5])(H){1|Ru<9>,1|N<3>,2|C<3>}	132.3950	0.000	1	132.3950	0.000	1	132.3950	0.000	1	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]N[5]H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(N[5]C[5])(H)	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](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>}	C[5](N[5]C[6]N[5])(N[5]C[5])(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<3>}	132.2515	0.408	2	132.2515	0.166	2	131.8657	0.502	6	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]N[5]H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(N[5]C[5])(H)	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](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>}	C[5](N[5]C[6]N[5])(N[5]C[5])(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<3>}	131.2885	0.556	2	131.2885	0.310	2	131.8657	0.502	6	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:2:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]N[5]H)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(N[5]C[5])(H)	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](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>}	C[5](N[5]C[6]N[5])(N[5]C[5])(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>}	132.0570	0.998	2	132.0570	0.997	2	131.8657	0.502	6	130.5942	9.765	9	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	C[5,6a]-3:N[5]-3:O-1:	N[5](C[5]C[5,6a]O)2(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O)	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]H)(C[6]N[6]H)(N[5]C[5]2){1|Pd<4>,1|H<1>,2|O<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O){1|H<1>,1|O<1>,4|C<3>}	124.0645	1.354	8	124.0645	1.834	8	124.0645	1.834	8	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]C)(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Ir)(C[6]N[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){2|C<3>,2|C<4>}	126.0640	0.000	1	126.0640	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Fe)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<8>,1|C<4>,2|C<3>}	121.6890	0.000	1	121.6890	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,3|C<3>}	132.0860	0.000	1	132.0860	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Ir)(C[6]N[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<6>,1|C<4>,2|C<3>}	133.8220	0.000	1	133.8220	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Pt)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]C)2(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]C)2(N[5]C[5]2){1|Pt<3>,1|H<1>,1|N<3>,2|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pt<3>,3|C<3>}	126.6030	0.205	2	126.6030	0.042	2	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]C)2(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]C)2(N[5]C[5]2){1|Rh<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<4>,3|C<3>}	119.6660	0.000	1	119.6660	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<6>,1|C<4>,2|C<3>}	124.1650	0.000	1	124.1650	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<6>,1|C<4>,2|C<3>}	132.5150	0.000	1	132.5490	0.002	2	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<8>,1|C<4>,2|C<3>}	132.5830	0.000	1	132.5490	0.002	2	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<7>,1|C<4>,2|C<3>}	134.8050	0.000	1	134.8050	0.000	1	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<9>,1|C<4>,2|C<3>}	132.9300	0.000	1	133.2215	0.170	2	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<9>,3|C<3>}	133.5130	0.000	1	133.2215	0.170	2	129.0034	25.965	13	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:O-1:	N[5](C[5]C[5]O)2(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]C[5]H)(O)	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]H)(C[6]N[6]H)(N[5]C[5]2){1|Re<6>,1|H<1>,2|O<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]C[5]H)(O){1|H<1>,1|O<1>,2|C<3>}	125.3675	0.967	2	125.3675	0.934	2	125.3675	0.934	2	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]H)2(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	C[5](N[5]C[6a]N[5])(N[5]C[5]C[6])(H)	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]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>}	C[5](N[5]C[6a]N[5])(N[5]C[5]C[6])(H){1|H<1>,4|C<3>}	125.3430	0.000	1	125.3430	0.000	1	125.3430	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	C[6,6a]-3:N[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6,6a]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]N[6]Ru)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	133.0570	0.000	1	133.0570	0.000	1	133.0570	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]C[6]H)(N[5]C[5]2)(N[6]C[6]H){2|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<3>,1|N<3>,2|H<1>}	123.3240	0.000	1	123.3240	0.000	1	128.2174	7.545	5	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]V)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]V)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]C[6]H)(N[5]C[5]2)(N[6]C[6]V){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|N<3>,1|V<6>,2|C<3>}	129.4408	0.289	4	129.4408	0.083	4	128.2174	7.545	5	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[6]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	C[5](N[5]C[5]C[6])(N[5]C[5]H)(H)	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]C[6]H)(N[5]C[5]2)(N[6]C[6]H){2|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(N[5]C[5]H)(H){1|C<3>,1|N<3>,2|H<1>}	128.3950	0.000	1	128.3950	0.000	1	128.3950	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	C[6]-3:N[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	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])(N[6]C[6,6]Ru)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]C[6a]C[6])(N[6]C[6,6]Ru)(N[5]C[5]2){2|H<1>,2|N<3>,4|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>}	130.4550	0.000	1	130.4550	0.000	1	130.4550	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[5,6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	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)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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>}	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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<3>,1|C<4>,1|N<3>}	135.9550	0.000	1	135.9550	0.000	1	135.9550	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	127.7850	0.000	1	127.7850	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]W)	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<3>,1|C<4>,1|N<3>,1|W<6>}	128.5730	0.000	1	128.5730	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ba)(C[5]C[5]H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ba<7>,1|N<3>,2|C<3>}	123.5740	0.412	2	123.5740	0.169	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ca)(C[5]C[5]H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ca<6>,1|N<3>,2|C<3>}	126.2145	0.483	6	126.2145	0.234	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Cr)(C[5]C[5]H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Cr<4>,1|N<3>,2|C<3>}	129.6950	0.000	2	129.6950	0.000	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Cu<3>,1|C<3>,1|C<4>,1|N<3>}	124.8380	0.393	2	124.4207	0.803	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Cu<3>,1|N<3>,2|C<3>}	123.3495	0.059	2	124.4207	0.803	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Cu<2>,1|N<3>,2|C<3>}	125.0745	0.600	2	124.4207	0.803	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Cu<3>,1|N<3>,2|C<3>}	122.6290	0.000	1	122.6290	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<5>,1|C<3>,1|C<4>,1|N<3>}	130.9670	0.000	1	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>}	132.0045	1.554	8	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>}	127.2707	0.457	7	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<5>,1|N<3>,2|C<3>}	130.5455	0.894	4	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<5>,1|N<3>,2|C<3>}	131.6747	0.315	4	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Fe)(C[5]C[5]H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Fe<6>,1|N<3>,2|C<3>}	129.7990	0.000	1	130.2631	4.867	25	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<4>,1|N<3>,2|C<3>}	132.6360	0.000	1	131.6373	0.755	3	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<7>,1|N<3>,2|C<3>}	131.1380	0.117	2	131.6373	0.755	3	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>}	129.3400	0.000	1	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<3>,1|C<4>,1|N<3>}	129.9423	0.627	3	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>}	129.6370	0.000	1	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<8>,1|C<3>,1|C<4>,1|N<3>}	130.5710	0.000	1	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){2|Ir<6>,1|C<3>,1|N<3>}	131.8390	0.000	1	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ir)(C[5]C[5]H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>}	130.4460	1.141	2	130.2340	0.785	9	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Li)(C[5]C[5]H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Li<4>,1|N<3>,2|C<3>}	125.7810	0.198	2	125.7810	0.039	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Mn)(C[5]C[5]H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Mn<6>,1|C<3>,1|C<4>,1|N<3>}	129.7727	0.734	3	129.7727	0.539	3	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ni)(C[5]C[5]H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ni<6>,1|N<3>,2|C<3>}	126.9800	0.000	1	126.9800	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Os)(C[5]C[5]H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Os<9>,1|C<3>,1|C<4>,1|N<3>}	130.5110	0.000	1	130.5110	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	127.9120	0.451	2	127.9120	0.204	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	131.9980	0.000	1	128.2965	27.402	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	124.5950	0.000	1	128.2965	27.402	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|N<3>,2|C<3>}	130.6510	0.000	1	131.0815	0.371	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	131.5120	0.000	1	131.0815	0.371	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	128.5790	0.000	1	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	129.4877	0.406	3	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	128.8200	1.375	6	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	127.6355	0.339	2	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|N<3>,2|C<3>}	128.1396	0.852	7	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|N<3>,2|C<3>}	128.3910	0.000	1	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|N<3>,2|C<3>}	128.4690	0.000	2	128.5245	0.962	22	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Pd)(C[5]C[5]H)	C[6](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>}	129.4990	0.000	1	129.4990	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Re<6>,1|N<3>,2|C<3>}	129.8608	0.546	5	129.8608	0.298	5	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|N<3>}	128.7935	1.004	4	128.5052	0.878	8	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Re)(C[5]C[5]H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Re<6>,1|N<3>,2|C<3>}	128.2170	0.905	4	128.5052	0.878	8	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<8>,1|C<3>,1|C<4>,1|N<3>}	130.3950	0.000	1	130.3950	0.000	1	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<5>,1|C<3>,1|C<4>,1|N<3>}	133.1660	0.522	2	132.7382	2.908	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<6>,1|C<3>,1|C<4>,1|N<3>}	133.5037	1.051	3	132.7382	2.908	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Rh)(C[5]C[5]H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Rh<8>,1|C<3>,1|C<4>,1|N<3>}	129.5860	0.000	1	132.7382	2.908	6	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>}	129.2900	0.000	1	129.9812	0.435	4	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	130.2117	0.578	3	129.9812	0.435	4	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	129.5612	0.440	5	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	129.0770	0.030	2	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|H<1>,2|N<3>,3|C<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	129.8165	0.548	4	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	130.0800	1.694	8	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<9>,1|C<3>,1|C<4>,1|N<3>}	130.4560	0.144	2	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	128.2568	1.541	26	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<9>,1|C<3>,1|C<4>,1|N<3>}	129.5720	0.000	1	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<9>,1|N<3>,2|C<3>}	130.4110	0.000	1	129.0090	2.409	49	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Sr)(C[5]C[5]H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Sr<7>,1|N<3>,2|C<3>}	123.4575	0.292	2	123.4575	0.085	2	128.9543	5.239	167	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]C[5]H)(C[5]N[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]C[5]C)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|N<3>,3|H<1>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(H){1|C<3>,1|N<3>,2|H<1>}	123.3170	0.000	1	123.3170	0.000	1	123.3170	0.000	1	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	C[5](C[5]C[6a]C[5])(N[5]C[6]N[5])(H)	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](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	C[5](C[5]C[6a]C[5])(N[5]C[6]N[5])(H){1|Ru<8>,1|H<1>,1|N<3>,3|C<3>}	132.6580	0.000	1	132.6580	0.000	1	132.5577	0.444	6	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Ir)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	C[5](C[5]C[6]N[5])(N[5]C[6]N[5])(H)	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](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>}	C[5](C[5]C[6]N[5])(N[5]C[6]N[5])(H){1|Ir<8>,2|C<3>,2|N<3>}	132.4280	0.000	1	132.4280	0.000	1	132.5577	0.444	6	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	C[5](C[5]C[6a]N[5])(N[5]C[6]N[5])(H)	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](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>}	C[5](C[5]C[6a]N[5])(N[5]C[6]N[5])(H){1|Pd<4>,1|N<3>,3|C<3>}	132.4567	1.013	3	132.4567	1.026	3	132.5577	0.444	6	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	C[5](C[5]C[6a]N[5])(N[5]C[6]N[5])(H)	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](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>}	C[5](C[5]C[6a]N[5])(N[5]C[6]N[5])(H){1|Re<6>,1|N<3>,3|C<3>}	132.8900	0.000	1	132.8900	0.000	1	132.5577	0.444	6	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>}	130.5785	0.402	2	130.2632	0.157	5	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>}	130.0530	0.259	3	130.2632	0.157	5	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Cu<4>,1|C<3>,1|C<4>,1|N<3>}	128.7790	0.000	1	129.6434	0.572	7	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>}	129.5295	0.510	2	129.6434	0.572	7	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Cu<6>,1|N<3>,2|C<3>}	129.9165	0.837	4	129.6434	0.572	7	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]C)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]C)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	131.8638	0.734	4	131.8638	0.539	4	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>}	130.0365	0.499	8	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>}	132.9650	0.559	2	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	133.0356	0.845	15	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	129.6530	0.180	2	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	130.6673	0.895	18	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	131.6290	1.098	28	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	131.7293	1.003	113	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	130.6807	0.565	4	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	132.8367	0.148	4	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	130.0755	0.419	4	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	131.6421	1.094	26	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>}	131.6322	2.525	4	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|N<3>,2|C<3>}	131.0670	1.915	6	131.5987	1.458	234	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>}	130.7640	0.000	1	130.7245	0.003	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ir)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ir<6>,1|N<3>,2|C<3>}	130.6850	0.000	1	130.7245	0.003	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<3>}	130.3400	0.000	1	130.3400	0.000	1	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>}	130.5917	1.353	3	130.5917	1.832	3	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<3>}	129.7370	0.000	1	130.4610	1.048	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Pd)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<3>}	131.1850	0.000	1	130.4610	1.048	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Re)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H){2|H<1>,3|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>}	130.2190	0.775	2	130.2190	0.601	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>}	130.5072	0.349	4	130.0922	0.429	12	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>}	129.5865	0.715	2	130.0922	0.429	12	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<3>}	130.3980	0.686	2	130.0922	0.429	12	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Zn<6>,1|N<3>,2|C<3>}	129.7770	0.728	4	130.0922	0.429	12	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Pd)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H){1|Pd<4>,1|C<3>,1|N<3>}	133.1395	1.133	2	133.1395	1.285	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Re)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H){1|Re<6>,1|C<3>,1|N<3>}	131.6680	0.000	1	131.6680	0.000	1	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]N[5]Ru)(C[5]C[5]H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]N[5]C)(H){1|Ru<6>,1|C<3>,1|N<3>}	132.4510	0.471	2	132.4510	0.222	2	131.4413	1.565	277	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<3>}	131.5900	0.028	2	132.2170	1.180	3	132.2730	1.207	7	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Cu<5>,1|C<3>,2|N<3>}	133.4710	0.000	1	132.2170	1.180	3	132.2730	1.207	7	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]H)	C[6](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>}	130.6440	0.000	1	130.6440	0.000	1	132.2730	1.207	7	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]2)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]2){2|H<1>,6|C<3>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>}	133.2830	0.358	2	133.2830	0.128	2	132.2730	1.207	7	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>}	132.0500	0.000	1	132.0500	0.000	1	132.2730	1.207	7	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:C[6]-3:C[6]-3:	N[5]-3:C[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(C[6]C[6]2)	C[6](N[5]C[5]N[5])(C[6]C[6]Ru)(C[6]C[6]O)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(H){1|Ru<6>,1|H<1>,2|C<3>}	134.6585	0.238	2	134.6585	0.057	2	134.6585	0.057	2	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:C[6]-3:	N[5]-3:N[6]-3:C[6]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](N[5]C[5,6a]Fe)(C[5]C[5,6a]H)(C[6]C[6]N[6])	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6]N[5])(H)	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](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>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6]N[5])(H){1|Fe<6>,1|H<1>,1|N<3>,3|C<3>}	131.4572	0.390	4	131.4572	0.152	4	131.4572	0.152	4	130.3801	5.944	497	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:2:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[6]-3:N[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]H)2(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[6]C[6]2)(N[5]N[5])	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]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>}	C[5](N[5]C[5]C[6])(C[6]C[6]2)(N[5]N[5]){1|Pt<4>,1|C<2>,2|H<1>,4|C<3>}	127.6480	0.000	1	127.6480	0.000	1	127.6480	0.000	1	127.6480	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]H)(C[5]N[5]C)(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CIrHH)	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]Ir)(C[6]N[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CIrHH){2|C<3>,2|H<1>}	124.7300	0.000	1	124.7300	0.000	1	124.7300	0.000	1	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CH3)	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](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>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CH3){1|Rh<8>,1|C<3>,1|H<1>,1|N<3>}	129.6780	0.000	1	129.6780	0.000	1	131.2383	2.506	3	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:	N[5](C[6]C[6]N[6])(C[5]C[5]Rh)(C[5]N[5]C)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CH3)	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](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>}	C[5](N[5]C[5]C[6])(N[5]C[5]C)(CH3){1|Rh<8>,1|C<3>,1|H<1>,1|N<3>}	131.1940	0.000	1	131.1940	0.000	1	131.2383	2.506	3	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(C[5]N[5]C)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(N[5]C[5]Ru)(CH3)	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](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>}	C[5](N[5]C[5]C[6])(N[5]C[5]Ru)(CH3){1|Ru<6>,1|C<3>,1|H<1>,1|N<3>}	132.8430	0.000	1	132.8430	0.000	1	131.2383	2.506	3	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Al)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Al)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Al<5>,1|C<3>,1|C<4>,1|N<3>}	133.0490	0.000	1	133.0490	0.000	1	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cd<6>,1|C<3>,1|C<4>,1|N<3>}	131.6330	0.566	2	131.6330	0.320	2	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CCCH)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CCCH){1|Co<5>,1|C<3>,1|C<4>,1|N<3>}	130.7600	0.000	1	130.7600	0.000	1	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Co)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Co<5>,1|C<3>,1|C<4>,1|N<3>}	131.8284	0.840	5	131.8284	0.706	5	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cr)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Cr)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cr<6>,1|C<3>,1|C<4>,1|N<3>}	132.4940	0.313	2	132.4940	0.098	2	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cu<6>,1|C<3>,1|C<4>,1|N<3>}	132.0885	0.357	2	132.5068	0.356	4	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cu<6>,1|C<3>,1|C<4>,1|N<3>}	132.9250	0.491	2	132.5068	0.356	4	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Fe)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>}	133.3735	0.175	2	133.3735	0.031	2	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Mn)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Mn<6>,1|C<3>,1|C<4>,1|N<3>}	132.1935	0.589	2	132.1935	0.347	2	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6,6]Ni)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ni<6>,1|C<3>,1|C<4>,1|N<3>}	132.2103	0.381	3	132.2103	0.145	3	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ni<6>,1|C<3>,1|C<4>,1|N<3>}	131.9710	0.571	4	132.2903	0.304	9	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ni)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ni<6>,1|C<3>,1|C<4>,1|N<3>}	132.5458	0.423	5	132.2903	0.304	9	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>}	132.1580	0.000	1	131.9066	0.192	8	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	131.8707	0.460	7	131.9066	0.192	8	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Sm)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Sm<14>,1|C<3>,1|C<4>,1|N<3>}	130.4510	0.000	1	130.4510	0.000	1	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Zn<4>,1|C<3>,1|C<4>,1|N<3>}	131.8385	1.148	2	131.1565	2.252	4	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Zn<5>,1|C<3>,1|C<4>,1|N<3>}	131.8120	0.000	1	131.1565	2.252	4	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Zn<5>,1|C<3>,1|C<4>,1|N<3>}	129.1370	0.000	1	131.1565	2.252	4	132.0441	0.699	44	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cd<5>,1|C<3>,1|C<4>,1|N<3>}	133.0973	0.223	3	132.8246	0.187	5	132.9057	0.189	6	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cd)(C[5]C[5]C)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cd<6>,1|C<3>,1|C<4>,1|N<3>}	132.4155	0.302	2	132.8246	0.187	5	132.9057	0.189	6	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Zn)(C[5]C[5]C)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Zn<4>,1|C<3>,1|C<4>,1|N<3>}	133.3110	0.000	1	133.3110	0.000	1	132.9057	0.189	6	131.9596	1.802	54	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:4:3:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-4:C-3:	N[5](C[5]C[5]C)(C[5]O[5]O)(C[6]C[6]2)	C[6](C[6]C[6]H)2(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]O[5]CC)(CHH)	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]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	C[5](N[5]C[5]C[6])(C[5]O[5]CC)(CHH){1|O<1>,2|C<3>}	125.9080	0.000	1	125.9080	0.000	1	125.9080	0.000	1	125.9080	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	4:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	C[5,6,6]-4:N[5]-3:O-1:	N[5](C[5]C[5,6,6]O)2(C[6]C[6]2)	C[6](C[6]C[6]H)2(N[5]C[5]2)	C[5](C[5,6,6]C[5,6,6]C[3x6]H)(N[5]C[5]C[6])(O)	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]H)2(N[5]C[5]2){1|N<3>,2|C<4>,2|H<1>,2|O<1>}	C[5](C[5,6,6]C[5,6,6]C[3x6]H)(N[5]C[5]C[6])(O){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	124.1605	0.175	2	124.1605	0.031	2	124.1605	0.031	2	124.1605	0.031	2	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:4:3:	3:2:1:	C[5,6a]-3:C[5]-3:C[6]-3:	N[5]-3:C[6]-4:C[6]-3:	N[5]-3:N[5]-2:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(C[6]C[6]2)	C[6](N[5]C[5,6a]C[5])(C[6]C[6]HH)(C[6]C[6]H)	C[5](N[5]C[5,6a]C[6])(N[5]C[5,6a])(O)	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](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>}	C[5](N[5]C[5,6a]C[6])(N[5]C[5,6a])(O){1|C<4>,3|C<3>}	122.9540	0.000	1	122.9540	0.000	1	122.9540	0.000	1	122.9540	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:4:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-4:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Cu)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu2)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Cu<4>,1|C<3>,1|C<4>,1|N<4>}	130.5340	0.559	2	130.5340	0.312	2	130.8423	0.441	3	130.8423	0.441	3	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:4:3:	3:3:4:	C[6]-3:N[5]-3:C[5]-3:	N[5]-3:N[6]-4:C[6]-3:	N[5]-3:C[5]-3:C-4:	N[5](C[6]C[6]N[6])(N[5]C[5]Ru)(C[5]C[5]C)	C[6](N[5]C[5]N[5])(N[6]C[6]RuB)(C[6]C[6]H)	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3)	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](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>}	C[5](N[5]C[6]N[5])(C[5]C[5]H)(CH3){1|Ru<7>,1|C<3>,1|C<4>,1|N<4>}	131.4590	0.000	1	131.4590	0.000	1	130.8423	0.441	3	130.8423	0.441	3	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	4:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	C[5,6a]-3:N[5]-3:O-1:	N[5](C[5]C[5,6a]O)2(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]O)(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O)	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]HH)(C[6]N[6]O)(N[5]C[5]2){2|O<1>,3|C<3>,3|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	123.0307	4.186	4	123.0307	17.525	4	123.0307	17.525	4	123.1786	3.533	17	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	4:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]P)(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]RuC)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,1|P<4>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|C<4>,1|P<4>,2|C<3>}	124.7790	0.000	1	124.7790	0.000	1	123.2241	0.319	13	123.1786	3.533	17	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	4:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Er)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]ErN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Er<10>,1|C<3>,2|C<4>}	123.1135	0.401	4	123.1135	0.161	4	123.2241	0.319	13	123.1786	3.533	17	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	4:3:3:	3:3:1:	C[5]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[5]N[5]Yb)(C[5]C[5]H)(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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]YbN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Yb<10>,1|C<3>,2|C<4>}	123.0850	0.323	8	123.0850	0.104	8	123.2241	0.319	13	123.1786	3.533	17	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	4:3:3:	3:3:4:	C[5]-3:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:N[5]-3:P-4:	N[5](C[5]C[5]H)(C[5]N[5]P)(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(N[5]C[5]2)	C[5](N[5]C[6a]C[5])(N[5]C[5]C[6])(PC[6a]RuC)	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]RuC)(C[6]C[6]C)(N[5]C[5]2){1|N<3>,1|P<4>,2|C<3>,3|H<1>}	C[5](N[5]C[6a]C[5])(N[5]C[5]C[6])(PC[6a]RuC){1|C<4>,2|H<1>,3|C<3>}	124.5590	0.000	1	124.5590	0.000	1	124.5590	0.000	1	124.5590	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:4:3:	3:3:2:	3:2:1:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:N[5]-3:O[6]-2:	N[5]-3:O[5]-2:O-1:	N[5](C[6]C[6]O[6])(C[5]C[5]CH)(C[5]O[5]O)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	C[5](N[5]C[5]C[6])(O[5]C[5])(O)	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[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>}	C[5](N[5]C[5]C[6])(O[5]C[5])(O){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	122.8240	0.000	1	122.8240	0.000	1	122.8495	0.001	2	122.8495	0.001	2	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:4:3:	3:3:2:	3:2:1:	C[6]-3:C[5]-4:C[5]-3:	C[6]-3:N[5]-3:O[6]-2:	N[5]-3:O[5]-2:O-1:	N[5](C[6]C[6]O[6])(C[5]C[5]HH)(C[5]O[5]O)	C[6](C[6]C[5,6]C[6a])(N[5]C[5]2)(O[6]C[6])	C[5](N[5]C[5]C[6])(O[5]C[5])(O)	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[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>}	C[5](N[5]C[5]C[6])(O[5]C[5])(O){1|C<3>,1|O<2>,4|H<1>}	122.8750	0.000	1	122.8750	0.000	1	122.8495	0.001	2	122.8495	0.001	2	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	3:4:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-4:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]PdC)(C[5]C[5]H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](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>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	127.7190	0.000	2	127.7190	0.000	2	127.7190	0.000	2	127.7190	0.000	2	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	4:3:3:	3:3:3:	3:2:1:	C[5]-4:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	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]Br)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(O[5]C[5])(O)	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]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>}	C[5](N[5]C[5]C[6])(O[5]C[5])(O){3|C<3>,3|H<1>}	123.7260	0.000	1	123.7260	0.000	1	123.7260	0.000	1	123.7260	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP2_SP2_SP2	N[5]	C[6]	C[5]	4:3:3:	4:3:3:	3:2:1:	C[5]-4:C[5]-3:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	N[5]-3:O[5]-2:O-1:	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]CH)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(O[5]C[5])(O)	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]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>}	C[5](N[5]C[5]C[6])(O[5]C[5])(O){1|C<4>,2|C<3>,3|H<1>}	126.7890	0.000	1	126.7890	0.000	1	126.7890	0.000	1	126.7890	0.000	1	130.1179	7.727	661	129.9522	8.318	739
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:1:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<3>,2|C<4>,2|H<1>}	122.7190	0.000	1	122.7190	0.000	1	122.7190	0.000	1	122.7190	0.000	1	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:3:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(CC[6a]H)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](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>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<4>,2|C<3>,2|H<1>}	122.3360	0.000	1	122.3360	0.000	1	123.1520	1.332	2	123.1520	1.332	2	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	3:3:3:	3:3:3:	3:4:1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-4:O-1:	N[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]C)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO)	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O)	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](N[5,6]N[5,6]C[5])(C[6]C[6]O)(COO){1|O<1>,2|H<1>,3|C<4>}	C[5](N[5,6]N[5,6]C[6])(C[5]C[5]HH)(O){1|C<4>,2|C<3>,2|H<1>}	123.9680	0.000	1	123.9680	0.000	1	123.1520	1.332	2	123.1520	1.332	2	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:2:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:N[6]-3:O-1:	N[5,6]-3:N[5]-2:H-1:	N[5,6](C[5,6]C[6,6a]C[5]C)(C[5]N[5]H)(C[6]N[6]O)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6,6a]C)(O)	C[5](N[5,6]C[5,6]C[6])(N[5]C[5])(H)	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>}	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>}	C[5](N[5,6]C[5,6]C[6])(N[5]C[5])(H){1|C<4>,1|N<3>,1|O<1>,3|C<3>}	120.2840	0.000	1	120.2840	0.000	1	120.2840	0.000	1	120.2840	0.000	1	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:3:	C[5,5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6a]-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)	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,5,6]C[6])(C[5]C[5,5]C[6a])(C[6a]C[6a]2)	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](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[5](N[5,6]C[5,5,6]C[6])(C[5]C[5,5]C[6a])(C[6a]C[6a]2){1|C<4>,1|O<2>,3|H<1>,7|C<3>}	126.6470	0.000	1	126.6470	0.000	1	126.6470	0.000	1	126.0260	0.771	2	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	3:3:3:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[5]-3:	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	C[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(C[5]C[5]H){1|C<4>,1|O<1>,3|H<1>,4|C<3>}	125.4050	0.000	1	125.4050	0.000	1	125.4050	0.000	1	126.0260	0.771	2	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:3:1:	4:3:1:	C[5,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-1:	C[5]-4:N[5,6]-3:O-1:	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](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	C[5](C[5]C[5,5]C[6a]C)(N[5,6]C[5,6]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){8|C<3>}	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>}	C[5](C[5]C[5,5]C[6a]C)(N[5,6]C[5,6]C[6])(O){1|O<1>,1|O<2>,6|C<3>}	123.2380	0.000	1	123.2380	0.000	1	123.2380	0.000	1	123.2380	0.000	1	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5,6]	C[6]	C[5]	4:3:3:	3:4:1:	3:2:1:	C[5,6,6]-4:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:O[5]-2:O-1:	N[5,6](C[5,6,6]C[6,6]C[5]C[6])(C[5]O[5]O)(C[6]C[6]O)	C[6](N[5,6]C[5,6,6]C[5])(C[6]C[6]HH)(O)	C[5](N[5,6]C[5,6,6]C[6])(O[5]C[5])(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){1|C<3>,2|C<4>,7|H<1>}	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>}	C[5](N[5,6]C[5,6,6]C[6])(O[5]C[5])(O){1|O<1>,2|H<1>,3|C<4>}	119.2850	0.000	1	119.2850	0.000	1	119.2850	0.000	1	119.2850	0.000	1	122.9853	5.968	8	124.6076	11.924	11
542	762	818	0:SP3_SP2_SP2	N[5]	C[6]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[6]-3:C[5]-3:C[5]-3:	N[6]-3:C[6]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](C[6]C[6]N[6])(C[5]N[5]Ru)(C[5]C[5]H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H)	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](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	C[5](N[5]C[5]C[6])(C[5]N[5]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>}	128.9340	0.355	3	128.9340	0.126	3	128.9340	0.126	3	128.9340	0.126	3	128.9340	0.126	3	124.6076	11.924	11
542	762	818	6:SP2_SP2_SP2	N[5,6,6]	C[6,6]	C[5,6]	4:3:3:	3:4:3:	3:4:3:	C[5,6,6]-4:C[5,6]-3:C[6,6]-3:	N[5,6,6]-3:C[6]-4:C[6]-3:	N[5,6,6]-3:C[5]-4:C[6]-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)	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)	C[5,6](N[5,6,6]C[5,6,6]C[6,6])(C[5]C[5,6]HH)(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){6|C<3>,7|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){1|H<1>,1|N<3>,1|O<1>,2|C<4>,6|C<3>}	C[5,6](N[5,6,6]C[5,6,6]C[6,6])(C[5]C[5,6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	124.5270	0.000	1	124.5270	0.000	1	124.5270	0.000	1	124.5270	0.000	1	124.5270	0.000	1	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[3x6]	C[5,6]	3:3:4:	4:3:3:	3:3:4:	C[3x6]-3:C[5,6]-3:C[5]-4:	C[4x6]-4:N[5,6]-3:C[6,6]-3:	C[6]-3:N[5,6]-3:C[5]-4:	N[5,6](C[3x6]C[4x6]C[6,6])(C[5,6]C[5]C[6])(C[5]C[5]CC)	C[3x6](C[4x6]C[6,6]P[3x6]C)(N[5,6]C[5,6]C[5])(C[6,6]C[3x6]C)	C[5,6](C[6]C[3x6]P[3x6])(N[5,6]C[3x6]C[5])(C[5]C[5]CC)	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[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>}	C[5,6](C[6]C[3x6]P[3x6])(N[5,6]C[3x6]C[5])(C[5]C[5]CC){1|C<3>,2|H<1>,7|C<4>}	116.3230	0.000	1	116.3230	0.000	1	116.3230	0.000	1	116.2895	0.002	2	116.2895	0.002	2	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[3x6]	C[5,6]	3:3:4:	4:3:3:	3:3:4:	C[3x6]-3:C[5,6]-3:C[5]-4:	C[4x6]-4:N[5,6]-3:C[6,6]-3:	N[5,6]-3:C[6]-3:C[5]-4:	N[5,6](C[3x6]C[4x6]C[6,6])(C[5,6]C[5]C[6])(C[5]C[5]CC)	C[3x6](C[4x6]C[6,6]P[3x6]C)(N[5,6]C[5,6]C[5])(C[6,6]C[3x6]C)	C[5,6](N[5,6]C[3x6]C[5])(C[6]P[3x6]C)(C[5]C[5]CC)	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[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>}	C[5,6](N[5,6]C[3x6]C[5])(C[6]P[3x6]C)(C[5]C[5]CC){1|C<3>,2|H<1>,4|C<4>}	116.2560	0.000	1	116.2560	0.000	1	116.2560	0.000	1	116.2895	0.002	2	116.2895	0.002	2	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:3:	3:3:3:	3:3:3:	C[6,6]-3:C[5,6]-3:C[5]-3:	N[5,6]-3:C[6,6]-3:N[6]-3:	N[5,6]-3:C[6]-3:N[5]-3:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Ir)	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6a]C[6])(N[5]C[5]Ir)	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6a]C[6])(N[5]C[5]Ir){1|Ir<8>,1|N<3>,2|H<1>,3|C<3>}	125.6490	0.000	1	125.6490	0.000	1	125.5995	0.533	4	125.5995	0.533	4	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:3:	3:3:3:	3:3:3:	C[6,6]-3:C[5,6]-3:C[5]-3:	N[5,6]-3:C[6,6]-3:N[6]-3:	N[5,6]-3:C[6]-3:N[5]-3:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(N[6]C[6]Pd)	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6a]C[6])(N[5]C[5]Pd)	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6a]C[6])(N[5]C[5]Pd){1|Pd<4>,1|H<1>,1|H<2>,1|N<3>,3|C<3>}	125.5830	0.893	3	125.5830	0.797	3	125.5995	0.533	4	125.5995	0.533	4	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:3:	3:3:3:	3:4:3:	C[6,6]-3:C[5,6]-3:C[5]-3:	N[5,6]-3:C[6,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:N[5]-3:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]O[6])(C[6]C[6]O)	C[5,6](N[5,6]C[6,6]C[5])(C[6]O[6]HH)(N[5]C[5]C)	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]O[6]HH)(N[5]C[5]C){2|C<3>,2|H<1>}	119.9010	0.000	1	119.9010	0.000	1	119.9010	0.000	1	119.9010	0.000	1	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:3:	4:3:3:	3:3:2:	C[6,6]-3:C[5,6]-3:C[5]-3:	C[5,6,6]-4:N[5,6]-3:C[6]-3:	N[5,6]-3:N[5]-3:N[6]-2:	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[6,6](C[5,6,6]Si[5,6]C[5,6]C)(N[5,6]C[5,6]C[5])(C[6]C[6]C)	C[5,6](N[5,6]C[6,6]C[5])(N[5]C[6a]C[5])(N[6]Si[5,6])	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[6,6](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>}	C[5,6](N[5,6]C[6,6]C[5])(N[5]C[6a]C[5])(N[6]Si[5,6]){1|C<4>,1|N<2>,1|O<2>,2|H<1>,3|C<3>}	123.7790	0.000	1	123.7790	0.000	1	123.7790	0.000	1	123.7790	0.000	1	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:4:	3:3:3:	3:3:3:	C[6,6]-3:C[5,6]-3:C[5]-4:	N[5,6]-3:C[6]-3:C[6,6]-3:	N[5,6]-3:C[6]-3:N[5]-3:	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]O)(C[6,6]C[6]2)	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(N[5]C[5]H)	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(N[5]C[5]H){3|C<3>,5|H<1>}	119.8500	0.000	2	119.8500	0.000	2	119.8500	0.000	2	119.8500	0.000	2	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:4:	3:3:4:	3:3:2:	C[6,6]-3:C[5,6]-3:C[5]-4:	N[5,6]-3:C[6,6]-3:C[6]-4:	N[5,6]-3:C[6]-3:S[5]-2:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH)	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(S[5]C[5])	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(S[5]C[5]){1|C<4>,2|C<3>,5|H<1>}	120.1853	0.549	3	120.1853	0.302	3	120.1853	0.302	3	120.1853	0.302	3	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6,6]	C[5,6]	3:3:4:	3:3:4:	3:3:3:	C[6,6]-3:C[5,6]-3:C[5]-4:	N[5,6]-3:C[6,6]-3:C[6]-4:	N[5,6]-3:C[6]-3:N[5]-3:	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](N[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]C[6]HH)	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(N[5]C[5]H)	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](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>}	C[5,6](N[5,6]C[6,6]C[5])(C[6]C[6]C)(N[5]C[5]H){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	120.7690	0.000	2	120.7690	0.000	2	120.7690	0.000	2	120.7690	0.000	2	122.1440	6.957	13	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:2:3:	3:3:1:	3:3:3:	C[5,6]-3:Ge[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H){3|C<3>,3|H<1>}	120.1570	0.204	2	120.1570	0.041	2	120.1570	0.041	2	119.7025	0.289	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:2:3:	3:3:1:	3:3:3:	C[5,6]-3:P[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>}	119.2480	0.000	2	119.2480	0.000	2	119.2480	0.000	2	119.7025	0.289	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:2:3:	3:3:3:	3:3:2:	C[5,6]-3:O[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	C[6,6a]-3:N[5,6]-3:O[5]-2:	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO)	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[6]O[5])(O[5]In[3x5])	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](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO){1|In<6>,1|O<2>,2|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[6]O[5])(O[5]In[3x5]){1|H<1>,4|C<3>,4|O<2>}	123.9040	0.000	1	123.9040	0.000	1	123.9040	0.000	1	123.9040	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:2:1:	3:2:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-2:C-1:	N[5,6]-3:N[5]-2:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(C)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5])(N[6]C[6])	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|C<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(C){1|C<1>,1|C<2>,2|N<2>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5])(N[6]C[6]){1|C<2>,2|C<1>}	122.6300	0.000	1	122.6300	0.000	1	122.6300	0.000	1	123.7595	2.552	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:2:1:	3:2:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-2:O-1:	N[5,6]-3:N[5]-2:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(O)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5])(N[6]C[6])	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){1|C<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(O){1|C<1>,1|C<2>,2|N<2>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5])(N[6]C[6]){1|C<1>,1|C<2>,1|O<1>}	124.8890	0.000	1	124.8890	0.000	1	124.8890	0.000	1	123.7595	2.552	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cd)(N[6]C[6])	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cd)(N[6]C[6]){1|C<3>,3|H<1>}	121.7260	0.000	1	121.7260	0.000	1	121.6406	0.020	9	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Co)(N[6]C[6])	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Co)(N[6]C[6]){1|C<3>,3|H<1>}	121.7110	0.000	1	121.7110	0.000	1	121.6406	0.020	9	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6])	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6]){1|C<3>,3|H<1>}	121.7550	0.197	2	121.7550	0.039	2	121.6406	0.020	9	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Mn)(N[6]C[6])	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Mn)(N[6]C[6]){1|C<3>,3|H<1>}	121.4590	0.000	1	121.4590	0.000	1	121.6406	0.020	9	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6])	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6]){1|C<3>,3|H<1>}	121.5897	0.112	4	121.5897	0.013	4	121.6406	0.020	9	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	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](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	C[5,6](N[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>}	125.6610	0.000	1	125.2470	0.343	2	125.2470	0.343	2	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	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](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	C[5,6](N[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>}	124.8330	0.000	1	125.2470	0.343	2	125.2470	0.343	2	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:S[5]-2:	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]Ge[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(S[5]Ge[5])	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](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|S<2>}	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(S[5]Ge[5]){1|C<3>,2|H<1>}	122.7520	0.000	1	122.7520	0.000	1	122.3735	0.287	2	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:S[5]-2:	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]In[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(S[5]In[5])	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](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|S<2>}	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(S[5]In[5]){2|Cl<1>,1|C<3>,2|H<1>,2|O<3>}	121.9950	0.000	1	121.9950	0.000	1	122.3735	0.287	2	122.3082	1.840	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H){1|Co<6>,1|N<3>,2|C<3>,2|H<1>}	124.3000	0.000	1	123.6885	0.201	4	123.6885	0.201	4	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[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>}	123.4847	0.227	3	123.6885	0.201	4	123.6885	0.201	4	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]N[5]Co)(C[6]C[6]C)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]N[5]Co)(C[6]C[6]C){1|C<3>,2|H<1>}	125.0540	0.000	1	125.0540	0.000	1	125.0310	0.001	2	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]N[5]Mn)(C[6]C[6]C)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]N[5]Mn)(C[6]C[6]C){1|C<3>,2|H<1>}	125.0080	0.000	1	125.0080	0.000	1	125.0310	0.001	2	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ag)(N[6]C[6]Ag)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ag)(N[6]C[6]Ag){1|C<3>,3|H<1>}	122.6150	0.185	2	122.6150	0.034	2	122.6150	0.034	2	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:N[5]-3:N[6]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pd)(N[6]C[6]Pd)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pd)(N[6]C[6]Pd){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	123.8750	0.181	2	123.8750	0.033	2	124.2707	0.221	4	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:N[5]-3:N[6]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6]H)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	124.6665	0.060	2	124.6665	0.004	2	124.2707	0.221	4	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:P[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H){2|C<3>,2|H<1>}	120.6520	0.000	1	120.6520	0.000	1	120.6520	0.000	1	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:S[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(S[5]C[5])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]S[5])(N[5]C[5]Cu)(C[6]C[6]H)	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[6]S[5])(N[5]C[5]Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	121.4390	0.000	1	121.4390	0.000	1	121.4390	0.000	1	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:Se[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(Se[5]N[5])	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Se[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[5,6](N[5,6]Se[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H){2|H<1>,3|C<3>}	120.5250	0.000	1	120.5250	0.000	1	120.5250	0.000	1	123.3163	2.198	15	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:3:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6]){1|C<3>,1|N<3>,2|H<1>}	122.8395	0.155	2	122.8395	0.024	2	122.8395	0.024	2	122.8395	0.024	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:3:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C[6]-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	C[5,6](N[5,6]C[6]N[5])(C[5]N[5]C)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]C[6]N[5])(C[5]N[5]C)(C[6]C[6]H){1|Zn<4>,1|H<1>,2|C<3>}	122.9080	0.000	1	122.9080	0.000	1	122.9080	0.000	1	121.8434	7.738	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:3:	3:3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:N[5]-3:N[6]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6]Cu)	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](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,2|N<3>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6]Cu){1|C<3>,1|N<3>,2|H<1>}	124.1690	1.515	2	124.1690	2.294	2	124.1690	2.294	2	121.8434	7.738	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:3:	3:3:3:	C[5,6]-3:C[6]-3:P[5]-2:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN)	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H){1|H<1>,3|C<3>}	118.9855	0.610	2	118.9855	0.372	2	118.9855	0.372	2	121.8434	7.738	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[3,6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[3,6]){1|C<3>,1|H<1>,1|H<2>,2|C<4>}	121.2080	0.000	1	121.2080	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ru)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ru)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	123.3760	0.000	1	123.3760	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	123.3655	1.235	2	123.3655	1.526	2	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ru)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ru)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.4040	0.000	1	122.4040	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Co)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Co)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.1160	0.000	1	122.1160	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Cu)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.2074	0.535	5	122.2074	0.287	5	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Fe)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Fe)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.1150	0.000	1	122.1150	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Mn)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Mn)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	121.9890	0.000	1	121.9890	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ni)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Ni)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.1780	0.000	1	122.1780	0.000	1	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Pt)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.4630	0.081	2	122.4630	0.006	2	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.1315	0.169	2	122.1230	0.014	3	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[5]C[5]Zn)(N[6]C[6]){1|C<3>,1|H<1>,2|C<4>}	122.1060	0.000	1	122.1230	0.014	3	122.3394	0.427	19	122.3394	0.427	19	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:2:	3:3:4:	3:3:3:	C[5,6]-3:C[6]-3:S[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]C)(S[5]C[5])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[6]S[5])(N[5]C[5]Cu)(C[6]C[6]H)	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[6]S[5])(N[5]C[5]Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	122.6090	0.091	2	122.6090	0.008	2	122.6090	0.008	2	122.6090	0.008	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:2:2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:O-1:	N[5,6]-3:O[5]-2:O[6]-2:	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)	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(O[6]Si[5,6])	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(O[6]Si[5,6]){1|O<1>,1|O<2>,2|N<3>,3|C<3>}	125.4560	0.129	2	125.1830	0.232	3	125.1830	0.232	3	125.1830	0.232	3	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:2:2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:O-1:	N[5,6]-3:O[5]-2:O[6]-2:	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)	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(O[6]Si[5,6])	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(O[6]Si[5,6]){1|O<1>,1|O<2>,3|C<3>,3|N<3>}	124.6370	0.000	1	125.1830	0.232	3	125.1830	0.232	3	125.1830	0.232	3	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:2:3:	C[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:P[5]-2:C[6]-3:	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(P[5]N[5,6])(C[6]C[6]H)	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(P[5]N[5,6])(C[6]C[6]H){2|H<1>,3|C<3>}	122.5480	0.000	2	122.5480	0.000	2	122.5480	0.000	2	122.5480	0.000	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5]){1|Fe<6>,2|C<3>,2|H<1>}	123.5930	0.000	1	123.5930	0.000	1	123.5930	0.000	1	121.5768	1.324	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:P[5]-2:	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(P[5]P[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|P<2>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(P[5]P[5]){1|C<3>,1|O<2>,2|H<1>}	121.1070	0.000	1	121.0727	0.072	4	121.0727	0.072	4	121.5768	1.324	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:P[5]-2:	N[5,6](C[5,6]C[6]P[5])(C[5]P[5]O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(P[5]P[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|P<2>,1|P<3>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(P[5]P[5]){1|Mo<6>,1|C<3>,1|O<2>,2|H<1>}	121.0613	0.327	3	121.0727	0.072	4	121.0727	0.072	4	121.5768	1.324	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:B[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){2|H<1>,5|C<3>}	119.2650	0.000	1	119.2650	0.000	1	119.2650	0.000	1	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[5,5]-3:N[5,6]-3:	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H)	C[5,6](C[6,6a]C[6,6a]C[6a])(C[5,5]C[5,5]C[5])(N[5,6]C[5]C[6])	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H){1|O<1>,4|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(C[5,5]C[5,5]C[5])(N[5,6]C[5]C[6]){1|N<3>,2|H<1>,2|O<1>,4|C<3>}	122.3220	0.000	1	122.3220	0.000	1	122.3220	0.000	1	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]Se)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]Se)(C[6]C[6]H){1|O<1>,2|C<3>,2|H<1>}	121.9865	0.207	2	121.9865	0.043	2	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H){1|Ru<6>,1|C<3>,3|H<1>}	122.0225	0.121	2	122.0225	0.015	2	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Cd<5>,2|C<3>,2|H<1>}	119.9333	0.869	3	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Co<5>,2|C<3>,2|H<1>}	120.3220	0.000	1	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Co<6>,2|C<3>,2|H<1>}	120.5720	0.164	2	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Fe<5>,2|C<3>,2|H<1>}	120.1665	0.793	2	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Fe<5>,2|C<3>,2|H<1>}	121.4340	0.000	1	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Fe<6>,2|C<3>,2|H<1>}	120.2760	0.351	2	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Zn<4>,2|C<3>,2|H<1>}	120.2620	0.000	1	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Zn<5>,2|C<3>,2|H<1>}	120.4617	0.448	3	120.3488	0.329	15	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]O)(C[6]C[6]H){1|Ru<6>,2|C<3>,2|H<1>}	121.7330	0.000	1	121.7330	0.000	1	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Co<6>,1|N<3>,2|H<1>,3|C<3>}	120.3295	0.004	2	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Cu<5>,1|N<3>,2|H<1>,3|C<3>}	122.0705	0.074	2	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Fe<6>,1|N<3>,2|H<1>,3|C<3>}	120.7950	0.000	1	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Pt<4>,1|N<3>,2|H<1>,3|C<3>}	122.2360	0.000	1	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Re<6>,1|N<3>,2|H<1>,3|C<3>}	121.8850	0.000	1	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Ru<9>,1|N<3>,2|H<1>,3|C<3>}	121.9740	0.160	2	121.5182	0.632	9	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Cu<3>,2|C<3>,2|H<1>}	120.8805	0.176	2	120.8805	0.031	2	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H){1|Pt<4>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	121.8680	0.000	1	121.8680	0.000	1	121.0086	0.770	32	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]C)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]Cl)(N[5]C[5]Re)	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](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]Cl)(N[5]C[5]Re){1|C<4>,2|C<3>,2|H<1>}	123.6420	0.000	1	123.6420	0.000	1	123.6420	0.000	1	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Co)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Co)(C[6]C[6]H){1|C<3>,4|H<1>}	121.1680	0.000	1	121.1680	0.000	1	121.2770	1.128	5	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Pt)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Pt)(C[6]C[6]H){2|C<3>,3|H<1>}	122.4820	0.000	1	122.0740	0.333	2	121.2770	1.128	5	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Pt)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Pt)(C[6]C[6]H){2|C<3>,3|H<1>}	121.6660	0.000	1	122.0740	0.333	2	121.2770	1.128	5	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Ru)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]Ru)(C[6]C[6]H){2|C<3>,3|H<1>}	120.5345	1.340	2	120.5345	1.796	2	121.2770	1.128	5	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6]-3:C[6]-3:P[5]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5]N)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[5,6](N[5,6]C[6]P[5])(C[5]N[5]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	120.6870	0.000	1	120.6870	0.000	1	120.6870	0.000	1	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	C[6,6a]-3:N[5,6]-3:O-1:	N[5,6]-3:N[6]-3:C[5]-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)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]C[5,6])(O)	C[5,6](N[5,6]C[5,6a]C[6])(N[6]C[6,6a]Pt)(C[5]C[5,6a]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){1|Pt<4>,1|H<1>,1|O<1>,4|C<3>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(N[6]C[6,6a]Pt)(C[5]C[5,6a]O){1|O<1>,4|C<3>}	123.3643	0.618	3	123.3643	0.381	3	123.3643	0.381	3	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]O)(C[6]C[6]H)	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]O)(C[6]C[6]H){2|H<1>,3|C<3>}	122.2705	0.127	2	122.2705	0.016	2	122.2705	0.016	2	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:3:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:C[6]-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)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6a]C[6])(N[5]C[5,6a]Cu)(C[6]C[6]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){1|Cu<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[5,6a]C[6])(N[5]C[5,6a]Cu)(C[6]C[6]H){2|H<1>,3|C<3>}	118.6120	0.000	1	118.6120	0.000	1	118.6120	0.000	1	121.2303	1.405	47	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:4:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]CH)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]CH)(C[6]C[6]H){1|Cd<5>,2|C<3>,2|H<1>}	119.8890	0.000	1	119.8890	0.000	1	121.2455	3.680	2	121.2455	3.680	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:4:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]CO)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]CO)(C[6]C[6]H){1|Fe<6>,2|C<3>,2|H<1>}	122.6020	0.000	1	122.6020	0.000	1	121.2455	3.680	2	121.2455	3.680	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	3:6:3:	C[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:P[5]-6:C[6]-3:	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(P[5]N[5,6]F4)(C[6]C[6]H)	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(P[5]N[5,6]F4)(C[6]C[6]H){2|H<1>,3|C<3>}	122.7300	0.000	1	122.7300	0.000	1	122.7300	0.000	1	122.7300	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	4:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](C[5]C[6a]C[5]O)(N[5,6]C[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[5,6](C[5]C[6a]C[5]O)(N[5,6]C[5]C[6])(C[6]C[6]H){1|Ru<6>,1|N<2>,2|C<3>,3|H<1>}	122.7400	0.000	1	122.7400	0.000	1	121.3740	1.411	3	121.1644	0.798	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	4:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]Os)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](C[5]C[6a]C[5]O)(N[5,6]C[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	C[5,6](C[5]C[6a]C[5]O)(N[5,6]C[5]C[6])(C[6]C[6]H){1|Os<6>,1|N<2>,2|C<3>,3|H<1>}	120.6910	0.150	2	120.6910	0.022	2	121.3740	1.411	3	121.1644	0.798	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	4:3:3:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6]-4:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6,6]N[5,6,6]C[6,6]C)(N[5,6]Ge[5,6]C[6])(C[6]C[6]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){2|H<1>,3|C<3>,3|C<4>}	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[5,6](C[5,6,6]N[5,6,6]C[6,6]C)(N[5,6]Ge[5,6]C[6])(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>,2|N<3>}	120.9900	0.000	1	120.8500	0.039	2	120.8500	0.039	2	121.1644	0.798	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:1:	4:3:3:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6,6]-4:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6,6]N[5,6,6]C[6,6]C)(N[5,6]Ge[5,6]C[6])(C[6]C[6]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){3|C<3>,3|C<4>,3|H<1>}	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[5,6](C[5,6,6]N[5,6,6]C[6,6]C)(N[5,6]Ge[5,6]C[6])(C[6]C[6]H){2|C<3>,2|C<4>,2|N<3>,3|H<1>}	120.7100	0.000	1	120.8500	0.039	2	120.8500	0.039	2	121.1644	0.798	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:2:	3:3:2:	C[5,6]-3:N[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-2:	N[5,6]-3:N[6]-3:N[5]-2:	N[5,6](C[5,6]N[5]N[6])(N[5]C[5]Mn)(C[6]C[6]O)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(OMn)	C[5,6](N[5,6]C[6]N[5])(N[6]C[6]H)(N[5]C[5])	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](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>}	C[5,6](N[5,6]C[6]N[5])(N[6]C[6]H)(N[5]C[5]){1|Mn<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	125.8540	0.000	1	125.8540	0.000	1	125.8540	0.000	1	125.8540	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:2:	3:4:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:N-2:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH)	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CC)(C[6]C[6]H)	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH){1|C<2>,1|C<4>,3|C<3>}	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CC)(C[6]C[6]H){1|C<2>,1|N<2>,3|C<3>}	123.9370	0.000	1	123.9370	0.000	1	123.9370	0.000	1	123.9370	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:3:	3:3:2:	C[5,6]-3:N[5]-3:C[6]-3:	N[5,6]-3:C[6]-3:C[6]-3:	N[5,6]-3:C[5]-3:N[6]-2:	N[5,6](C[5,6]C[5]N[6])(N[5]C[5]Pd)(C[6]C[6]2)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	C[5,6](N[5,6]C[6]N[5])(C[5]C[5]H)(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[6]N[5])(C[5]C[5]H)(N[6]C[6]){1|Pd<4>,1|C<4>,1|H<1>,2|C<3>}	123.4020	0.000	1	123.4020	0.000	1	123.4020	0.000	1	123.4020	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:3:	3:3:3:	C[6]-3:C[5,6]-3:C[5]-3:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[6]C[6,6a]C[6a])(C[5,6]C[6]N[5])(C[5]N[5]Rh)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(C[6a]C[6a]2)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]H)(N[5]N[5]C)	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]H)(N[5]N[5]C){1|Rh<6>,1|C<4>,3|C<3>}	120.8010	0.000	1	120.8010	0.000	1	120.8010	0.000	1	120.8010	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:3:	3:4:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NHH)	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CC)(C[6]C[6]H)	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NHH){1|C<2>,1|C<4>,3|C<3>}	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CC)(C[6]C[6]H){1|C<2>,1|N<3>,3|C<3>}	122.2950	0.000	1	122.2950	0.000	1	122.2950	0.000	1	122.2950	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:4:	3:2:2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:S[5]-2:N[6]-2:	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](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(CCCH)	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6])	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](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>}	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6]){1|C<4>,1|H<1>,4|C<3>}	114.9400	0.000	1	114.9400	0.000	1	114.9400	0.000	1	114.9400	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:3:4:	3:3:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	C[5a,6]-3:N[5,6]-3:N[5]-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)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3)	C[5,6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6a]C[6])(N[5]C[5,6a]H)	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[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3){1|N<2>,1|N<3>,3|C<3>}	C[5,6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6a]C[6])(N[5]C[5,6a]H){1|N<2>,2|C<4>,4|C<3>}	122.6450	0.000	1	122.6450	0.000	1	122.6450	0.000	1	122.6450	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:2:2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:S[5]-2:N[6]-2:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CH)(O)	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6])	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6]){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	119.4560	0.000	1	119.4560	0.000	1	119.8900	0.377	2	119.8900	0.377	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:2:2:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:S[5]-2:N[6]-2:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]N[6]S[5])(C[6]C[6]O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]CN)(O)	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6])	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(N[6]C[6]){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	120.3240	0.000	1	120.3240	0.000	1	119.8900	0.377	2	119.8900	0.377	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:2:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:O[5]-2:C[6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]O[5])(C[6]C[6]O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(C[6]C[6]C)	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(O[5]C[5,6a])(C[6]C[6]C){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	123.4200	0.000	1	123.4200	0.000	1	123.4200	0.000	1	122.8210	0.718	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:2:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:S[5]-2:C[6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[6]S[5])(C[6]C[6]O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(C[6]C[6]C)	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(S[5]C[5,6a])(C[6]C[6]C){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	122.2220	0.000	1	122.2220	0.000	1	122.2220	0.000	1	122.8210	0.718	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:N[6]-3:C[5]-3:	N[5,6](C[5,6]C[5]N[6])(C[5]C[5]C)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	C[5,6](N[5,6]C[5]C[6])(N[6]C[6a]C[6])(C[5]C[5]C)	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(N[6]C[6a]C[6])(C[5]C[5]C){1|C<4>,2|O<1>,5|C<3>}	119.3020	0.000	1	119.3020	0.000	1	118.6845	0.763	2	118.6845	0.763	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:N[6]-3:C[5]-3:	N[5,6](C[5,6]C[5]N[6])(C[5]P[5]C)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CC)(O)	C[5,6](N[5,6]C[5]C[6])(N[6]C[6a]C[6])(C[5]P[5]C)	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(N[6]C[6a]C[6])(C[5]P[5]C){1|Au<2>,1|C<4>,2|O<1>,4|C<3>}	118.0670	0.000	1	118.0670	0.000	1	118.6845	0.763	2	118.6845	0.763	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:3:	3:4:1:	3:4:3:	C[5,6a]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(C[5,6]C[5]C[6])(C[6]C[6]O)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CH)(C[6]C[6]C)	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>}	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>}	C[5,6](N[5,6]C[5,6a]C[6])(C[5]C[5,6a]CH)(C[6]C[6]C){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	123.0060	0.000	1	123.0060	0.000	1	123.0060	0.000	1	123.0060	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:4:	3:3:1:	3:2:4:	C[5,6]-3:C[6]-3:C[5]-4:	C[6,6a]-3:N[5,6]-3:S-1:	N[5,6]-3:N[6]-2:C[5]-4:	N[5,6](C[5,6]C[5]N[6])(C[6]C[6,6a]S)(C[5]C[5]HH)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(S)	C[5,6](N[5,6]C[5]C[6])(N[6]C[6,6a])(C[5]C[5]HH)	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](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>}	C[5,6](N[5,6]C[5]C[6])(N[6]C[6,6a])(C[5]C[5]HH){1|S<1>,2|C<3>,4|H<1>}	123.6120	0.000	1	123.6120	0.000	1	123.6120	0.000	1	123.6120	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:4:	3:3:1:	3:3:2:	C[5,6]-3:C[6]-3:C[5]-4:	C[6,6a]-3:N[5,6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6,6a]H)(C[5]C[5]HH)	C[6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6]C[5])(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(N[5]C[5])	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6,6a]C)(N[5]C[5]){2|C<3>,5|H<1>}	123.4090	0.000	1	123.4090	0.000	1	123.4090	0.000	1	123.4090	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:4:	3:3:1:	4:3:3:	C[5,6]-3:C[6]-3:C[5]-4:	C[5a,6]-3:N[5,6]-3:O-1:	C[5,6]-4:N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[5,6]C[5])(C[6]C[5a,6]O)(C[5]C[5]HH)	C[6](C[5a,6]N[5a,6]C[5a])(N[5,6]C[5,6]C[5])(O)	C[5,6](C[5,6]N[5a,6]C[5]N[5])(N[5,6]C[5]C[6])(C[5]C[5]H)	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[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>}	C[5,6](C[5,6]N[5a,6]C[5]N[5])(N[5,6]C[5]C[6])(C[5]C[5]H){1|N<2>,1|N<3>,1|O<1>,3|C<3>,4|H<1>}	126.2310	0.100	2	126.2310	0.010	2	126.2310	0.010	2	126.2310	0.010	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:4:	3:3:2:	3:3:2:	C[5,6]-3:C[6]-3:C[5]-4:	N[5,6]-3:C[6a]-3:N[6]-2:	C[6,6a]-3:N[5,6]-3:N[5]-2:	N[5,6](C[5,6]C[6,6a]N[5])(C[6]C[6a]N[6])(C[5]C[5]HH)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(N[6]C[6,6a])	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5]C[6])(N[5]C[5])	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[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>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5]C[6])(N[5]C[5]){1|N<2>,3|C<3>,5|H<1>}	123.0370	0.000	1	123.0370	0.000	1	123.0370	0.000	1	123.0370	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:3:4:	3:3:3:	3:3:2:	C[5,6]-3:C[6]-3:C[5]-4:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]N[5])(C[5]C[5]HH)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Ir)(N[5]C[5]2)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]C[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]C[5]){1|C<3>,1|N<3>,5|H<1>}	120.2400	0.000	1	120.2400	0.000	1	120.2400	0.000	1	120.2400	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:2:1:	3:2:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:S[6]-2:S-1:	N[5,6]-3:N[5]-2:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]S[6]S)	C[6](N[5,6]C[5,6]C[5])(S[6]C[6])(S)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5])(N[6]C[6])	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]S[6]S){1|C<3>,2|H<1>}	C[6](N[5,6]C[5,6]C[5])(S[6]C[6])(S){1|C<4>,1|S<1>,2|H<1>,2|N<2>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5])(N[6]C[6]){1|S<2>,2|S<1>,4|H<1>}	128.0060	0.000	1	128.0060	0.000	1	128.0060	0.000	1	128.0060	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:2:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:S[6]-2:S-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]S[6]S)	C[6](N[5,6]C[5,6]C[5])(S[6]C[6])(S)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]H)(N[6]C[6])	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]S[6]S){1|C<3>,3|H<1>}	C[6](N[5,6]C[5,6]C[5])(S[6]C[6])(S){1|C<4>,1|N<2>,1|N<3>,1|S<1>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]H)(N[6]C[6]){1|S<2>,2|S<1>,4|H<1>}	125.6090	0.000	2	125.6090	0.000	2	125.6090	0.000	2	125.6090	0.000	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:2:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:Cl-1:	N[5,6]-3:O[5]-2:C[6]-3:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]Cl)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H){1|Cl<1>,1|C<3>,1|O<2>,2|C<4>,3|H<1>}	120.6883	0.078	3	120.6883	0.006	3	120.6883	0.006	3	122.2613	1.355	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:2:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:C[6]-3:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]N)	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](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]N){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	123.5447	0.442	4	123.5447	0.195	4	122.7857	0.624	9	122.2613	1.355	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:2:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:C[6]-3:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	122.1203	0.223	3	122.1203	0.050	3	122.7857	0.624	9	122.2613	1.355	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:2:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:C[6]-3:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5,5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	122.2655	0.368	2	122.2655	0.136	2	122.7857	0.624	9	122.2613	1.355	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:Cl-1:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|Cl<1>,1|C<3>,1|O<3>,2|C<4>,3|H<1>}	121.2030	0.000	1	120.8707	0.143	3	120.8707	0.143	3	122.1134	1.995	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:Cl-1:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]Cl)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){2|Cl<1>,1|C<3>,2|C<4>,3|H<1>}	120.7045	0.346	2	120.8707	0.143	3	120.8707	0.143	3	122.1134	1.995	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]N[5]H)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5]){1|C<4>,2|C<3>,3|H<1>}	123.8520	0.000	1	123.8520	0.000	1	123.9860	0.036	2	122.1134	1.995	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[5]N[5]CH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]Cl)(N[5]N[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]Cl)(N[5]N[5]){1|C<4>,2|C<3>,3|H<1>}	124.1200	0.000	1	124.1200	0.000	1	123.9860	0.036	2	122.1134	1.995	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:N[6]-3:S-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]N[6]S)	C[6](N[5,6]C[5,6]C[5])(N[6]C[6a]C[6])(S)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]C)(N[6]C[6])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]C)(N[6]C[6]){1|N<2>,1|N<3>,1|S<1>,4|H<1>}	122.1050	0.000	2	122.1050	0.000	2	122.1050	0.000	2	122.1134	1.995	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:B[5,5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,5]C[6])(C[6]C[6]H)	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	119.4890	0.000	1	119.4890	0.000	1	119.4890	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,6]-3:N[5,6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]Cl2)(C[6]C[5,6]H)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(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)	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[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>}	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>}	122.7880	0.000	1	122.7880	0.000	1	122.7880	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[6]-3:N[5,6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C[6]-3:	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[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H)	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H){1|H<1>,2|C<4>,3|C<3>,4|B<6>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	119.8590	0.000	1	119.8590	0.000	1	119.8590	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]Br2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){2|Br<1>,1|H<1>,3|C<3>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|Br<1>,2|H<1>,3|C<3>}	120.6980	0.000	1	120.6980	0.000	1	120.6980	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]C[6]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){2|C<4>,3|C<3>,3|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,3|H<1>,4|C<3>}	121.9910	0.000	1	121.9910	0.000	1	121.9910	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[6,6a]C[5])(C[5]C[5]CH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5]C[6])(C[5]C[5]C)	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](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5]C[6])(C[5]C[5]C){4|C<3>,5|H<1>}	125.1310	0.000	1	125.1310	0.000	1	125.1310	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]OsC)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]H)(C[6]C[6]H){1|Os<5>,1|Os<6>,1|C<3>,1|C<4>,2|H<1>}	121.7150	0.000	1	121.7150	0.000	1	121.7150	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CC)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	122.8790	0.000	1	122.8790	0.000	1	123.2008	0.736	5	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]CH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H){1|C<3>,1|C<4>,1|O<1>,3|H<1>}	122.7260	0.000	1	122.7260	0.000	1	123.2008	0.736	5	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]C)	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](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]C){2|C<3>,5|H<1>}	123.5100	0.000	1	123.5100	0.000	1	123.2008	0.736	5	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]N)(N[5]C[5]C)	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](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]N)(N[5]C[5]C){1|C<3>,6|H<1>}	124.5400	0.000	1	124.5400	0.000	1	123.2008	0.736	5	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]H){1|C<3>,1|O<1>,4|H<1>}	122.3490	0.000	1	122.3490	0.000	1	123.2008	0.736	5	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:N[5]-3:N[6]-3:	N[5,6](C[5,6]N[5]N[6])(C[5]C[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(O)	C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(N[6]C[6a]C[6])	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](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>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[6a]C[5])(N[6]C[6a]C[6]){1|O<1>,1|S<1>,4|H<1>,5|C<3>}	124.9480	0.000	1	124.9480	0.000	1	124.9480	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Fe2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){2|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H){2|Fe<8>,3|C<3>,3|H<1>}	119.4025	0.042	2	119.4025	0.002	2	119.4025	0.002	2	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:Ge[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,3|H<1>}	120.4955	0.763	2	120.4955	0.582	2	120.4955	0.582	2	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:P[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(P[5]O[5]CW)(C[6]C[6]H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[6]P[5])(C[5]C[6a]O[5])(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,1|W<6>,2|C<3>}	C[5,6](N[5,6]C[6]P[5])(C[5]C[6a]O[5])(C[6]C[6]H){1|C<4>,1|N<2>,1|W<6>,2|C<3>,2|H<1>}	121.3030	0.571	2	121.3030	0.326	2	121.3030	0.326	2	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:3:3:	C[5,6]-3:Si[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[4,6]-3:C[5,5]-3:N[5,6]-3:	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](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H)	C[5,6](C[4,6]C[4,6]Si[4])(C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])	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](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|C<4>}	C[5,6](C[4,6]C[4,6]Si[4])(C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6]){1|Si<4>,1|C<3>,3|H<1>,6|C<4>}	118.0230	0.000	1	118.0230	0.000	1	118.0230	0.000	1	121.6524	3.960	20	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:B[5,5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5,5]O[5]3)(C[6]C[6]H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,5]C[6])(C[5]O[5]CH)(C[6]C[6]H)	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|O<2>}	C[5,6](N[5,6]B[5,5]C[6])(C[5]O[5]CH)(C[6]C[6]H){1|C<3>,2|H<1>,2|O<2>}	120.9650	0.128	4	120.9650	0.016	4	120.9650	0.016	4	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]CH)(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]CH)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[5,6](N[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>}	122.5470	0.000	1	122.5470	0.000	1	122.5470	0.000	1	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	C[5,6](N[5,6]Ga[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|I<1>,3|H<1>}	120.5750	0.000	1	120.6520	0.012	2	120.6520	0.012	2	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	C[5,6](N[5,6]Ga[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H){1|N<3>,2|I<1>,3|C<3>,3|H<1>}	120.7290	0.000	1	120.6520	0.012	2	120.6520	0.012	2	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){2|Si<4>,1|C<3>,2|C<4>,2|H<1>}	120.7010	0.000	1	120.7010	0.000	1	121.2393	0.225	3	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){2|Cl<1>,1|C<3>,4|H<1>}	121.5940	0.000	1	121.5085	0.015	2	121.2393	0.225	3	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){2|Cl<1>,2|Si<4>,1|C<3>,2|H<1>}	121.4230	0.000	1	121.5085	0.015	2	121.2393	0.225	3	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:In[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]Cl2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	C[5,6](N[5,6]In[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){2|Cl<1>,2|Si<4>,1|C<3>,2|H<1>}	120.5760	0.000	1	120.5760	0.000	1	120.3550	0.098	2	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:1:	3:4:3:	C[5,6]-3:In[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(In[5]C[5]II)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,2|I<1>}	C[5,6](N[5,6]In[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){2|Si<4>,1|C<3>,2|H<1>,2|I<1>}	120.1340	0.000	1	120.1340	0.000	1	120.3550	0.098	2	121.0116	0.386	12	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:3:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:N-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)(C[6]C[6]N)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH){1|H<1>,2|C<4>,3|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	120.1510	0.000	1	120.1510	0.000	1	120.1510	0.000	1	121.8435	1.969	10	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:3:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]N)	C[6](N[5,6]C[5,6]C[5])(C[6]C[5,6]C)(NHH)	C[5,6](N[5,6]C[5]C[6])(C[6]C[5,6]N)(N[5]C[5]H)	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[5,6]N)(N[5]C[5]H){1|N<3>,3|C<3>,4|H<1>}	122.9370	0.338	4	122.9370	0.114	4	122.9370	0.114	4	121.8435	1.969	10	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:3:	3:3:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:P-3:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6]P)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(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[6]P){2|H<1>,3|C<3>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H){2|Cl<1>,1|P<3>,2|H<1>,3|C<3>}	120.2500	0.977	2	120.2500	0.955	2	120.2500	0.955	2	121.8435	1.969	10	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:3:	3:3:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6a]-3:C[6]-3:	C[5,6]-3:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(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]){1|N<2>,2|H<1>,4|C<3>}	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H){2|Cl<1>,1|N<3>,2|H<1>,4|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H){2|Cl<1>,2|H<1>,4|C<3>}	122.6420	1.112	2	122.6420	1.236	2	122.6420	1.236	2	121.8435	1.969	10	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:3:	3:3:3:	C[5,6]-3:In[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(In[5]N[5]ClS)(C[6]C[6]C)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN)	C[5,6](N[5,6]In[5]C[6])(C[5]N[5]C)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]In[5]C[6])(C[5]N[5]C)(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<2>,1|S<2>,2|C<3>}	120.7520	0.000	1	120.7520	0.000	1	120.7520	0.000	1	121.8435	1.969	10	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|F<1>,3|C<4>,3|H<1>}	123.3010	0.000	1	123.1295	0.059	2	123.1295	0.059	2	123.1295	0.059	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|O<3>,3|C<4>,3|H<1>}	122.9580	0.000	1	123.1295	0.059	2	123.1295	0.059	2	123.1295	0.059	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(C[5]C[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	123.0810	0.000	1	123.0810	0.000	1	123.0810	0.000	1	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H)	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](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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H){1|C<4>,2|C<3>,5|H<1>}	121.6810	0.000	1	121.6810	0.000	1	121.6810	0.000	1	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Ga[5]O[5]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN)	C[5,6](N[5,6]Ga[5]C[6])(C[5]O[5]O)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>,3|O<2>}	C[5,6](N[5,6]Ga[5]C[6])(C[5]O[5]O)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	123.0820	0.000	1	123.0820	0.000	1	122.1655	1.680	2	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Ga[5]P[5]Cl2)(C[6]C[6]C)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]Ga[5]C[6])(C[5]P[5]H)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]Ga[5]C[6])(C[5]P[5]H)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|H<1>,3|C<4>}	121.2490	0.000	1	121.2490	0.000	1	122.1655	1.680	2	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H)	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](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3){1|H<1>,2|O<1>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H){1|C<4>,2|H<1>,2|O<1>,4|C<3>}	121.1150	0.000	1	121.1150	0.000	1	120.1735	1.773	2	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]C)	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH){1|H<1>,2|O<1>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]C){1|C<4>,2|H<1>,2|O<1>,4|C<3>}	119.2320	0.000	1	119.2320	0.000	1	120.1735	1.773	2	121.5733	2.072	6	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:4:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HH)(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	121.6950	0.000	1	121.6950	0.000	1	121.6010	0.018	2	121.6010	0.018	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:3:4:	3:4:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	121.5070	0.000	1	121.5070	0.000	1	121.6010	0.018	2	121.6010	0.018	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-3:S[5]-2:	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]CH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]N)(S[5]C[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]N)(S[5]C[5]){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	123.4790	0.000	1	123.4790	0.000	1	123.8630	0.295	2	123.8630	0.295	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-3:S[5]-2:	N[5,6](C[5,6]C[6]S[5])(C[5]C[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6a]C[6]S)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(S[5]C[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(S[5]C[5]){1|C<4>,1|O<1>,6|H<1>}	124.2470	0.000	1	124.2470	0.000	1	123.8630	0.295	2	123.8630	0.295	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H)	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H){1|C<4>,1|O<1>,6|H<1>}	124.8960	0.000	1	124.2595	0.810	2	124.0197	0.578	3	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H)	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H){1|C<3>,1|C<4>,1|O<1>,5|H<1>}	123.6230	0.000	1	124.2595	0.810	2	124.0197	0.578	3	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H)	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H){1|C<4>,1|O<1>,6|H<1>}	123.5400	0.000	1	123.5400	0.000	1	124.0197	0.578	3	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:S-1:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]S)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(S)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H)	N[5,6](C[5,6]C[6]N[5])(C[5]C[5]HH)(C[6]C[6]S){1|C<4>,2|C<3>,4|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]CH)(S){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]C)(N[5]C[5]H){1|C<3>,1|C<4>,1|S<1>,5|H<1>}	124.6450	0.000	1	124.6450	0.000	1	124.6450	0.000	1	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]CH)(O)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H)	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>}	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>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>,3|O<1>}	123.2210	0.000	1	123.2210	0.000	1	123.8050	0.724	3	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6a]C[6]H)(O)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H)	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>}	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>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>,3|O<1>}	124.0970	0.967	2	124.0970	0.936	2	123.8050	0.724	3	124.0170	0.522	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:4:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-4:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5]){1|C<4>,1|O<1>,3|F<1>,4|H<1>}	124.2810	0.000	1	123.8814	0.362	5	123.8814	0.362	5	123.8814	0.362	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:4:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-4:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5]){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	124.2580	0.583	2	123.8814	0.362	5	123.8814	0.362	5	123.8814	0.362	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	3:4:2:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:C[6]-4:O[5]-2:	N[5,6](C[5,6]C[6]O[5])(C[5]Si[5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5])	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>}	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>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5]){1|O<1>,3|C<4>,4|H<1>}	123.3050	0.000	2	123.8814	0.362	5	123.8814	0.362	5	123.8814	0.362	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:1:	4:3:3:	C[5,6]-3:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,5]-4:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,5]C[6])(C[5]C[5,5]HH)(C[6]C[6]O)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]HH)(O)	C[5,6](C[5,5]C[5,5]O[5]H)(N[5,6]C[5]C[6])(C[6]C[6]C)	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>}	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>}	C[5,6](C[5,5]C[5,5]O[5]H)(N[5,6]C[5]C[6])(C[6]C[6]C){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	122.8500	0.000	1	122.8500	0.000	1	122.8500	0.000	1	122.8500	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:3:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H)	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[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH){1|H<1>,2|O<1>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H){1|C<4>,2|H<1>,2|O<1>,4|C<3>}	122.2680	0.000	1	122.2680	0.000	1	122.2680	0.000	1	122.2680	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:5:3:	3:3:1:	3:3:3:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CCO)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	119.1605	1.240	2	119.1605	1.537	2	119.4445	0.787	4	119.4445	0.787	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:5:3:	3:3:1:	3:3:3:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){3|Cl<1>,3|C<3>,3|H<1>}	119.7285	0.708	2	119.7285	0.501	2	119.4445	0.787	4	119.4445	0.787	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:5:3:	3:3:1:	3:4:3:	C[5,6]-3:Ga[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-4:C[6]-3:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3Fe)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Fe<11>,1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	C[5,6](N[5,6]Ga[5]C[6])(Si[5]C[5]CC)(C[6]C[6]H){1|Fe<11>,2|Si<4>,1|C<3>,2|C<4>,2|H<1>}	119.6460	0.315	2	119.6460	0.099	2	119.6460	0.099	2	119.8500	0.136	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:5:3:	3:3:1:	3:4:3:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[5,6](N[5,6]Si[5]C[6])(C[5]C[5]N[5]H)(C[6]C[6]H){3|Cl<1>,1|N<3>,3|C<3>,3|H<1>}	120.2115	0.011	2	120.2115	0.000	2	119.9860	0.153	3	119.8500	0.136	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:5:3:	3:3:1:	3:4:3:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[5,6](N[5,6]Si[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){3|Cl<1>,2|C<3>,2|H<1>}	119.5350	0.000	1	119.5350	0.000	1	119.9860	0.153	3	119.8500	0.136	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:Ga[3x5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	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](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|N<3>}	C[5,6](N[5,6]Ga[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){3|C<3>,3|H<1>,4|N<3>}	119.7032	0.686	6	119.7032	0.471	6	119.7032	0.471	6	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:Ga[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H){1|O<3>,3|C<3>,3|F<1>,3|H<1>}	119.5815	0.486	2	119.5815	0.236	2	119.5815	0.236	2	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:In[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H){3|Cl<1>,1|O<2>,3|C<3>,3|H<1>}	119.0730	0.273	4	119.2433	0.114	6	118.9088	0.209	14	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:In[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H){3|Cl<1>,1|O<3>,3|C<3>,3|H<1>}	119.5840	0.023	2	119.2433	0.114	6	118.9088	0.209	14	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:In[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H){3|Cl<1>,1|C<4>,1|O<2>,2|H<1>,3|C<3>}	118.7370	0.290	4	118.6579	0.138	8	118.9088	0.209	14	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:In[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(In[5]N[5,6]Cl3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<3>,2|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]In[5]C[6])(C[6]C[6]H){3|Cl<1>,1|C<4>,1|O<3>,2|H<1>,3|C<3>}	118.5787	0.471	4	118.6579	0.138	8	118.9088	0.209	14	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:In[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(In[5]O[5]Cl3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[5,6](N[5,6]In[5]C[6])(C[5]O[5]O)(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|O<2>,1|O<3>,2|C<3>}	C[5,6](N[5,6]In[5]C[6])(C[5]O[5]O)(C[6]C[6]H){3|Cl<1>,1|C<3>,1|O<3>,2|H<1>}	119.6640	0.000	1	119.6640	0.000	1	119.6640	0.000	1	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:Nb[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Nb[5]N[5,6]N3O)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Nb[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,3|N<2>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Nb[5]C[6])(C[6]C[6]H){1|O<1>,3|C<3>,3|H<1>,3|N<2>}	118.7175	0.045	2	118.7175	0.002	2	118.7175	0.002	2	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:P[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6]F4)(C[6]C[6]H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H)	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|F<1>}	C[5,6](N[5,6]C[5,6]C[6])(N[5,6]C[6]P[5])(C[6]C[6]H){3|C<3>,3|H<1>,4|F<1>}	119.8000	0.000	1	119.8000	0.000	1	119.8000	0.000	1	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:6:3:	3:3:1:	3:3:3:	C[5,6]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CF3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){1|C<2>,3|C<3>,3|F<1>,3|H<1>}	119.4575	0.101	2	119.4575	0.010	2	119.4575	0.010	2	119.2114	0.351	28	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:2:3:	C[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Se[5]-2:C[6]-3:	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](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,5]C[6])(Se[5]C[5,5])(C[6]C[6]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){1|C<3>,2|C<4>,5|H<1>}	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|C<3>,2|C<4>,2|H<1>}	C[5,6](N[5,6]C[5,5]C[6])(Se[5]C[5,5])(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	121.6410	0.000	1	121.6410	0.000	1	121.6410	0.000	1	122.7525	2.471	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:2:3:	C[5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-2:C[6]-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)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5,6]C[6])(N[5]C[5,6])(C[6]C[6]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){1|C<4>,3|C<3>,3|H<1>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[5,6](N[5,6]C[5,6]C[6])(N[5]C[5,6])(C[6]C[6]H){1|C<2>,1|C<4>,2|C<3>,2|H<1>}	123.8640	0.000	1	123.8640	0.000	1	123.8640	0.000	1	122.7525	2.471	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:2:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-2:	N[5,6](C[5]C[6a]C[5]C)(C[5,6]C[6]N[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(N[5]C[5]){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	123.5070	0.000	1	123.5070	0.000	1	123.5070	0.000	1	122.5337	1.254	3	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:2:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O[5]-2:	N[5,6](C[5]N[6a]Si[5]H)(C[5,6]C[6]O[5])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,1|O<2>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	122.7840	0.000	1	122.7840	0.000	1	122.7840	0.000	1	122.5337	1.254	3	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:2:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:N[6]-2:	N[5,6](C[5]C[6a]C[5]O)(C[5,6]N[5]N[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]H)(N[6]C[6])	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<3>}	C[5,6](N[5,6]C[5]C[6])(N[5]C[5]H)(N[6]C[6]){1|N<2>,1|O<2>,2|C<3>,2|H<1>}	121.3100	0.000	1	121.3100	0.000	1	121.3100	0.000	1	122.5337	1.254	3	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[4,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[4,5]C[6])(C[5]C[4,5]C[6a])(C[6]C[6]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){2|H<1>,6|C<3>}	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[5,6](N[5,6]B[4,5]C[6])(C[5]C[4,5]C[6a])(C[6]C[6]H){1|O<2>,2|H<1>,6|C<3>}	121.6530	0.000	1	121.6530	0.000	1	121.6530	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){1|C<3>,5|C<4>,5|H<1>}	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	118.6570	0.223	2	118.5446	0.064	5	118.5446	0.064	5	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){1|Si<4>,1|C<3>,4|C<4>,5|H<1>}	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	118.7080	0.000	1	118.5446	0.064	5	118.5446	0.064	5	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){2|C<3>,4|C<4>,5|H<1>}	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	118.3505	0.279	2	118.5446	0.064	5	118.5446	0.064	5	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N[5]-3:	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](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H)	C[5,6](N[5,6]B[5,6,6]C[6])(C[6]C[6]H)(N[5]C[5]C)	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](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[6]C[6]H)(N[5]C[5]C){1|C<3>,2|C<4>,4|H<1>}	118.8470	0.000	1	118.8470	0.000	1	118.8470	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6a]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,6a]C[6])(C[6]C[6]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){2|H<1>,7|C<3>}	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,6a]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	120.3000	1.106	2	120.3000	1.223	2	120.3000	1.223	2	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5,6a]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,6a]C[6])(C[5]N[5,6a]O)(C[6]C[6]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){1|N<2>,1|O<1>,2|H<1>,3|C<3>}	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[5,6](N[5,6]B[5,6a]C[6])(C[5]N[5,6a]O)(C[6]C[6]H){1|N<2>,1|O<2>,2|C<3>,2|H<1>}	120.7980	0.000	1	120.7980	0.000	1	120.7980	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6]-3:N[5,6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](C[5,6]C[5,6a]N[5,6])(N[5,6]C[5,6]B[5])(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)	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[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>}	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>}	122.0610	0.000	1	122.0610	0.000	1	122.0610	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]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){1|S<2>,2|H<1>,6|C<3>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	118.7270	0.000	1	118.7270	0.000	1	118.7270	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){1|B<3>,1|H<1>,7|C<3>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H){1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	120.3270	0.542	2	120.3270	0.293	2	119.8809	0.445	11	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){1|H<1>,8|C<3>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	120.2580	0.000	1	120.2580	0.000	1	119.8809	0.445	11	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){2|H<1>,7|C<3>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	119.6596	0.730	7	119.6596	0.533	7	119.8809	0.445	11	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){1|H<1>,8|C<3>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H){1|H<1>,7|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	120.1610	0.000	1	120.1610	0.000	1	119.8809	0.445	11	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]C)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|C<4>,2|H<1>,5|C<3>}	120.7340	0.000	1	120.7340	0.000	1	121.0820	0.242	2	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|Cl<1>,2|H<1>,5|C<3>}	121.4300	0.000	1	121.4300	0.000	1	121.0820	0.242	2	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	C[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]C[5,5]C[5,6])(C[6]N[6]O)(O)	C[5,6](N[5,6]C[5,5]C[6])(C[5]C[5,5]H)(C[6]N[6]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){1|N<3>,2|H<1>,2|O<1>,3|C<3>}	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>}	C[5,6](N[5,6]C[5,5]C[6])(C[5]C[5,5]H)(C[6]N[6]O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,3|C<3>}	124.5490	0.000	1	124.5490	0.000	1	124.5490	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5]C[6a]C[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]N)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]N)(C[6]C[6]H){3|C<3>,4|H<1>}	123.2560	0.000	1	123.2560	0.000	1	123.2560	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	Ga[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]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){3|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	119.7640	0.000	1	119.7640	0.000	1	119.7640	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	Si[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5]H)(C[6]C[6]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){3|H<1>,6|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	119.3325	0.189	2	119.3325	0.036	2	119.3325	0.036	2	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	Si[5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,6]C[6])(C[5]C[6a]O[5])(C[6]C[6]H)	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](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[5,6](N[5,6]Si[5,6]C[6])(C[5]C[6a]O[5])(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	120.8280	0.000	1	120.8280	0.000	1	120.8280	0.000	1	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:3:3:	Si[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])(C[6]C[6]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){2|C<4>,2|H<1>,5|C<3>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[5,6](C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	118.5530	1.296	3	118.5530	1.681	3	118.5530	1.681	3	119.9701	2.199	34	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:4:3:	B[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5,5]C[6])(C[5]C[5]HH)(C[6]C[6]H)	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](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[5,6](N[5,6]B[5,5]C[6])(C[5]C[5]HH)(C[6]C[6]H){1|C<3>,2|B<3>,2|H<1>,2|O<2>}	120.8350	0.000	1	120.8350	0.000	1	120.8350	0.000	1	122.1910	3.677	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	3:4:3:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5]C[6a]N[5]H)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	123.5470	0.000	1	123.5470	0.000	1	123.5470	0.000	1	122.1910	3.677	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	4:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-4:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C)	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](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|Cl<1>,1|H<1>,2|C<3>,2|C<4>}	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C){1|Cl<1>,2|C<3>,2|C<4>,3|H<1>}	121.6250	0.205	2	121.6250	0.042	2	121.6250	0.042	2	122.2215	0.688	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	4:3:3:	C[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-4:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]C[5,6,6]N[6]H)(N[5,6]C[5,6,6]C[6])(C[6]C[6]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){1|N<3>,3|C<3>,3|C<4>,3|H<1>}	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>}	C[5,6](C[5,6]C[5,6,6]N[6]H)(N[5,6]C[5,6,6]C[6])(C[6]C[6]H){1|H<1>,2|C<3>,2|O<2>,4|C<4>}	122.2710	0.000	1	122.2710	0.000	1	122.2710	0.000	1	122.2215	0.688	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:1:	4:3:3:	C[5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5]-4:N[5,6]-3:C[6]-3:	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](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[5,6](C[5]C[5,6]C[6a]H)(N[5,6]C[5,6]C[6])(C[6]C[6]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){1|Br<1>,2|C<3>,2|C<4>,5|H<1>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[5,6](C[5]C[5,6]C[6a]H)(N[5,6]C[5,6]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	123.3650	0.000	1	123.3650	0.000	1	123.3650	0.000	1	122.2215	0.688	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:4:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6]-3:N[5,6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[5,6]C)	C[6](C[5,6]N[5,6]C[5])(N[5,6]C[5,6]B[5])(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]N[5,6]C)	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[6](C[5,6]N[5,6]C[5])(N[5,6]C[5,6]B[5])(CH3){1|Cl<1>,1|B<4>,6|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]N[5,6]C){1|Cl<1>,1|B<4>,1|C<4>,5|C<3>}	123.2723	0.142	3	123.2723	0.020	3	123.2723	0.020	3	123.2488	0.034	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:4:	3:3:3:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,5|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[5]C)(C[6]C[6]H){1|Au<2>,1|C<4>,1|H<1>,3|C<3>}	123.4280	0.000	1	123.4280	0.000	1	123.2135	0.092	2	123.2488	0.034	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:4:	3:3:3:	C[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](C[5]C[6a]2C[5])(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,5|C<3>}	C[5,6](N[5,6]C[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|Au<2>,1|C<4>,1|H<1>,5|C<3>}	122.9990	0.000	1	122.9990	0.000	1	123.2135	0.092	2	123.2488	0.034	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:4:	3:4:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]GaH)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]GaH)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	120.3690	0.000	1	120.3690	0.000	1	120.1140	0.130	2	120.1140	0.130	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:3:4:	3:4:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]HH)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]HH)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	119.8590	0.000	1	119.8590	0.000	1	120.1140	0.130	2	120.1140	0.130	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[3x5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H)	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]C)(C[6]N[6]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){1|C<4>,2|H<1>,3|C<3>,3|N<2>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H){2|C<3>,2|N<3>,2|S<2>}	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]C)(C[6]N[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|S<2>}	118.4370	0.000	1	118.4370	0.000	1	118.4370	0.000	1	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<4>,2|C<3>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){2|Cl<1>,1|C<4>,1|N<3>,2|H<1>,3|C<3>}	119.3950	0.803	2	119.3950	0.645	2	119.2995	0.253	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|F<1>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){1|N<3>,2|F<1>,3|C<3>,3|H<1>}	119.1625	0.057	2	119.1625	0.003	2	119.2995	0.253	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){1|N<3>,2|I<1>,3|C<3>,3|H<1>}	119.3410	0.745	2	119.3410	0.555	2	119.2995	0.253	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|N<2>,1|S<2>,2|H<1>}	119.6020	0.000	1	119.6020	0.000	1	118.6650	0.281	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]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){1|N<2>,2|H<1>,3|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]H){2|Cl<1>,1|N<2>,1|S<2>,2|H<1>,3|C<3>}	118.8300	0.000	1	118.8300	0.000	1	118.6650	0.281	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]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){3|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){1|Cl<1>,2|C<3>,2|H<1>,2|N<3>}	118.3120	0.000	1	118.3120	0.000	1	118.6650	0.281	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]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){3|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<3>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){1|O<3>,2|C<3>,2|H<1>,2|N<3>}	118.2070	0.000	1	118.2070	0.000	1	118.6650	0.281	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]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){3|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Ga[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){1|S<2>,2|C<3>,2|H<1>,2|N<3>}	118.5195	0.350	2	118.5195	0.123	2	118.6650	0.281	6	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:3:3:	In[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,2|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){1|Se<2>,2|Br<1>,1|C<3>,1|N<2>,2|H<1>}	119.8420	0.000	1	119.8420	0.000	1	119.8420	0.000	1	119.0047	0.377	14	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:4:3:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){4|H<1>,5|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){1|Br<1>,1|S<2>,2|H<1>,3|C<3>}	119.3600	0.000	1	119.3600	0.000	1	119.6483	0.054	7	119.6483	0.054	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:4:3:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){4|H<1>,5|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){1|Cl<1>,1|S<2>,2|H<1>,3|C<3>}	119.6155	0.043	2	119.6155	0.002	2	119.6483	0.054	7	119.6483	0.054	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:4:3:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){4|H<1>,5|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){1|N<2>,1|S<2>,2|H<1>,3|C<3>}	119.6750	0.281	3	119.6750	0.079	3	119.6483	0.054	7	119.6483	0.054	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:1:	3:4:3:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){3|C<3>,4|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<4>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){1|C<4>,1|O<2>,1|S<2>,2|C<3>,2|H<1>}	119.9220	0.000	1	119.9220	0.000	1	119.6483	0.054	7	119.6483	0.054	7	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:3:	3:3:3:	In[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:P-3:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(C[6]C[6]H)	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](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(C[6]C[6]H){2|Cl<1>,1|N<3>,1|P<3>,2|H<1>,3|C<3>}	120.7205	0.114	2	120.7205	0.013	2	120.7205	0.013	2	120.7205	0.013	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:3:4:	3:3:3:	In[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:P-4:	C[5,5a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PIrCC)	C[5,6](C[5,5a]N[5,5,5a]C[5a])(N[5,6]In[5,5]C[6])(C[6]C[6]H)	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](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>}	C[5,6](C[5,5a]N[5,5,5a]C[5a])(N[5,6]In[5,5]C[6])(C[6]C[6]H){1|Cl<1>,1|Ir<5>,1|N<3>,1|P<4>,2|H<1>,3|C<3>}	121.7532	0.709	4	121.7532	0.503	4	121.7532	0.503	4	121.7532	0.503	4	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	5:3:3:	3:4:3:	3:3:3:	Ga[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:P-4:C[6]-3:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(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){2|H<1>,5|C<3>}	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>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){1|Cl<1>,1|Pd<4>,1|N<3>,1|P<4>,2|H<1>,3|C<3>}	121.3330	0.209	2	121.3330	0.044	2	121.3330	0.044	2	121.3330	0.044	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:2:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-2:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(N[5]N[5,5])(C[6]C[6]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){2|H<1>,4|C<3>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[5,6](N[5,6]In[5,5]C[6])(N[5]N[5,5])(C[6]C[6]H){3|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	118.4610	0.000	1	118.4610	0.000	1	118.4610	0.000	1	118.4610	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[4,5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[4,5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]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){1|Ga<6>,2|H<1>,7|C<3>}	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	C[5,6](N[5,6]Ga[4,5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){2|N<3>,2|O<2>,3|C<3>,3|H<1>}	118.9464	0.887	16	118.9464	0.787	16	118.9464	0.787	16	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){1|C<3>,1|N<2>,2|H<1>,2|N<3>,2|S<2>}	119.8650	1.237	2	119.8650	1.531	2	119.7940	0.742	4	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]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){2|H<1>,2|N<2>,7|C<3>}	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]H){1|N<2>,2|H<1>,2|N<3>,2|S<2>,3|C<3>}	119.7230	0.822	2	119.7230	0.675	2	119.7940	0.742	4	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[5,5,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5,6]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]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){2|H<1>,9|C<3>}	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	C[5,6](N[5,6]Ga[5,5,6]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){2|N<3>,2|O<2>,3|C<3>,3|H<1>}	118.8030	0.443	4	118.8030	0.196	4	118.8030	0.196	4	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|H<1>,2|C<3>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){3|Br<1>,1|N<3>,3|C<3>,3|H<1>}	119.3725	0.449	2	119.3725	0.202	2	119.1317	0.186	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){3|Cl<1>,1|N<3>,3|C<3>,3|H<1>}	119.1960	0.042	2	119.1960	0.002	2	119.1317	0.186	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	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](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|F<1>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){1|N<3>,3|C<3>,3|F<1>,3|H<1>}	118.8265	0.644	2	118.8265	0.415	2	119.1317	0.186	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5,6]-3:C[6]-3:	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](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]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){2|H<1>,7|C<3>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|O<2>}	C[5,6](N[5,6]In[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){3|C<3>,3|H<1>,4|O<2>}	120.0115	0.139	2	120.0115	0.019	2	120.0115	0.019	2	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	C[5,6](N[5,6]In[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){1|C<3>,1|N<2>,2|H<1>,2|N<3>,2|S<2>}	119.2858	0.241	4	119.2858	0.058	4	119.2858	0.058	4	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(C[6]C[6]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){2|H<1>,5|C<3>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(C[6]C[6]H){3|Cl<1>,1|N<3>,3|C<3>,3|H<1>}	119.5855	0.523	2	119.5855	0.273	2	119.5855	0.273	2	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){2|Br<1>,1|C<3>,1|N<2>,1|O<3>,1|S<2>,2|H<1>}	119.4150	0.000	1	119.4150	0.000	1	119.7987	0.119	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|N<2>,1|O<2>,1|S<2>,2|H<1>}	120.0150	0.000	1	119.9715	0.004	2	119.7987	0.119	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]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){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|N<2>,1|O<3>,1|S<2>,2|H<1>}	119.9280	0.000	1	119.9715	0.004	2	119.7987	0.119	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]H)(C[6]C[6]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){1|N<2>,2|C<3>,3|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]H)(C[6]C[6]H){3|Cl<1>,1|C<3>,1|N<2>,1|S<2>,2|H<1>}	119.3150	0.000	1	119.3150	0.000	1	119.7987	0.119	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]O[5]O)(C[6]C[6]C)	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](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]O[5]O)(C[6]C[6]C){1|C<3>,1|N<3>,1|O<3>,2|H<1>,2|O<2>}	120.0595	0.112	2	120.0595	0.013	2	119.7987	0.119	6	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,5]N[5,5,6]C[5])(N[5,6]In[5,6]C[6])(C[6]C[6]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){2|H<1>,2|N<3>,3|C<3>}	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[5,6](C[5,5]N[5,5,6]C[5])(N[5,6]In[5,6]C[6])(C[6]C[6]H){2|Cl<1>,1|O<2>,2|C<3>,2|N<3>,3|H<1>}	118.5440	0.000	1	118.5440	0.000	1	118.5440	0.000	1	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	In[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](In[5]N[5]O[5]Cl3)(C[5,6]C[5]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5]C[6])(C[5]N[5]H)(C[6]C[6]H)	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](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	C[5,6](N[5,6]In[5]C[6])(C[5]N[5]H)(C[6]C[6]H){3|Cl<1>,1|O<3>,2|C<3>,2|H<1>}	118.1950	0.000	1	118.1950	0.000	1	118.1950	0.000	1	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	P[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]P[3x5]C[6])(C[6]C[6]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){2|H<1>,9|C<3>}	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H){1|H<1>,2|N<3>,2|O<2>,3|C<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]P[3x5]C[6])(C[6]C[6]H){1|N<3>,2|O<2>,3|H<1>,4|C<3>}	120.2790	0.185	2	120.2790	0.034	2	120.2790	0.034	2	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Si[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,5a]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](C[5,5a]N[5,5a]N[5a])(N[5,6]Si[5,5]C[6])(C[6]C[6]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){2|H<1>,3|N<2>,4|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[5,6](C[5,5a]N[5,5a]N[5a])(N[5,6]Si[5,5]C[6])(C[6]C[6]H){1|C<3>,2|H<1>,2|N<3>,4|N<2>}	118.5020	0.000	1	118.5020	0.000	1	118.5020	0.000	1	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Si[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5,6]-3:C[6]-3:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Si[5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){2|Cl<1>,2|N<3>,3|C<3>,3|H<1>}	119.1040	0.231	3	119.1040	0.053	3	119.1040	0.053	3	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](Si[5]N[5,6]Cl2HH)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H)	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,3|H<1>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){2|Cl<1>,3|C<3>,5|H<1>}	119.8640	0.416	2	119.8640	0.173	2	119.3476	0.264	7	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]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){2|H<1>,3|C<3>,4|N<2>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){2|N<2>,2|N<3>,3|C<3>,3|H<1>}	119.3347	0.276	3	119.1410	0.165	5	119.3476	0.264	7	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:3:3:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]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){2|H<1>,3|N<2>,4|C<3>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Si[5]C[6])(C[6]C[6]H){2|N<2>,2|N<3>,3|C<3>,3|H<1>}	118.8505	0.477	2	119.1410	0.165	5	119.3476	0.264	7	119.2541	0.508	59	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	B[4x3,4x5,12x6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[4x3,4x5,12x6]C[6])(C[5]C[3x3,4x5,12x6]HH)(C[6]C[6]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){1|B<5>,1|C<3>,4|B<6>,7|H<1>}	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|H<2>,3|B<6>}	C[5,6](N[5,6]B[4x3,4x5,12x6]C[6])(C[5]C[3x3,4x5,12x6]HH)(C[6]C[6]H){1|B<5>,1|C<3>,1|H<2>,2|H<1>,4|B<6>}	122.5570	0.000	1	122.5570	0.000	1	122.5570	0.000	1	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	B[5x3,6x5,20x6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]B[5x3,6x5,20x6]C[6])(C[5]C[5x3,6x5,20x6]HH)(C[6]C[6]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){1|C<3>,5|B<6>,8|H<1>}	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[5,6](N[5,6]B[5x3,6x5,20x6]C[6])(C[5]C[5x3,6x5,20x6]HH)(C[6]C[6]H){1|C<3>,2|H<1>,6|B<6>}	121.7050	0.000	1	121.7050	0.000	1	121.7050	0.000	1	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	Ga[3x5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[3x5,6,6]C[6])(C[5]N[3x5]HH)(C[6]C[6]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){3|C<3>,6|C<4>,6|H<1>}	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<4>}	C[5,6](N[5,6]Ga[3x5,6,6]C[6])(C[5]N[3x5]HH)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>,2|N<4>,2|O<2>}	119.1900	0.177	2	119.1900	0.031	2	119.1900	0.031	2	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	Ga[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){3|C<3>,3|C<4>,6|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>}	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|C<4>,1|N<3>,1|N<4>,3|H<1>}	118.8790	0.074	2	118.8790	0.005	2	118.8790	0.005	2	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	Ga[5,5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-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)	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5,5,6,6]C[6])(C[5]N[5,6]HH)(C[6]C[6]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){1|C<4>,2|S<4>,4|H<1>,5|C<3>}	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<3>}	C[5,6](N[5,6]Ga[5,5,6,6]C[6])(C[5]N[5,6]HH)(C[6]C[6]H){1|C<3>,1|S<4>,2|H<1>,2|N<3>,2|O<2>}	119.7735	0.018	2	119.7735	0.000	2	119.7735	0.000	2	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	Ga[5x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]Ga[5x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]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){4|H<1>,5|C<3>,5|C<4>}	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>,2|O<2>}	C[5,6](N[5,6]Ga[5x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]H){1|C<3>,1|N<3>,1|N<4>,2|C<4>,2|H<1>,2|O<2>}	119.6390	0.000	1	119.6390	0.000	1	119.6390	0.000	1	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	In[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-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)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[3x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]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){2|S<4>,3|C<3>,4|C<4>,4|H<1>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<4>,3|N<3>}	C[5,6](N[5,6]In[3x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]H){1|Cl<1>,1|C<3>,2|C<4>,2|H<1>,3|N<3>}	119.5950	0.000	1	119.5950	0.000	1	119.5950	0.000	1	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	In[5,5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5,6,6]C[6])(C[5]O[5]HH)(C[6]C[6]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){2|C<4>,4|H<1>,5|C<3>}	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>,3|O<2>}	C[5,6](N[5,6]In[5,5,6,6]C[6])(C[5]O[5]HH)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<3>,2|O<2>}	119.4495	0.320	2	119.4495	0.103	2	119.4495	0.103	2	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:1:	3:4:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	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](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]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){1|C<4>,3|C<3>,5|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){3|Br<1>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	119.7400	0.000	1	119.7400	0.000	1	119.7400	0.000	1	119.8323	1.176	13	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:3:	3:3:3:	In[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO)	C[5,6](N[5,6]In[3x5]C[6])(C[5]O[5]O)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]In[3x5]C[6])(C[5]O[5]O)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	119.2930	0.863	3	119.2930	0.745	3	119.2930	0.745	3	119.6298	0.613	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:3:3:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN)	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H)	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](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>}	C[5,6](N[5,6]In[5,5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){2|Cl<1>,1|H<1>,1|N<2>,2|C<3>,2|S<2>}	120.1350	0.330	2	120.1350	0.109	2	120.1350	0.109	2	119.6298	0.613	5	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	6:3:3:	3:4:3:	3:3:3:	In[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:P-4:C[6]-3:	C[5,6]-3:N[5,6]-3:C[6]-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)	C[6](N[5,6]In[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(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){2|H<1>,5|C<3>}	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>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]In[5,5]C[6])(C[6]C[6]H){1|Pd<4>,2|Cl<1>,1|N<3>,1|P<4>,2|H<1>,3|C<3>}	124.0855	0.175	2	124.0855	0.031	2	124.0855	0.031	2	124.0855	0.031	2	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP2_SP2_SP2	N[5,6]	C[6]	C[5,6]	7:3:3:	3:3:1:	3:3:3:	In[3x5]-7:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:C[6]-3:	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](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[5,6](N[5,6]In[3x5]C[6])(C[5]O[5]O)(C[6]C[6]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){1|O<1>,2|H<1>,5|C<3>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<3>,3|O<2>}	C[5,6](N[5,6]In[3x5]C[6])(C[5]O[5]O)(C[6]C[6]H){1|C<3>,1|N<3>,2|H<1>,2|O<2>,2|O<3>}	117.8330	0.000	1	117.8330	0.000	1	117.8330	0.000	1	117.8330	0.000	1	121.0672	3.809	437	121.0846	4.019	453
542	762	818	6:SP3_SP2_SP2	N[5,6]	C[6]	C[5,6,6]	3:3:3:	3:4:1:	4:3:3:	C[5,6,6]-3:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,5,6]-4:N[5,6]-3:C[6,6]-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)	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]HO)(O)	C[5,6,6](C[5,5,6]C[5,6,6]C[5,6a]C[5])(N[5,6]C[5,6a]C[6])(C[6,6]C[6,6]C[6])	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>}	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>}	C[5,6,6](C[5,5,6]C[5,6,6]C[5,6a]C[5])(N[5,6]C[5,6a]C[6])(C[6,6]C[6,6]C[6]){1|N<3>,1|O<1>,2|C<3>,4|C<4>,6|H<1>}	121.4250	0.000	1	121.4250	0.000	1	121.4250	0.000	1	121.4250	0.000	1	121.4250	0.000	1	119.7697	6.204	3
542	762	818	6:SP3_SP2_SP2	N[5,6]	C[6]	C[5,6]	3:4:3:	3:4:3:	3:3:3:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC)	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H)	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[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC){1|H<1>,2|O<1>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6]S[5])(C[6]C[6]H){1|C<4>,2|H<1>,2|O<1>,4|C<3>}	116.9050	0.000	1	116.9050	0.000	1	116.9050	0.000	1	116.9050	0.000	1	118.9420	8.299	2	119.7697	6.204	3
542	762	818	6:SP3_SP2_SP2	N[5,6]	C[6]	C[5,6]	4:3:3:	3:4:1:	3:3:3:	C[3,5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	N[5,6]-3:N[6]-3:C[5]-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)	C[6](N[5,6]C[3,5,6]C[5,6])(C[6]C[6]CC)(O)	C[5,6](N[5,6]C[3,5,6]C[6])(N[6]C[6a]C[6])(C[5]P[3,5]C)	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>}	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>}	C[5,6](N[5,6]C[3,5,6]C[6])(N[6]C[6a]C[6])(C[5]P[3,5]C){2|C<4>,2|O<1>,3|C<3>}	120.9790	0.000	1	120.9790	0.000	1	120.9790	0.000	1	120.9790	0.000	1	118.9420	8.299	2	119.7697	6.204	3
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5,5]	4:3:3:	3:3:1:	3:3:3:3:	Ga[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-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)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2	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](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2{4|H<1>,8|C<3>}	130.0760	0.000	1	130.0760	0.000	1	130.0760	0.000	1	130.0760	0.000	1	130.0760	0.000	1	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:3:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:I-1:I-1:	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6]C[5,6]C[6])(N[5]C[5]C)(I)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(N[5]C[5]C)(I)2{1|C<4>,2|C<3>,2|H<1>}	129.6570	0.000	1	129.6570	0.000	1	128.1485	4.551	2	128.1485	4.551	2	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:3:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:I-1:I-1:	N[5,6](C[5,6]C[5]C[6])(Ga[5]N[5]II)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(I)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(I)2{1|C<4>,2|H<1>,4|C<3>}	126.6400	0.000	1	126.6400	0.000	1	128.1485	4.551	2	128.1485	4.551	2	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:3:2:2:	C[5,6,6a]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6]-3:O-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)	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OC[6a])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](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>}	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OC[6a])2{2|H<1>,4|C<3>}	127.1400	0.000	1	127.1400	0.000	1	127.1400	0.000	1	127.1400	0.000	1	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:4:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:Cl-1:Cl-1:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]HH)(Cl)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]HH)(Cl)2{1|H<1>,2|C<3>,2|C<4>}	124.3570	0.000	1	124.3570	0.000	1	125.1195	1.163	2	125.1195	1.163	2	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:4:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:Cl-1:Cl-1:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]Cl2)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]Si2)(Cl)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]Si2)(Cl)2{1|H<1>,2|C<3>,2|C<4>}	125.8820	0.000	1	125.8820	0.000	1	125.1195	1.163	2	125.1195	1.163	2	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:1:	3:4:4:4:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-4:C[5]-4:C[5]-4:	N[5,6](C[5,6]Si[5]C[6])(Ga[5]C[5]3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]Si2)(C[5]C[5]2H)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(C[5]Si[5]Si2)(C[5]C[5]2H)2{2|C<4>,5|H<1>,6|C<3>}	125.3340	0.000	1	125.3340	0.000	1	125.3340	0.000	1	125.3340	0.000	1	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:3:	3:3:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:P-3:	N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]Cl2)(C[6]C[6]P)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2)	Ga[5](N[5,6]C[5,6]C[6])2(Cl)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])2(Cl)2{1|P<3>,5|C<3>}	126.6365	0.439	2	126.6365	0.193	2	126.6365	0.193	2	122.9070	18.656	4	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:3:	3:3:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6a]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	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](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H)	Ga[5](N[5,6]C[5,6]C[6])2(Cl)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])2(Cl)2{1|P<3>,5|C<3>}	119.1775	0.374	2	119.1775	0.140	2	119.1775	0.140	2	122.9070	18.656	4	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:4:	3:2:2:2:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:O[5]-2:O-2:O-2:	N[5,6](C[5,6]C[5]C[6])(Ga[5]O[5]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN)	Ga[5](N[5,6]C[5,6]C[6])(O[5]C[5])(OC)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](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>,3|O<2>}	Ga[5](N[5,6]C[5,6]C[6])(O[5]C[5])(OC)2{1|C<4>,1|O<1>,2|C<3>}	120.5820	0.000	1	120.5820	0.000	1	120.5820	0.000	1	120.5820	0.000	1	124.6573	11.088	12	125.0742	12.423	13
542	762	885	0:SP2_SP-NON_SP2	N[5,6]	C[6]	Ga[5]	3:4:3:	3:3:4:	3:4:1:1:	C[5,6]-3:Ga[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:P[5]-4:Cl-1:Cl-1:	N[5,6](C[5,6]C[5]C[6])(Ga[5]P[5]Cl2)(C[6]C[6]C)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3)	Ga[5](N[5,6]C[5,6]C[6])(P[5]C[5]CC)(Cl)2	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](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>}	Ga[5](N[5,6]C[5,6]C[6])(P[5]C[5]CC)(Cl)2{1|C<4>,1|H<1>,2|C<3>}	124.6680	0.000	1	124.6680	0.000	1	124.6680	0.000	1	124.6680	0.000	1	124.6573	11.088	12	125.0742	12.423	13
542	762	891	0:SP2_SP2_SP2	N[5,6]	C[6]	S[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:S[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(S[5]C[5])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	S[5](N[5,6]C[5,6]C[6])(C[5]N[5]N)	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	S[5](N[5,6]C[5,6]C[6])(C[5]N[5]N){1|Cu<4>,1|H<1>,2|C<3>}	125.6450	0.000	1	125.6450	0.000	1	125.6450	0.000	1	125.6450	0.000	1	125.3877	0.051	3	125.3877	0.051	3
542	762	891	0:SP2_SP2_SP2	N[5,6]	C[6]	S[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:S[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]C)(S[5]C[5])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3)	S[5](N[5,6]C[5,6]C[6])(C[5]N[5]N)	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>}	S[5](N[5,6]C[5,6]C[6])(C[5]N[5]N){1|Cu<4>,1|C<4>,2|C<3>}	125.2590	0.057	2	125.2590	0.003	2	125.2590	0.003	2	125.2590	0.003	2	125.3877	0.051	3	125.3877	0.051	3
542	762	894	0:SP2_SP2_SPD6	N[5,6]	C[6]	P[3x5]	6:3:3:	3:3:1:	3:3:3:3:2:2:	P[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:C[6a]-3:O[5]-2:O[5]-2:	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](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H)	P[3x5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(C[6a]C[6a]2)(O[5]C[5,6a])2	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](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>}	P[3x5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(C[6a]C[6a]2)(O[5]C[5,6a])2{10|C<3>,4|H<1>}	124.5090	0.331	2	124.5090	0.110	2	124.5090	0.110	2	124.5090	0.110	2	124.5090	0.110	2	124.7500	0.229	3
542	762	894	0:SP2_SP2_SPD6	N[5,6]	C[6]	P[5]	3:6:3:	3:3:1:	3:3:1:1:1:1:	C[5,6]-3:P[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:F-1:F-1:F-1:F-1:	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6]F4)(C[6]C[6]H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	P[5](C[5,6]N[5,6]C[6])(N[5,6]C[5,6]C[6])(F)4	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](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>}	P[5](C[5,6]N[5,6]C[6])(N[5,6]C[5,6]C[6])(F)4{2|H<1>,4|C<3>}	125.2320	0.000	1	125.2320	0.000	1	125.2320	0.000	1	125.2320	0.000	1	125.2320	0.000	1	124.7500	0.229	3
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[3x5]	6:3:3:	3:3:1:	3:3:3:3:2:2:	Si[3x5]-6:C[5,6,6a]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6a]-3:N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:	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](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H)	Si[3x5](N[5,6a]C[5,6a,6a]C[6a])2(N[5,6]C[5,6,6a]C[6])2(O[5]C[5,6a])2	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](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>}	Si[3x5](N[5,6a]C[5,6a,6a]C[6a])2(N[5,6]C[5,6,6a]C[6])2(O[5]C[5,6a])2{10|C<3>,4|H<1>}	129.4825	0.146	2	129.4825	0.021	2	129.4825	0.021	2	129.4825	0.021	2	129.4825	0.021	2	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,5]	6:3:3:	3:3:1:	3:3:3:3:1:1:	Si[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,6]C[5,6]C[6])4(Cl)2	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](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>}	Si[5,5](N[5,6]C[5,6]C[6])4(Cl)2{4|H<1>,8|C<3>}	126.2703	0.599	4	126.2703	0.359	4	126.2703	0.359	4	126.2703	0.359	4	126.1408	0.353	5	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,5]	6:3:3:	3:3:1:	3:3:3:3:2:2:	Si[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5a]-3:N[5,5a]-3:N[5,6]-3:N[5,6]-3:N-2:N-2:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5a]C[5,5a]N[5a])2(N[5,6]C[5,6]C[6])2(NN)2	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](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>}	Si[5,5](N[5,5a]C[5,5a]N[5a])2(N[5,6]C[5,6]C[6])2(NN)2{2|H<1>,4|C<3>,4|N<2>}	125.6230	0.000	1	125.6230	0.000	1	125.6230	0.000	1	125.6230	0.000	1	126.1408	0.353	5	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:1:1:1:1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:Cl-1:Cl-1:	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](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6,6a]C[6])2(Cl)4	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](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>}	Si[5](N[5,6]C[5,6,6a]C[6])2(Cl)4{2|H<1>,4|C<3>}	128.5235	0.149	2	128.5235	0.022	2	128.5235	0.022	2	128.5400	0.012	3	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:1:1:1:1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6]-3:Cl-1:Cl-1:Cl-1:Cl-1:	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](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(Cl)4	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](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>}	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(Cl)4{2|H<1>,4|C<3>}	128.5730	0.000	1	128.5730	0.000	1	128.5730	0.000	1	128.5400	0.012	3	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:2:1:1:1:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6]-3:C-2:F-1:F-1: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)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(CC)(F)3	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](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>}	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(CC)(F)3{2|H<1>,4|C<3>}	127.7850	0.061	2	127.7850	0.004	2	127.7850	0.004	2	125.6483	6.091	4	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:2:1:1:1:	C[5,6]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C-2:F-1:F-1:F-1:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CF3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(CC)(F)3	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](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>}	Si[5](N[5,6]C[5,6]C[6])2(CC)(F)3{2|H<1>,4|C<3>}	123.5115	0.076	2	123.5115	0.006	2	123.5115	0.006	2	125.6483	6.091	4	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:2:2:2:2:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N-2:N-2:N-2: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)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6,6a]C[6])2(NC)4	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](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>}	Si[5](N[5,6]C[5,6,6a]C[6])2(NC)4{2|H<1>,4|C<3>}	128.0355	0.101	2	128.0355	0.010	2	128.0355	0.010	2	128.0355	0.010	2	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:3:3:2:2:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5a]-3:N[5a]-3:N-2:N-2:	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](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6,6a]C[6])2(N[5a]N[5a]2)2(NN)2	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](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>}	Si[5](N[5,6]C[5,6,6a]C[6])2(N[5a]N[5a]2)2(NN)2{2|H<1>,2|N<2>,6|C<3>}	127.8545	0.489	2	127.8545	0.239	2	127.8545	0.239	2	127.9780	0.165	3	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	3:6:3:	3:3:1:	3:3:3:3:2:2:	C[5,6,6a]-3:Si[5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6]-3:N[5a]-3:N[5a]-3:N-2:N-2:	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](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(N[5a]N[5a]2)2(NN)2	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](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>}	Si[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(N[5a]N[5a]2)2(NN)2{2|H<1>,2|N<2>,6|C<3>}	128.2250	0.000	1	128.2250	0.000	1	128.2250	0.000	1	127.9780	0.165	3	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	6:3:3:	3:3:1:	3:3:1:1:1:1:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:H-1:H-1:	N[5,6](Si[5]N[5,6]Cl2HH)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(Cl)2(H)2	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](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>}	Si[5](N[5,6]C[5,6]C[6])2(Cl)2(H)2{2|H<1>,4|C<3>}	122.1420	0.677	2	122.1420	0.459	2	122.1420	0.459	2	122.1420	0.459	2	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	6:3:3:	3:3:1:	3:3:3:3:2:2:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5a]-3:N[5a]-3:N-2:N-2:	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(N[5a]C[5a]N[5a])(N[5a]N[5a]2)(NN)2	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](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>}	Si[5](N[5,6]C[5,6]C[6])2(N[5a]C[5a]N[5a])(N[5a]N[5a]2)(NN)2{1|C<4>,2|H<1>,3|N<2>,5|C<3>}	125.1960	0.789	2	125.1960	0.623	2	124.9526	0.259	5	124.9526	0.259	5	126.1718	5.261	19	126.4205	4.658	26
542	762	928	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5]	6:3:3:	3:3:1:	3:3:3:3:2:2:	Si[5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:N[5a]-3:N[5a]-3:N-2:N-2:	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](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(N[5a]N[5a]2)2(NN)2	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](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>}	Si[5](N[5,6]C[5,6]C[6])2(N[5a]N[5a]2)2(NN)2{2|H<1>,2|N<2>,6|C<3>}	124.7903	0.329	3	124.7903	0.108	3	124.9526	0.259	5	124.9526	0.259	5	126.1718	5.261	19	126.4205	4.658	26
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:3:	3:3:1:	3:3:3:3:2:2:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6,6a]-3:H-1:	N[5,6]-3:N[5,6]-3:C[6a]-3:C[6a]-3:O[6]-2:O[6]-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]H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(H)	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)2(O[6]C[6,6a])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]H){10|C<3>,1|H<1>}	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>}	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)2(O[6]C[6,6a])2{11|C<3>,5|H<1>}	123.5240	0.000	1	123.5240	0.000	1	123.5240	0.000	1	123.5240	0.000	1	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:3:	3:3:3:	3:3:3:3:2:2:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:C[6a]-3:C[6a]-3:O[6]-2:O[6]-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](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)2(O[6]C[6,6a])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]){12|C<3>,1|H<1>}	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>}	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)2(O[6]C[6,6a])2{11|C<3>,5|H<1>}	122.4180	0.000	1	122.4180	0.000	1	122.4180	0.000	1	122.4180	0.000	1	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:3:	3:3:4:	3:3:2:2:2:2:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6a]-3:S[5]-2:O[6]-2:O[6]-2:O[6]-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)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3	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](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>}	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3{2|C<4>,2|H<1>,8|C<3>}	120.0240	0.000	1	120.4723	0.154	3	120.4723	0.154	3	120.4723	0.154	3	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:3:	3:3:4:	3:3:2:2:2:2:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6a]-3:S[5]-2:O[6]-2:O[6]-2:O[6]-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)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3	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](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>}	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3{2|H<1>,3|C<4>,7|C<3>}	120.7490	0.000	1	120.4723	0.154	3	120.4723	0.154	3	120.4723	0.154	3	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:3:	3:3:4:	3:3:2:2:2:2:	Si[5,6,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[6a]-3:S[5]-2:O[6]-2:O[6]-2:O[6]-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)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3	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](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>}	Si[5,6,6](N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(O[6]C[6])3{2|H<1>,4|C<4>,6|C<3>}	120.6440	0.000	1	120.4723	0.154	3	120.4723	0.154	3	120.4723	0.154	3	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:4:	3:3:3:	3:3:2:2:2:2:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:N-2:N-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](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6,6a])2(NC)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){2|H<1>,6|C<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){1|C<4>,1|N<3>,2|N<2>,2|O<2>,4|C<3>,5|H<1>}	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6,6a])2(NC)2{4|H<1>,6|C<3>}	125.6508	0.434	4	125.6508	0.188	4	125.6508	0.188	4	125.6508	0.188	4	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:3:4:	3:3:3:	3:3:2:2:4:2:	Si[5,6,6]-6:C[6]-3:C[5]-4:	C[6,6a]-3:N[5,6]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:C-4:N-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](C[6,6a]C[6,6a]C[6a])(N[5,6]Si[5,6,6]C[5])(C[6a]C[6a]2)	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6,6a])2(CH3)(NC)	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](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>}	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6,6a])2(CH3)(NC){4|H<1>,6|C<3>}	125.6315	0.009	2	125.6315	0.000	2	125.6315	0.000	2	125.6315	0.000	2	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6,6]	6:4:3:	3:3:4:	3:3:2:2:2:2:	Si[5,6,6]-6:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:N-2:N-2:	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](N[5,6]Si[5,6,6]C[5])(C[6]C[6]H)(CH3)	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6])2(NC)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](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>}	Si[5,6,6](N[5,6]C[5]C[6])2(O[6]C[6])2(NC)2{2|C<3>,4|C<4>,4|H<1>}	125.8380	0.000	1	125.8380	0.000	1	125.8380	0.000	1	125.8380	0.000	1	123.9219	5.497	12	124.5942	10.913	13
542	762	928	6:SP2_SP2_SPD6	N[5,6]	C[6]	Si[5,6]	6:3:3:	3:3:1:	3:3:3:2:2:3:	Si[5,6]-6:C[5,6a]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:O-1:	N[5a]-3:N[5,6]-3:C[6a]-3:O[5]-2:O[6]-2:N[5]-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)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	Si[5,6](N[5a]C[5a,6a]C[5a])(N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(O[5]C[5,6a])(O[6]C[5,6])(N[5]C[5]2)	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>}	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>}	Si[5,6](N[5a]C[5a,6a]C[5a])(N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(O[5]C[5,6a])(O[6]C[5,6])(N[5]C[5]2){2|N<3>,2|O<1>,2|O<2>,4|H<1>,7|C<3>}	132.6610	0.000	1	132.6610	0.000	1	132.6610	0.000	1	132.6610	0.000	1	132.6610	0.000	1	124.5942	10.913	13
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5]	5:3:3:	3:3:1:	3:3:2:2:4:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5]-3:N[5,6]-3:S[5]-2:O-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)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(S[5]C[5,6a])(OC[6a])(CH3)	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](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>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(S[5]C[5,6a])(OC[6a])(CH3){3|H<1>,4|C<3>}	124.6610	0.000	1	124.6610	0.000	1	124.6610	0.000	1	124.6610	0.000	1	125.6591	0.247	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5]	5:3:3:	3:3:1:	3:3:3:2:1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5]-3:N[5,6]-3:C[6a]-3:S[5]-2:Br-1:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Br)	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](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>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Br){5|H<1>,6|C<3>}	126.0460	0.000	1	126.0460	0.000	1	126.0460	0.000	1	126.0077	0.003	3	125.6591	0.247	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5]	5:3:3:	3:3:1:	3:3:3:2:1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5]-3:N[5,6]-3:C[6a]-3:S[5]-2:Cl-1:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Cl)	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](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>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Cl){2|F<1>,3|H<1>,6|C<3>}	126.0310	0.000	1	125.9885	0.004	2	125.9885	0.004	2	126.0077	0.003	3	125.6591	0.247	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5]	5:3:3:	3:3:1:	3:3:3:2:1:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5]-3:N[5,6]-3:C[6a]-3:S[5]-2:Cl-1:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Cl)	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](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>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(Cl){5|H<1>,6|C<3>}	125.9460	0.000	1	125.9885	0.004	2	125.9885	0.004	2	126.0077	0.003	3	125.6591	0.247	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5]	5:3:3:	3:3:1:	3:3:3:2:2:	Si[5,5]-5:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,5]-3:N[5,6]-3:C[6a]-3:S[5]-2:N-2:	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](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(NC)	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](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>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(S[5]C[5,6a])(NC){5|H<1>,6|C<3>}	125.6433	0.239	3	125.6433	0.057	3	125.6433	0.057	3	125.6433	0.057	3	125.6591	0.247	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5]	3:5:3:	3:3:1:	3:3:1:1:1:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:Cl-1:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(Cl)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](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>}	Si[5](N[5,6]C[5,6]C[6])2(Cl)3{2|H<1>,4|C<3>}	123.9365	2.157	2	123.9365	4.654	2	123.9365	4.654	2	124.6118	1.662	5	124.7740	1.277	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5]	3:5:3:	3:3:1:	3:3:1:1:1:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:Cl-1:Cl-1:Cl-1:	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(Cl)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](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>}	Si[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(Cl)3{1|C<4>,2|H<1>,4|C<3>}	124.7860	0.126	2	125.0620	0.236	3	125.0620	0.236	3	124.6118	1.662	5	124.7740	1.277	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5]	3:5:3:	3:3:1:	3:3:1:1:1:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:Cl-1:Cl-1:Cl-1:	N[5,6](C[5,6]C[5]C[6])(Si[5]N[5]Cl3)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(Cl)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](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>}	Si[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(Cl)3{3|H<1>,4|C<3>}	125.6140	0.000	1	125.0620	0.236	3	125.0620	0.236	3	124.6118	1.662	5	124.7740	1.277	7	125.2166	0.914	14
542	762	931	0:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5]	3:5:3:	3:3:1:	3:3:4:4:2:	C[5,6]-3:Si[5]-5:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:C-4:C-4:O-2:	N[5,6](C[5,6]C[5,6]C[6])(Si[5]N[5,6]CCO)(C[6]C[6]H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	Si[5](N[5,6]C[5,6]C[6])2(CH3)2(OS)	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](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>}	Si[5](N[5,6]C[5,6]C[6])2(CH3)2(OS){2|H<1>,4|C<3>}	125.1795	0.746	2	125.1795	0.557	2	125.1795	0.557	2	125.1795	0.557	2	124.7740	1.277	7	125.2166	0.914	14
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5,6]	5:3:2:	3:4:4:	3:3:2:2:4:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]CH)(CCHH)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<3>,1|H<1>,1|N<2>,3|C<4>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]CH)(CCHH){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	130.9010	0.000	1	130.9010	0.000	1	129.3438	1.585	4	129.3438	1.585	4	129.3438	1.585	4	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5,6]	5:3:2:	3:4:4:	3:3:2:2:4:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH)	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH){2|C<3>,4|C<4>}	128.4885	0.919	2	128.4885	0.844	2	129.3438	1.585	4	129.3438	1.585	4	129.3438	1.585	4	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,5,6]	5:3:2:	3:4:4:	3:3:2:2:4:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	129.4970	0.000	1	129.4970	0.000	1	129.3438	1.585	4	129.3438	1.585	4	129.3438	1.585	4	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,6,6]	5:3:3:	3:3:3:	3:3:3:2:2:	Si[5,6,6]-5:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:C[6a]-3:O[6]-2:O[6]-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](N[5,6]Si[5,6,6]C[5,6a])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)(O[6]C[6,6a])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]){1|C<4>,1|H<1>,9|C<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){1|N<3>,2|O<2>,3|H<1>,7|C<3>}	Si[5,6,6](N[5,6]C[5,6a]C[6])2(C[6a]C[6a]2)(O[6]C[6,6a])2{10|C<3>,3|H<1>}	120.6120	0.304	2	120.6120	0.092	2	120.6120	0.092	2	120.6120	0.092	2	120.6120	0.092	2	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,6]	5:3:3:	3:3:1:	3:3:3:2:2:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:O-1:	N[5a]-3:N[5,6]-3:C[6a]-3:O[5]-2:O[6]-2:	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)	C[6](N[5,6]C[5,6a]Si[5,6])(N[5,6]C[5,6a]C[5,6])(O)	Si[5,6](N[5a]C[5a,6a]C[5a])(N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(O[5]C[5,6a])(O[6]C[5,6])	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>}	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>}	Si[5,6](N[5a]C[5a,6a]C[5a])(N[5,6]C[5,6a]C[6])(C[6a]C[6a]2)(O[5]C[5,6a])(O[6]C[5,6]){1|N<3>,2|H<1>,2|O<1>,2|O<2>,6|C<3>}	132.8705	0.045	2	132.8705	0.002	2	132.8705	0.002	2	132.8705	0.002	2	127.4088	18.231	6	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,6]	5:3:3:	3:3:3:	3:4:2:2:4:	Si[5,6]-5:C[5,6a]-3:C[6]-3:	N[5,6]-3:C[6,6a]-3:C[6a]-3:	N[5,6]-3:Si[5]-4:O[5]-2:O[6]-2:C-4:	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](N[5,6]C[5,6a]Si[5,6])(C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)	Si[5,6](N[5,6]C[5,6a]C[6])(Si[5]N[5]2C)(O[5]C[5,6a])(O[6]C[6,6a])(CH3)	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](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>}	Si[5,6](N[5,6]C[5,6a]C[6])(Si[5]N[5]2C)(O[5]C[5,6a])(O[6]C[6,6a])(CH3){2|C<4>,7|C<3>}	125.7040	0.000	1	125.7040	0.000	1	125.7040	0.000	1	125.7040	0.000	1	127.4088	18.231	6	126.9210	18.229	12
542	762	931	6:SP2_SP2_SPD5	N[5,6]	C[6]	Si[5,6]	5:4:3:	3:3:4:	3:2:2:4:4:	Si[5,6]-5:C[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:O[5]-2:O[6]-2:C-4:C-4:	N[5,6](Si[5,6]O[5]O[6]CC)(C[5]C[5]CH)(C[6]C[6]C)	C[6](N[5,6]Si[5,6]C[5])(C[6]C[6]H)(CH3)	Si[5,6](N[5,6]C[5]C[6])(O[5]C[5])(O[6]C[6])(CH3)2	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](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>}	Si[5,6](N[5,6]C[5]C[6])(O[5]C[5])(O[6]C[6])(CH3)2{1|C<3>,1|H<1>,1|O<1>,3|C<4>}	124.3360	0.362	3	124.3360	0.131	3	124.3360	0.131	3	124.3360	0.131	3	127.4088	18.231	6	126.9210	18.229	12
542	762	939	0:SP2_SP2_SP2	N[5,6]	C[6]	Ge[5,6]	3:3:3:	3:3:1:	3:3:3:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6,6]-3:N[5,6]-3:N[6,6]-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)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	Ge[5,6](N[5,6,6]C[5,6,6]C[6])(N[5,6]C[5,6]C[6])(N[6,6]C[6,6]C[6])	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](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>}	Ge[5,6](N[5,6,6]C[5,6,6]C[6])(N[5,6]C[5,6]C[6])(N[6,6]C[6,6]C[6]){3|C<4>,4|C<3>,4|H<1>}	122.4620	0.000	1	122.4620	0.000	1	122.4620	0.000	1	122.4620	0.000	1	122.8930	0.372	2	122.8930	0.372	2
542	762	939	0:SP2_SP2_SP2	N[5,6]	C[6]	Ge[5,6]	3:3:3:	3:3:1:	4:3:3:	Ge[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6,6]-4:N[5,6]-3:N[6,6]-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)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	Ge[5,6](N[5,6,6]C[5,6,6]C[6]H)(N[5,6]C[5,6]C[6])(N[6,6]C[6,6]C[6])	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](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>}	Ge[5,6](N[5,6,6]C[5,6,6]C[6]H)(N[5,6]C[5,6]C[6])(N[6,6]C[6,6]C[6]){3|C<4>,4|C<3>,4|H<1>}	123.3240	0.000	1	123.3240	0.000	1	123.3240	0.000	1	123.3240	0.000	1	122.8930	0.372	2	122.8930	0.372	2
542	762	946	0:SP2_SP1_SP2	N[5,6]	C[6]	Ge[5]	3:2:3:	3:3:1:	3:3:	C[5,6,6a]-3:Ge[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6a]-3:N[5,6]-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)	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H)	Ge[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])	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](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	Ge[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6]){2|H<1>,4|C<3>}	126.7100	0.000	1	126.7100	0.000	1	126.7100	0.000	1	124.3530	4.170	3	124.3530	4.170	3	124.3530	4.170	3
542	762	946	0:SP2_SP1_SP2	N[5,6]	C[6]	Ge[5]	3:2:3:	3:3:1:	3:3:	C[5,6]-3:Ge[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5,6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	Ge[5](N[5,6]C[5,6]C[6])2	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](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	Ge[5](N[5,6]C[5,6]C[6])2{2|H<1>,4|C<3>}	123.1745	0.081	2	123.1745	0.007	2	123.1745	0.007	2	124.3530	4.170	3	124.3530	4.170	3	124.3530	4.170	3
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:3:4:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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](N[5,6]C[5,6]S[5])(C[6]C[6]C)(CH3){1|H<1>,2|O<1>,4|C<3>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,4|C<3>}	124.0090	0.000	1	124.0090	0.000	1	123.7790	0.106	2	123.7790	0.106	2	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:3:4:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-3:C-4:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH){1|H<1>,2|O<1>,4|C<3>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,4|C<3>}	123.5490	0.000	1	123.5490	0.000	1	123.7790	0.106	2	123.7790	0.106	2	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:4:1:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]CH)(O)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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>}	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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,1|O<1>,3|C<3>}	122.7450	0.000	1	122.7450	0.000	1	121.4980	1.175	3	121.4980	1.175	3	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:4:1:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:O-1:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]O)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6a]C[6]H)(O)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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>}	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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,1|O<1>,3|C<3>}	120.8745	0.135	2	120.8745	0.018	2	121.4980	1.175	3	121.4980	1.175	3	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:4:3:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCH){1|H<1>,2|O<1>,4|C<3>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,4|C<3>}	124.1440	0.000	1	124.1440	0.000	1	124.1440	0.000	1	124.1440	0.000	1	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	4:4:3:	3:3:1:	3:3:1:1:	C[5,6]-4:S[5]-4:C[6]-3:	C[6,6a]-3:N[5,6]-3:O-1:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	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](C[6,6a]C[5a,6,6a]C[6a])(N[5,6]C[5,6]S[5])(O)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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](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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|H<1>,1|N<3>,1|O<1>,4|C<3>}	120.3960	0.000	1	120.3960	0.000	1	120.3960	0.000	1	120.7115	0.199	2	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	4:4:3:	3:3:1:	3:3:1:1:	C[5,6]-4:S[5]-4:C[6]-3:	N[5,6]-3:N[6]-3:O-1:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6,6a]H)(S[5]C[5,6a]OO)(C[6]N[6]O)	C[6](N[5,6]C[5,6]S[5])(N[6]C[6,6a]H)(O)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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>}	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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|N<3>,1|O<1>,2|H<1>,3|C<3>}	121.0270	0.000	1	121.0270	0.000	1	121.0270	0.000	1	120.7115	0.199	2	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP2_SP2_SP3	N[5,6]	C[6]	S[5]	4:4:3:	3:4:3:	3:3:1:1:	C[4,5,6]-4:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	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[6](N[5,6]C[4,5,6]S[5])(C[6]C[6]HH)(CCC)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[4,5,6]C[6])(O)2	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[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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[4,5,6]C[6])(O)2{1|H<1>,2|C<4>,4|C<3>}	113.5250	0.000	1	113.5250	0.000	1	113.5250	0.000	1	113.5250	0.000	1	121.2382	10.533	9	121.2382	10.533	9
542	762	959	0:SP3_SP2_SP3	N[5,6]	C[6]	S[5]	3:4:3:	3:4:3:	3:3:1:1:	C[5,6]-3:S[5]-4:C[6]-3:	N[5,6]-3:C[6]-4:C-3:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	N[5,6](C[5,6]C[5,6a]C[6])(S[5]C[5,6a]OO)(C[6]C[6]C)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC)	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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[6](N[5,6]C[5,6]S[5])(C[6]C[6]HH)(CCC){1|H<1>,2|O<1>,4|C<3>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|C<4>,1|H<1>,4|C<3>}	121.3790	0.000	1	121.3790	0.000	1	121.3790	0.000	1	121.3790	0.000	1	120.2617	2.764	3	120.2617	2.764	3
542	762	959	0:SP3_SP2_SP3	N[5,6]	C[6]	S[5]	4:4:3:	3:3:2:	3:3:1:1:	C[5,6]-4:S[5]-4:C[6]-3:	N[5,6]-3:C[6a]-3:N[6]-2:	C[5,6a]-3:N[5,6]-3:O-1:O-1:	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[6](N[5,6]C[5,6]S[5])(C[6a]C[6a]2)(N[6]C[6,6a])	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2	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[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>}	S[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(O)2{1|N<2>,2|H<1>,4|C<3>}	119.7030	1.912	2	119.7030	3.656	2	119.7030	3.656	2	119.7030	3.656	2	120.2617	2.764	3	120.2617	2.764	3
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:2:1:	3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-2:C-1:	N[5,6]-3:C[5]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(C)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5])	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5]){1|C<3>}	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](N[5,6]C[5,6]C[6])(C[5]N[5]){1|C<1>,1|C<2>,1|N<2>}	127.2990	0.000	1	127.2990	0.000	1	127.2990	0.000	1	126.7110	0.691	2	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:2:1:	3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-2:O-1:	N[5,6]-3:C[5]-2:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6])(O)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5])	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5]){1|C<3>}	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](N[5,6]C[5,6]C[6])(C[5]N[5]){1|C<2>,1|N<2>,1|O<1>}	126.1230	0.000	1	126.1230	0.000	1	126.1230	0.000	1	126.7110	0.691	2	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(N[5]N[5])	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](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](N[5,6]C[5,6]C[6])(N[5]N[5]){1|Co<6>,1|H<1>,2|C<3>}	126.8280	0.000	1	126.4785	0.244	2	126.4785	0.244	2	126.4785	0.244	2	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:2:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-2:	N[5,6](C[5,6]C[6]N[5])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(N[5]N[5])	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](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](N[5,6]C[5,6]C[6])(N[5]N[5]){1|Mn<6>,1|H<1>,2|C<3>}	126.1290	0.000	1	126.4785	0.244	2	126.4785	0.244	2	126.4785	0.244	2	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>}	127.9040	0.000	1	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>}	128.3000	0.000	1	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>}	127.3775	0.186	2	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>}	128.3530	0.000	1	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>}	127.7875	0.180	4	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]H)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Ag<5>,1|C<3>,1|H<1>,1|N<3>}	127.2065	0.078	2	127.7159	0.169	11	127.7159	0.169	11	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(N[5]C[5]Co)	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](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](N[5,6]C[5,6]C[6])(N[5]C[5]Co){1|H<1>,3|C<3>}	124.3240	0.000	1	124.3240	0.000	1	124.2150	0.225	4	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	N[5](N[5,6]C[5,6]C[6])(N[5]C[5]Fe)	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](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](N[5,6]C[5,6]C[6])(N[5]C[5]Fe){1|H<1>,3|C<3>}	124.1787	0.574	3	124.1787	0.330	3	124.2150	0.225	4	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Pt<4>,1|C<3>,1|N<3>,1|O<1>}	125.0130	0.346	2	125.1000	0.078	4	125.1000	0.078	4	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:O-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Pd<4>,1|C<3>,1|N<3>,1|O<1>}	125.1870	0.288	2	125.1000	0.078	4	125.1000	0.078	4	126.4282	2.638	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C[6]-3:	N[5,6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]2)(N[5]N[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[5](N[5,6]C[5,6]C[6])(N[5]C[5]Zn)	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](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](N[5,6]C[5,6]C[6])(N[5]C[5]Zn){1|C<4>,3|C<3>}	124.9270	0.000	1	124.9270	0.000	1	124.9270	0.000	1	125.5720	0.858	5	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Zn<6>,1|C<3>,1|N<2>,1|N<3>}	126.2760	0.069	2	125.7332	0.970	4	125.7332	0.970	4	125.5720	0.858	5	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:N-3:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]N)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Cu<5>,1|C<3>,2|N<3>}	125.1905	1.315	2	125.7332	0.970	4	125.7332	0.970	4	125.5720	0.858	5	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Cu<5>,1|C<3>,1|C<4>,1|N<2>}	127.6140	0.000	1	127.6140	0.000	1	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]C)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Ru<9>,1|C<3>,1|C<4>,1|N<2>}	126.1550	0.000	1	126.1550	0.000	1	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Pt<4>,1|C<3>,1|C<4>,1|N<2>}	126.4710	0.079	2	126.5420	0.018	3	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Ru<9>,1|C<3>,1|C<4>,1|N<2>}	126.6840	0.000	1	126.5420	0.018	3	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Co<6>,1|C<3>,1|C<4>,1|N<2>}	127.4010	0.000	1	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Cu<5>,1|C<3>,1|C<4>,1|N<2>}	126.6476	0.245	5	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Fe<6>,1|C<3>,1|C<4>,1|N<2>}	127.4350	0.000	1	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Mn<6>,1|C<3>,1|C<4>,1|N<2>}	127.7310	0.000	1	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Ni<6>,1|C<3>,1|C<4>,1|N<2>}	127.3770	0.000	1	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Pt<4>,1|C<3>,1|C<4>,1|N<2>}	126.3690	0.320	2	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Zn<4>,1|C<3>,1|C<4>,1|N<2>}	127.3945	0.334	2	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	3:3:2:	3:3:4:	3:3:	C[5,6]-3:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]N[5]N[6])(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]N[5]H)	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](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](N[5,6]C[5,6]C[6])(C[5]N[5]H){1|Zn<6>,1|C<3>,1|C<4>,1|N<2>}	127.6120	0.000	1	127.0229	0.275	14	126.9324	0.292	19	126.9324	0.292	19	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	4:3:2:	3:2:1:	3:3:	C[5,6]-4:C[6]-3:N[5]-2:	N[5,6]-3:O[6]-2:O-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]O[6]O)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(O[6]C[6,6a])(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)	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>}	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](N[5,6]C[5,6]C[6])(C[5]C[5]C){1|C<3>,1|O<1>,1|O<2>,3|H<1>}	121.6220	0.000	1	121.6220	0.000	1	121.6220	0.000	1	121.6220	0.000	1	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	4:3:2:	3:3:1:	3:3:	C[5,6]-4:C[6]-3:N[5]-2:	N[5,6]-3:N[6]-3:S-1:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[5]C[6]H)(C[6]N[6]S)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(N[6]C[6]H)(S)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)	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>}	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](N[5,6]C[5,6]C[6])(C[5]C[5]C){1|N<3>,1|S<1>,2|C<3>,2|H<1>}	122.9350	0.000	1	122.9350	0.000	1	122.9350	0.000	1	122.9350	0.000	1	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	4:3:2:	3:3:3:	3:3:	C[5,6]-4:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-3:C[6a]-3:	N[5,6]-3:C[5]-3:	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](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5,5]C)	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](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](N[5,6]C[5,6]C[6])(C[5]C[5,5]C){1|H<1>,5|C<3>}	124.2830	0.000	1	124.2830	0.000	1	124.2830	0.000	1	124.2830	0.000	1	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	4:3:2:	3:3:4:	3:3:	C[5,6]-4:C[6]-3:N[5]-2:	N[5,6]-3:N[6]-3:C-4:	N[5,6]-3:C[5]-3:	N[5,6](C[5,6]C[6,6a]S[5]C)(C[6]N[6]C)(N[5]C[5])	C[6](N[5,6]C[5,6]N[5])(N[6]C[6,6a]H)(CH3)	N[5](N[5,6]C[5,6]C[6])(C[5]S[5]N)	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>}	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](N[5,6]C[5,6]C[6])(C[5]S[5]N){1|C<4>,1|N<3>,2|C<3>}	121.3480	0.000	1	121.3480	0.000	1	121.3480	0.000	1	121.3480	0.000	1	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	5:3:2:	3:4:4:	3:3:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:C[5]-3:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]CH)(CCHH)	N[5](N[5,6]Si[5,5,6]C[6])(C[5]O[5]C)	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<3>,1|H<1>,1|N<2>,3|C<4>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]CH)(CCHH){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	N[5](N[5,6]Si[5,5,6]C[6])(C[5]O[5]C){1|N<3>,1|O<2>,3|C<4>}	118.2790	0.000	1	118.2790	0.000	1	118.2527	0.074	4	118.2527	0.074	4	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	5:3:2:	3:4:4:	3:3:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:C[5]-3:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3)	N[5](N[5,6]Si[5,5,6]C[6])(C[5]C[6a]O[5])	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	N[5](N[5,6]Si[5,5,6]C[6])(C[5]C[6a]O[5]){1|N<3>,1|O<2>,2|C<3>,3|C<4>}	118.1115	0.342	2	118.1115	0.117	2	118.2527	0.074	4	118.2527	0.074	4	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	5:3:2:	3:4:4:	3:3:	Si[5,5,6]-5:C[6]-3:N[5]-2:	N[5,6]-3:C[6]-4:C-4:	N[5,6]-3:C[5]-3:	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5])	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3)	N[5](N[5,6]Si[5,5,6]C[6])(C[5]O[5]C)	N[5,6](Si[5,5,6]N[5,6]O[5]2C)(C[6]C[6]C)(N[5]C[5]){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](N[5,6]Si[5,5,6]N[5])(C[6]C[6]HH)(CH3){1|C<3>,1|N<3>,2|O<2>,3|C<4>}	N[5](N[5,6]Si[5,5,6]C[6])(C[5]O[5]C){1|N<3>,1|O<2>,3|C<4>}	118.5090	0.000	1	118.5090	0.000	1	118.2527	0.074	4	118.2527	0.074	4	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5,6]	C[6]	N[5]	6:3:2:	3:3:1:	3:3:	In[5,5,6,6]-6:C[6]-3:N[5]-2:	N[5,6]-3:C[6,6a]-3:H-1:	N[5,6]-3:C[5]-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])	C[6](N[5,6]In[5,5,6,6]N[5])(C[6,6a]C[6,6a]C[6a])(H)	N[5](N[5,6]In[5,5,6,6]C[6])(C[5]S[5]N)	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](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](N[5,6]In[5,5,6,6]C[6])(C[5]S[5]N){1|C<3>,1|H<1>,1|N<3>,1|S<2>,2|O<2>}	113.5370	0.243	2	113.5370	0.059	2	113.5370	0.059	2	113.5370	0.059	2	125.2344	11.612	57	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:2:3:	4:3:3:	3:3:	N[5]-3:N[5]-2:C[6]-3:	C[6]-4:C[6]-3:N[5]-3:	C[5,6a]-3:N[5]-3:	N[5](N[5]C[5,6a]Ta)(N[5]C[5,6a])(C[6]C[6]2)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(N[5]N[5]2)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6]N[5])	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]TaO)(C[6]C[6]H)(N[5]N[5]2){1|C<4>,1|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6]N[5]){1|Ta<7>,1|C<4>,1|H<1>,3|C<3>}	120.3670	0.000	1	120.3670	0.000	1	120.3670	0.000	1	120.3670	0.000	1	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[5]-3:C[6]-3:N[5]-2:	N[5]-3:C[6]-3:C[6]-3:	N[5]-3:C[5]-3:	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]C[5])	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	N[5](N[5]C[5]C[6])(C[5]C[5]N)	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](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	N[5](N[5]C[5]C[6])(C[5]C[5]N){1|H<1>,2|C<3>}	120.4250	0.000	1	120.4250	0.000	1	120.4250	0.000	1	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[5]-3:C[6]-3:N[5]-2:	N[5]-3:C[6]-3:C[6]-3:	N[5]-3:N[5]-3:	N[5](C[5]C[5]H)(C[6]C[6]2)(N[5]N[5])	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	N[5](N[5]C[5]C[6])(N[5]C[5]C)	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](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](N[5]C[5]C[6])(N[5]C[5]C){1|H<1>,3|C<3>}	119.3110	0.000	1	119.3110	0.000	1	119.3110	0.000	1	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[5]-3:N[5]-2:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:N[5]-3:	N[5](C[6]C[6]N[6])(C[5]C[5]Ir)(N[5]N[5])	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	N[5](N[5]C[6a]C[5])(N[5]C[5]C[6])	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](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](N[5]C[6a]C[5])(N[5]C[5]C[6]){1|Ir<8>,1|C<4>,1|N<3>,3|C<3>}	122.1690	1.424	2	122.1690	2.028	2	122.6592	2.927	6	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[5]-3:N[5]-2:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:N[5]-3:	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5])	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](N[5]C[5]C[6])(N[5]C[5]C)	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](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](N[5]C[5]C[6])(N[5]C[5]C){1|Ru<9>,1|C<3>,1|N<3>,1|O<2>}	123.6140	3.086	2	122.9043	3.962	4	122.6592	2.927	6	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[5]-3:N[5]-2:	N[5]-3:N[6]-3:C[6]-3:	N[5]-3:N[5]-3:	N[5](C[6]C[6]N[6])(C[5]C[5]Ru)(N[5]N[5])	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	N[5](N[5]C[5]C[6])(N[5]C[5]C)	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](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](N[5]C[5]C[6])(N[5]C[5]C){1|Ru<9>,1|N<3>,2|C<3>}	122.1945	0.590	2	122.9043	3.962	4	122.6592	2.927	6	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	960	0:SP2_SP2_SP2	N[5]	C[6]	N[5]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[5]-3:N[5]-2:	N[6]-3:N[5]-3:C[6]-3:	N[5]-3:C[5]-3:	N[5](C[6]C[6]N[6])(C[5]N[5]Cu)(N[5]C[5])	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	N[5](N[5]C[5]C[6])(C[5]N[5]H)	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](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](N[5]C[5]C[6])(C[5]N[5]H){1|Cu<3>,1|C<3>,1|C<4>,1|N<3>}	118.3090	0.000	1	118.3090	0.000	1	118.3090	0.000	1	121.5556	4.850	9	121.4367	4.452	10	124.6676	12.319	67
542	762	964	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[4,5,5]	3:6:3:	3:3:1:	3:2:2:2:3:3:	C[5,6,6a]-3:Si[4,5,5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:N[4]-3:N[4]-3:	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](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H)	Si[4,5,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])3(N[4]C[4]C)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](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>}	Si[4,5,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])3(N[4]C[4]C)2{1|H<1>,6|C<3>}	131.3080	0.000	1	131.3080	0.000	1	131.3080	0.000	1	131.3080	0.000	1	131.3080	0.000	1	132.0643	0.219	6
542	762	964	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[4,5]	3:6:3:	3:3:1:	3:2:3:3:1:1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:Br-1:Br-1:	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](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Br)2	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](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>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Br)2{1|H<1>,4|C<3>}	132.1390	0.000	1	132.1390	0.000	1	132.1390	0.000	1	132.3180	0.064	2	132.2156	0.102	5	132.0643	0.219	6
542	762	964	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[4,5]	3:6:3:	3:3:1:	3:2:3:3:1:1:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:Cl-1:Cl-1:	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](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Cl)2	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](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>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(Cl)2{1|H<1>,4|C<3>}	132.4970	0.000	1	132.4970	0.000	1	132.4970	0.000	1	132.3180	0.064	2	132.2156	0.102	5	132.0643	0.219	6
542	762	964	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[4,5]	3:6:3:	3:3:1:	3:2:3:3:2:2:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:N-2:N-2:	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](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NC)2	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](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>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NC)2{1|H<1>,4|C<3>}	132.1170	0.552	2	132.1170	0.304	2	132.1473	0.155	3	132.1473	0.155	3	132.2156	0.102	5	132.0643	0.219	6
542	762	964	0:SP2_SP2_SPD6	N[5,6]	C[6]	Si[4,5]	3:6:3:	3:3:1:	3:2:3:3:2:2:	C[5,6,6a]-3:Si[4,5]-6:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:O[5]-2:N[4]-3:N[4]-3:N-2:N-2:	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](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NN)2	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](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>}	Si[4,5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(N[4]C[4]C)2(NN)2{1|H<1>,4|C<3>}	132.2080	0.000	1	132.2080	0.000	1	132.1473	0.155	3	132.1473	0.155	3	132.2156	0.102	5	132.0643	0.219	6
542	762	976	0:SP2_SP2_SP3	N[5,6]	C[6]	O[5]	3:2:3:	3:3:3:	3:6:	C[5,6]-3:O[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:In[3x5]-6:	N[5,6](C[5,6]C[6,6a]O[5])(O[5]In[3x5])(C[6]C[6]C)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO)	O[5](N[5,6]C[5,6]C[6])(In[3x5]O[5]5)	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](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO){1|In<6>,1|O<2>,2|C<3>}	O[5](N[5,6]C[5,6]C[6])(In[3x5]O[5]5){2|N<3>,5|C<3>}	119.1900	0.000	1	119.1900	0.000	1	119.1900	0.000	1	119.1900	0.000	1	118.6286	4.735	5	118.6286	4.735	5
542	762	976	0:SP2_SP2_SP3	N[5,6]	C[6]	O[5]	3:3:2:	3:3:1:	3:2:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Ge[5]-2:	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]Ge[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	O[5](N[5,6]C[5,6]C[6])(Ge[5]S[5])	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](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>}	O[5](N[5,6]C[5,6]C[6])(Ge[5]S[5]){1|H<1>,2|C<3>}	116.4620	0.000	1	116.4620	0.000	1	116.4620	0.000	1	116.4620	0.000	1	118.6286	4.735	5	118.6286	4.735	5
542	762	976	0:SP2_SP2_SP3	N[5,6]	C[6]	O[5]	3:3:2:	3:3:1:	3:5:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-5:	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	O[5](N[5,6]C[5,6]C[6])(Si[5]O[5]CCO)	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](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>}	O[5](N[5,6]C[5,6]C[6])(Si[5]O[5]CCO){1|H<1>,2|C<3>}	120.5200	0.000	1	120.5200	0.000	1	120.6380	0.028	2	120.6380	0.028	2	118.6286	4.735	5	118.6286	4.735	5
542	762	976	0:SP2_SP2_SP3	N[5,6]	C[6]	O[5]	3:3:2:	3:3:1:	3:5:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:Si[5]-5:	N[5,6](C[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	O[5](N[5,6]C[5,6]C[6])(Si[5]O[5]ClCC)	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](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>}	O[5](N[5,6]C[5,6]C[6])(Si[5]O[5]ClCC){1|H<1>,2|C<3>}	120.7560	0.000	1	120.7560	0.000	1	120.6380	0.028	2	120.6380	0.028	2	118.6286	4.735	5	118.6286	4.735	5
542	762	976	0:SP2_SP2_SP3	N[5,6]	C[6]	O[5]	3:3:2:	3:3:1:	6:3:	C[5,6]-3:C[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	In[5]-6:N[5,6]-3:	N[5,6](C[5,6]C[6]S[5])(C[6]C[6]H)(O[5]In[5])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	O[5](In[5]O[5]2S[5]Cl2)(N[5,6]C[5,6]C[6])	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](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>}	O[5](In[5]O[5]2S[5]Cl2)(N[5,6]C[5,6]C[6]){1|H<1>,2|C<3>,4|C<4>}	116.2150	0.000	1	116.2150	0.000	1	116.2150	0.000	1	116.2150	0.000	1	118.6286	4.735	5	118.6286	4.735	5
542	762	987	0:SP2_SP-NON_SP2	N[5,6]	C[6]	P[5]	3:2:3:	3:3:1:	3:3:	C[5,6]-3:P[5]-2:C[6]-3:	N[5,6]-3:C[6]-3:H-1:	C[5,6]-3:N[5,6]-3:	N[5,6](C[5,6]N[5,6]C[6])(P[5]C[5,6])(C[6]C[6]H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	P[5](C[5,6]N[5,6]C[6])(N[5,6]C[5,6]C[6])	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	P[5](C[5,6]N[5,6]C[6])(N[5,6]C[5,6]C[6]){2|H<1>,4|C<3>}	125.0550	0.000	2	125.0550	0.000	2	125.0550	0.000	2	125.0550	0.000	2	123.9668	2.907	5	123.9668	2.907	5
542	762	987	0:SP2_SP-NON_SP2	N[5,6]	C[6]	P[5]	3:3:2:	3:3:1:	3:3:	C[5,6]-3:C[6]-3:P[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(P[5]N[5])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5]){2|H<1>,4|C<3>}	124.3440	0.000	1	124.3440	0.000	1	124.3440	0.000	1	124.3440	0.000	1	123.9668	2.907	5	123.9668	2.907	5
542	762	987	0:SP2_SP-NON_SP2	N[5,6]	C[6]	P[5]	3:3:2:	3:3:3:	3:3:	C[5,6]-3:C[6]-3:P[5]-2:	N[5,6]-3:C[6]-3:C-3:	N[5,6]-3:N[5]-3:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]C)(P[5]N[5])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN)	P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])	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](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN){1|H<1>,1|N<3>,2|C<3>}	P[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5]){1|H<1>,5|C<3>}	122.6900	2.420	2	122.6900	5.855	2	122.6900	5.855	2	122.6900	5.855	2	123.9668	2.907	5	123.9668	2.907	5
542	762	997	0:SP2_SP2_SP3	N[5,6]	C[6]	Se[5]	3:3:2:	3:3:1:	3:2:	C[5,6]-3:C[6]-3:Se[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6]-3:N[5]-2:	N[5,6](C[5,6]C[5]C[6])(C[6]C[6]H)(Se[5]N[5])	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H)	Se[5](N[5,6]C[5,6]C[6])(N[5]C[5])	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](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	Se[5](N[5,6]C[5,6]C[6])(N[5]C[5]){1|H<1>,3|C<3>}	128.1570	0.000	1	128.1570	0.000	1	128.1570	0.000	1	128.1570	0.000	1	128.1570	0.000	1	128.1570	0.000	1
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]H)	B(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]H){1|C<2>,1|H<1>}	B(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(H){1|Co<5>,1|H<1>}	131.1500	0.143	2	131.1500	0.020	2	131.1500	0.020	2	131.1500	0.020	2	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:2:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:O-2:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]O)	B(N[5]C[5]N[5])2(OH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]O){2|H<1>}	B(N[5]C[5]N[5])2(OH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	124.5740	0.228	2	124.5740	0.052	2	124.5740	0.052	2	124.5740	0.052	2	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:2:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	N[5]-3:C[5]-2:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](N[5]N[5]B)(C[5]C[5])(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](N[5]N[5]B)(C[5]C[5])(H){1|Re<7>}	128.5010	0.000	1	128.5010	0.000	1	128.5010	0.000	1	128.5010	0.000	1	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:2:2:	C[5,6a]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	N[5]-3:S[5]-2:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2)	B(N[5]C[5,6a]C[5])3	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SSb)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SSb){2|C<3>}	129.4688	1.299	6	129.4688	1.686	6	129.4688	1.686	6	129.4688	1.686	6	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2){1|C<3>,1|H<1>}	B(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Se<2>,1|C<3>}	118.9770	0.017	3	118.9770	0.000	3	118.9770	0.000	3	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:N[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|W<6>}	130.4700	0.620	3	130.4700	0.384	3	130.4700	0.384	3	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	131.3163	0.470	6	131.3163	0.220	6	130.7024	1.003	16	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mn<6>,1|H<1>}	131.3180	0.008	3	131.3180	0.000	3	130.7024	1.003	16	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<6>,1|H<1>}	129.2010	0.866	3	129.2010	0.750	3	130.7024	1.003	16	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<7>,1|H<1>}	131.0710	0.000	1	131.0710	0.000	1	130.7024	1.003	16	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2){2|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	130.2377	0.865	3	130.2377	0.749	3	130.7024	1.003	16	129.0718	17.616	22	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:2:	C[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2)	B(N[5]C[5]2)3	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeZn)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2){1|C<3>,1|H<1>}	B(N[5]C[5]2)3	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeZn){2|C<3>,2|H<1>}	132.7500	0.019	3	132.7500	0.000	3	132.7500	0.000	3	132.7500	0.000	3	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:4:	C[5]-3:N[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|W<7>}	130.3217	0.950	6	130.3217	0.903	6	130.3217	0.903	6	129.9597	0.986	15	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<5>,1|C<3>}	128.7463	1.242	3	128.7463	1.544	3	129.7183	0.997	9	129.9597	0.986	15	129.4899	9.722	51	129.4899	9.722	51
542	770	818	0:SP2_SP2_SP2	N[5]	B	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5]-3:C[5]-3:B-3:	N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2)	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mo<6>,1|C<4>}	130.2043	0.356	6	130.2043	0.127	6	129.7183	0.997	9	129.9597	0.986	15	129.4899	9.722	51	129.4899	9.722	51
542	786	786	5:SP2_SP3_SP3	N[5]	B[5,5]	B[5,5]	4:4:2:	3:3:3:3:	3:3:3:3:	B[5,5]-4:B[5,5]-4:N-2:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:N[5]-3:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:N[5]-3:	N[5](B[5,5]C[5,6a]3)2(NN)	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N)	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N)	N[5](B[5,5]C[5,6a]3)2(NN){10|C<3>}	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N){3|F<1>,8|C<3>}	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N){3|F<1>,8|C<3>}	115.0160	0.000	1	115.0160	0.000	1	115.0160	0.000	1	115.0160	0.000	1	115.0160	0.000	1	115.0160	0.000	1
542	786	813	0:SP2_SP2_SP3	N[5]	B[5]	N[5a]	3:4:3:	3:3:3:3:	3:3:3:	N[5a]-3:B[5]-4:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:N[5]-3:C[5a]-3:	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H)	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H){3|H<1>,6|C<3>}	124.8110	0.000	1	124.8110	0.000	1	124.8110	0.000	1	124.8110	0.000	1	125.6630	1.452	2	125.6630	1.452	2
542	786	813	0:SP2_SP2_SP3	N[5]	B[5]	N[5a]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:N[5a]-3:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a,6a]-3:N[5]-3:	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2	N[5a](C[5a,6a]C[5a,6a]C[6a])2(N[5]B[5]C[5])	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H){10|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(N[5]B[5]C[5]){3|H<1>,8|C<3>}	126.5150	0.000	1	126.5150	0.000	1	126.5150	0.000	1	126.5150	0.000	1	125.6630	1.452	2	125.6630	1.452	2
542	786	813	0:SP2_SP3_SP3	N[5]	B[5]	N[5a]	3:4:3:	3:3:3:3:	3:3:3:	N[5a]-3:B[5]-4:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:N[5]-3:C[5a]-3:	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H)	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H){3|H<1>,6|C<3>}	124.6770	0.000	1	124.6770	0.000	1	124.6770	0.000	1	124.6770	0.000	1	124.6770	0.000	1	124.6770	0.000	1
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5,5,6,6]	C[5]	4:3:3:	4:4:3:2:	3:3:1:	B[5,5,6,6]-4:C[5,5]-3:C[5]-3:	B[5,5,6,6]-4:C[3x6]-4:N[5,5]-3:S[5]-2:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5,5,6,6]B[5,5,6,6]C[3x6]S[5])(C[5,5]N[5]S[5])(C[5]C[5]H)	B[5,5,6,6](B[5,5,6,6]C[3x6]N[5,5]S[5])(C[3x6]C[6,6,6a]2H)(N[5,5]C[5,5]C[5])(S[5]C[5,5])	C[5](N[5,5]B[5,5,6,6]C[5,5])(C[5]N[5]H)(H)	N[5,5](B[5,5,6,6]B[5,5,6,6]C[3x6]S[5])(C[5,5]N[5]S[5])(C[5]C[5]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	B[5,5,6,6](B[5,5,6,6]C[3x6]N[5,5]S[5])(C[3x6]C[6,6,6a]2H)(N[5,5]C[5,5]C[5])(S[5]C[5,5]){2|H<1>,2|N<3>,6|C<3>}	C[5](N[5,5]B[5,5,6,6]C[5,5])(C[5]N[5]H)(H){1|B<4>,2|C<4>,2|S<2>}	134.6615	1.036	2	134.6615	1.073	2	134.6615	1.073	2	134.6615	1.073	2	134.6615	1.073	2	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:2:	3:3:4:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:C[6a]-3:C[6a]-3:O[5]-2:	N[5,5]-3:C[5]-3:C-4:	N[5,5](B[5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5])	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3)	N[5,5](B[5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C){1|C<4>,1|H<1>,1|N<2>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5]){1|C<4>,1|N<2>,4|F<1>,6|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3){1|C<4>,1|O<2>,3|C<3>}	144.0230	0.000	1	145.3645	3.599	2	145.3645	3.599	2	142.1023	33.725	3	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:2:	3:3:4:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:C[6a]-3:C[6a]-3:O[5]-2:	N[5,5]-3:C[5]-3:C-4:	N[5,5](B[5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5])	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3)	N[5,5](B[5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C){1|C<4>,3|H<1>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5]){1|C<4>,2|H<1>,4|F<1>,6|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3){1|O<2>,2|C<3>,2|C<4>}	146.7060	0.000	1	145.3645	3.599	2	145.3645	3.599	2	142.1023	33.725	3	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:2:	3:3:4:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:C[6a]-3:C[6a]-3:S[5]-2:	N[5,5]-3:C[5]-3:C-4:	N[5,5](B[5]C[6a]2S[5])(N[5,5]C[5]2)(C[5]C[5]C)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(S[5]C[5])	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3)	N[5,5](B[5]C[6a]2S[5])(N[5,5]C[5]2)(C[5]C[5]C){1|C<4>,1|H<1>,1|N<2>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(S[5]C[5]){1|C<4>,1|N<2>,4|F<1>,6|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3){1|C<4>,1|S<2>,3|C<3>}	135.5780	0.000	1	135.5780	0.000	1	135.5780	0.000	1	142.1023	33.725	3	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:C[5,5]-3:C[5]-3:	C[5,6a]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]S[5])(C[5]C[5]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,5]C[5])(C[6a]C[6a]2)2	C[5](N[5,5]C[5,5]B[5])(C[5]S[5]C)(H)	N[5,5](B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]S[5])(C[5]C[5]H){1|C<4>,6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,5]C[5])(C[6a]C[6a]2)2{1|S<2>,2|H<1>,4|C<4>,7|C<3>}	C[5](N[5,5]C[5,5]B[5])(C[5]S[5]C)(H){4|C<3>}	134.0730	0.000	1	134.0730	0.000	1	134.0730	0.000	1	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H){1|Fe<6>,1|H<1>,2|N<3>,5|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H){1|B<4>,1|N<3>,1|O<3>,2|C<3>}	139.7040	0.000	1	139.7040	0.000	1	140.3824	0.410	13	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mg)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H){1|Mg<6>,2|H<1>,2|N<3>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mg){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	140.6890	0.147	2	140.6890	0.022	2	140.3824	0.410	13	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mn)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H){1|Mn<6>,2|H<1>,2|N<3>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mn){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	139.8400	0.631	2	139.8400	0.398	2	140.3824	0.410	13	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H){1|Ru<8>,2|H<1>,2|N<3>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	140.5458	0.786	6	140.5261	0.443	8	140.3824	0.410	13	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[5]-3:H-1:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[5]H){1|Ru<9>,2|H<1>,2|N<3>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	140.4670	0.074	2	140.5261	0.443	8	140.3824	0.410	13	139.9317	3.222	14	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5,5]-3:C[6a]-3:C[5]-3:	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[6a]C[5])	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe)	C[5](N[5,5]N[5,5]B[5])(C[6a]C[6a]2)(C[5]C[5]H)	N[5,5](B[5]C[6a]N[5]O[5])(N[5,5]B[5]C[5])(C[5]C[6a]C[5]){1|Fe<6>,2|H<1>,2|N<3>,6|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe){1|N<3>,3|H<1>,8|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[6a]C[6a]2)(C[5]C[5]H){1|B<4>,1|N<3>,1|O<3>,3|C<3>,3|H<1>}	141.2180	0.000	1	141.2180	0.000	1	141.2180	0.000	1	141.2180	0.000	1	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:4:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:C[5]-3:C-4:	N[5,5](B[5]C[6a]2N[5])(N[5,5]C[5]2)(C[5]C[5]C)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3)	N[5,5](B[5]C[6a]2N[5])(N[5,5]C[5]2)(C[5]C[5]C){1|H<1>,1|S<1>,2|C<4>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]C){1|C<4>,1|S<1>,4|F<1>,6|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CC3){1|C<4>,1|N<3>,3|C<3>}	142.3350	0.000	1	142.3350	0.000	1	142.5530	0.042	3	142.5530	0.042	3	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:4:	B[5]-4:N[5,5]-3:C[5]-3:	N[5,5]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:C[5]-3:C-4:	N[5,5](B[5]C[6a]2N[5])(N[5,5]C[5]2)(C[5]C[5]C)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]Cu)	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CH3)	N[5,5](B[5]C[6a]2N[5])(N[5,5]C[5]2)(C[5]C[5]C){1|Cu<2>,1|H<1>,2|C<4>,4|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]Cu){2|C<4>,4|H<1>,6|C<3>}	C[5](N[5,5]N[5,5]B[5])(C[5]C[5]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	142.6620	0.116	2	142.6620	0.013	2	142.5530	0.042	3	142.5530	0.042	3	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5,5]	B[5]	C[5]	4:4:3:	3:3:3:3:	3:2:3:	C[5,5,6]-4:B[5]-4:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:C-3:	N[5,5]-3:S[5]-2:C-3:	N[5,5](C[5,5,6]C[5,6]C[5]C[6])(B[5]C[6a]N[5]C)(C[5]S[5]C)	B[5](N[5,5]C[5,5,6]C[5])(N[5]C[6a]C[5])(C[6a]C[6a]2)(CC[6a]C)	C[5](N[5,5]C[5,5,6]B[5])(S[5]C[5,6])(CC[6a]C)	N[5,5](C[5,5,6]C[5,6]C[5]C[6])(B[5]C[6a]N[5]C)(C[5]S[5]C){1|S<1>,2|H<1>,5|C<3>}	B[5](N[5,5]C[5,5,6]C[5])(N[5]C[6a]C[5])(C[6a]C[6a]2)(CC[6a]C){1|C<4>,1|S<1>,1|S<2>,2|H<1>,6|C<3>}	C[5](N[5,5]C[5,5,6]B[5])(S[5]C[5,6])(CC[6a]C){1|H<1>,1|N<3>,5|C<3>}	128.1580	0.173	2	128.1580	0.030	2	128.1580	0.030	2	128.1580	0.030	2	139.5889	19.109	23	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Fe)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Fe)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe){1|N<3>,3|H<1>,8|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	133.2650	0.000	1	133.5620	0.176	2	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Fe)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Fe)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Fe){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	133.8590	0.000	1	133.5620	0.176	2	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Mg)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mg)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Mg)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mg){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Mg<6>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	132.9510	0.554	2	132.9510	0.307	2	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Mn)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mn)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Mn)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Mn){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	132.3915	0.104	2	132.3915	0.011	2	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Ru)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Ru)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Ru<8>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	133.0482	0.412	6	133.2876	0.834	8	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	0:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5]-3:C[5]-3:	N[5,5]-3:N[5]-3:C[6a]-3:O[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Ru)(C[5]C[5]H)	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru)	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H)	N[5](B[5]N[5,5]C[6a]O[5])(N[5]C[5]Ru)(C[5]C[5]H){1|B<4>,1|N<3>,2|H<1>,3|C<3>}	B[5](N[5,5]N[5,5]C[5])(N[5]C[5]N[5])(C[6a]C[6a]2)(O[5]B[5]Ru){1|N<3>,4|H<1>,7|C<3>}	C[5](N[5]B[5]N[5])(C[5]C[5]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>,1|O<3>}	134.0060	1.902	2	133.2876	0.834	8	133.1507	0.620	14	133.1507	0.620	14	133.1507	0.620	14	137.0251	21.106	39
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5,5,6,6]	C[5,5]	4:3:3:	4:4:3:2:	3:2:3:	B[5,5,6,6]-4:C[5,5]-3:C[5]-3:	B[5,5,6,6]-4:C[3x6]-4:N[5,5]-3:S[5]-2:	N[5,5]-3:S[5]-2:N[5]-3:	N[5,5](B[5,5,6,6]B[5,5,6,6]C[3x6]S[5])(C[5,5]N[5]S[5])(C[5]C[5]H)	B[5,5,6,6](B[5,5,6,6]C[3x6]N[5,5]S[5])(C[3x6]C[6,6,6a]2H)(N[5,5]C[5,5]C[5])(S[5]C[5,5])	C[5,5](N[5,5]B[5,5,6,6]C[5])(S[5]B[5,5,6,6])(N[5]C[5]C)	N[5,5](B[5,5,6,6]B[5,5,6,6]C[3x6]S[5])(C[5,5]N[5]S[5])(C[5]C[5]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	B[5,5,6,6](B[5,5,6,6]C[3x6]N[5,5]S[5])(C[3x6]C[6,6,6a]2H)(N[5,5]C[5,5]C[5])(S[5]C[5,5]){2|H<1>,2|N<3>,6|C<3>}	C[5,5](N[5,5]B[5,5,6,6]C[5])(S[5]B[5,5,6,6])(N[5]C[5]C){1|N<3>,1|S<2>,2|C<4>,2|H<1>}	116.0040	0.072	2	116.0040	0.005	2	116.0040	0.005	2	116.0040	0.005	2	116.0040	0.005	2	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5]	C[5,5]	3:3:4:	3:3:4:4:	3:3:3:	C[5,6a]-3:C[5,5]-3:B[5]-4:	C[5,6a]-3:N[5,5]-3:C-4:C-4:	C[5,6a]-3:N[5,5]-3:N[5]-3:	N[5,5](C[5,6a]C[6a,6a]C[5,6a])(C[5,5]C[5,6a]N[5])(B[5]C[5,6a]CC)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(CH3)2	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C[6a])	N[5,5](C[5,6a]C[6a,6a]C[5,6a])(C[5,5]C[5,6a]N[5])(B[5]C[5,6a]CC){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(CH3)2{1|H<1>,1|N<3>,4|C<3>}	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C[6a]){1|H<1>,2|C<4>,6|C<3>}	110.3365	0.179	4	110.3365	0.032	4	110.3365	0.032	4	110.3365	0.032	4	111.7439	1.823	9	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5]	C[5,5]	3:4:3:	3:3:3:3:	3:3:3:	C[5,6a]-3:B[5]-4:C[5,5]-3:	C[5,6a]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,5]-3:N[5]-3:	N[5,5](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]N[5])	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(C[6a]C[6a]2)2	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C)	N[5,5](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]N[5]){1|C<4>,1|H<1>,8|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]C[5,5])(C[6a]C[6a]2)2{1|N<3>,5|F<1>,8|C<3>}	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C){1|F<1>,6|C<3>}	112.9200	0.000	1	112.9200	0.000	1	112.9200	0.000	1	112.9200	0.000	1	111.7439	1.823	9	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5]	C[5,5]	3:4:3:	3:4:3:3:	4:3:3:	C[5,6a]-3:B[5]-4:C[5,5]-3:	N[5,5]-3:C[5,5]-4:C[6a]-3:C[6a]-3:	C[5,5]-4:N[5,5]-3:N[5]-3:	N[5,5](C[5,6a]C[5,6a]C[6a])(B[5]C[5,5]C[6a]2)(C[5,5]C[5,5]N[5])	B[5](N[5,5]C[5,6a]C[5,5])(C[5,5]C[5,5]C[5]Fe)(C[6a]C[6a]2)2	C[5,5](C[5,5]C[5,5]C[5]Fe)(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C)	N[5,5](C[5,6a]C[5,6a]C[6a])(B[5]C[5,5]C[6a]2)(C[5,5]C[5,5]N[5]){1|Fe<10>,1|H<1>,3|C<4>,6|C<3>}	B[5](N[5,5]C[5,6a]C[5,5])(C[5,5]C[5,5]C[5]Fe)(C[6a]C[6a]2)2{1|H<1>,1|N<3>,6|C<3>,6|C<4>}	C[5,5](C[5,5]C[5,5]C[5]Fe)(N[5,5]C[5,6a]B[5])(N[5]C[5,6a]C){1|H<1>,2|C<4>,4|C<3>}	112.7813	0.281	3	112.7813	0.079	3	112.7813	0.079	3	112.7813	0.079	3	111.7439	1.823	9	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5]	C[5,5]	4:3:3:	3:3:3:3:	3:3:2:	B[5]-4:C[5,5]-3:C[5]-3:	C[5,6a]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,5]-3:S[5]-2:	N[5,5](B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]S[5])(C[5]C[5]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,5]C[5])(C[6a]C[6a]2)2	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]B[5]C[5])(S[5]C[5])	N[5,5](B[5]C[5,6a]C[6a]2)(C[5,5]C[5,6a]S[5])(C[5]C[5]H){1|C<4>,6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,5]C[5,5]C[5])(C[6a]C[6a]2)2{1|S<2>,2|H<1>,4|C<4>,7|C<3>}	C[5,5](C[5,6a]C[5,6a]C[6a])(N[5,5]B[5]C[5])(S[5]C[5]){1|C<4>,2|H<1>,4|C<3>}	113.0850	0.000	1	113.0850	0.000	1	113.0850	0.000	1	113.0850	0.000	1	111.7439	1.823	9	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,5]	B[5]	C[5,6]	3:3:4:	3:3:1:1:	3:3:3:	C[5,6]-3:N[5,5]-3:B[5]-4:	N[5,6]-3:N[5,5]-3:F-1:F-1:	N[5,6]-3:N[5,5]-3:C[6]-3:	N[5,5](C[5,6]N[5,6]C[6])(N[5,5]C[5,6]B[5])(B[5]N[5,6]FF)	B[5](N[5,6]C[6,6a]C[5,6])(N[5,5]C[5,6]N[5,5])(F)2	C[5,6](N[5,6]C[6,6a]B[5])(N[5,5]N[5,5]B[5])(C[6]C[6]H)	N[5,5](C[5,6]N[5,6]C[6])(N[5,5]C[5,6]B[5])(B[5]N[5,6]FF){1|H<1>,2|F<1>,4|C<3>}	B[5](N[5,6]C[6,6a]C[5,6])(N[5,5]C[5,6]N[5,5])(F)2{1|B<4>,1|N<2>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[6,6a]B[5])(N[5,5]N[5,5]B[5])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>,4|F<1>}	138.7600	0.000	1	138.7600	0.000	1	138.7600	0.000	1	138.7600	0.000	1	138.7600	0.000	1	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6,6]	3:4:4:	3:3:4:2:	3:3:3:	C[5,6,6]-3:B[5,5]-4:C[6]-4:	N[5,6]-3:N[5,6]-3:B[5,5]-4:C-2:	N[5,6]-3:N[5,6]-3:N[6,6]-3:	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]C)(C[6]C[6]HH)	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2C)(CC)	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2)	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]C)(C[6]C[6]HH){1|C<2>,1|C<3>,1|N<3>,2|H<1>,4|C<4>}	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2C)(CC){2|N<3>,4|C<4>,4|H<1>}	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2){2|C<2>,2|C<4>,2|N<3>,8|H<1>}	113.2613	0.227	4	113.2613	0.051	4	113.2613	0.051	4	112.2949	1.116	8	112.5430	0.975	11	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6,6]	3:4:4:	3:3:4:2:	3:3:3:	C[5,6,6]-3:B[5,5]-4:C[6]-4:	N[5,6]-3:N[5,6]-3:B[5,5]-4:O-2:	N[5,6]-3:N[5,6]-3:N[6,6]-3:	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]O)(C[6]C[6]HH)	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2O)(OS)	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2)	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]O)(C[6]C[6]HH){1|C<3>,1|N<3>,1|O<2>,2|H<1>,4|C<4>}	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2O)(OS){2|N<3>,4|C<4>,4|H<1>}	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2){2|C<4>,2|N<3>,2|O<2>,8|H<1>}	111.3285	0.250	4	111.3285	0.063	4	111.3285	0.063	4	112.2949	1.116	8	112.5430	0.975	11	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6,6]	3:4:4:	3:3:4:3:	3:3:3:	C[5,6,6]-3:B[5,5]-4:C[6]-4:	N[5,6]-3:N[5,6]-3:B[5,5]-4:N-3:	N[5,6]-3:N[5,6]-3:N[6,6]-3:	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]N)(C[6]C[6]HH)	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2N)(NCC)	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2)	N[5,6](C[5,6,6]N[5,6]N[6,6])(B[5,5]B[5,5]N[5,6]N)(C[6]C[6]HH){1|C<3>,2|H<1>,2|N<3>,4|C<4>}	B[5,5](N[5,6]C[5,6,6]C[6])2(B[5,5]N[5,6]2N)(NCC){2|N<3>,4|C<4>,4|H<1>}	C[5,6,6](N[5,6]B[5,5]C[6])2(N[6,6]C[6]2){2|C<4>,4|N<3>,8|H<1>}	113.2047	0.253	3	113.2047	0.064	3	113.2047	0.064	3	113.2047	0.064	3	112.5430	0.975	11	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6]	3:4:3:	3:2:2:2:	3:4:3:	C[5,6]-3:B[5,5]-4:C[6]-3:	N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5,5]O[5]3)(C[6]C[6]H)	B[5,5](N[5,6]C[5,6]C[6])(O[5]C[5])3	C[5,6](N[5,6]B[5,5]C[6])(C[5]O[5]CH)(C[6]C[6]H)	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>}	B[5,5](N[5,6]C[5,6]C[6])(O[5]C[5])3{2|C<3>,2|H<1>,5|C<4>}	C[5,6](N[5,6]B[5,5]C[6])(C[5]O[5]CH)(C[6]C[6]H){1|C<3>,2|H<1>,2|O<2>}	110.3452	0.404	4	110.3452	0.163	4	110.3452	0.163	4	110.3452	0.163	4	111.2170	2.023	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6]	3:4:3:	3:3:3:3:	3:3:3:	C[5,6]-3:B[5,5]-4:C[6]-3:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:N[5,6]-3:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(B[5,5]C[5,6a]3)(C[6]C[6]H)	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5,6]C[5,6]C[6])	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,5]C[6])(C[6]C[6]H)	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>}	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5,6]C[5,6]C[6]){4|H<1>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5,5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	112.4590	0.000	1	112.4590	0.000	1	112.4590	0.000	1	112.4590	0.000	1	111.2170	2.023	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,5]	C[5,6]	4:3:3:	3:4:2:2:	3:4:3:	B[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-4:O[5]-2:O[5]-2:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](B[5,5]C[5]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	B[5,5](N[5,6]C[5,6]C[6])(C[5]B[5]2C[5])(O[5]C[5])2	C[5,6](N[5,6]B[5,5]C[6])(C[5]C[5]HH)(C[6]C[6]H)	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>}	B[5,5](N[5,6]C[5,6]C[6])(C[5]B[5]2C[5])(O[5]C[5])2{2|C<3>,3|H<1>,4|C<4>,4|O<2>}	C[5,6](N[5,6]B[5,5]C[6])(C[5]C[5]HH)(C[6]C[6]H){1|C<3>,2|B<3>,2|H<1>,2|O<2>}	113.4620	0.000	1	113.4620	0.000	1	113.4620	0.000	1	113.4620	0.000	1	111.2170	2.023	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,6,6]	C[5,6]	4:3:3:	3:3:4:4:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-3:C[6,6]-4:C[6,6]-4:	N[5,6]-3:C[5]-3:C[6]-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)	B[5,6,6](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6,6]C[6]2H)2	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){2|C<3>,4|C<4>,5|H<1>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6,6]C[6]2H)2{10|H<1>,2|C<4>,4|C<3>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	110.2500	0.369	2	110.2500	0.136	2	110.2500	0.136	2	110.2500	0.136	2	110.1768	0.139	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,6,6]	C[5,6]	4:3:3:	3:4:4:3:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-3:	N[5,6]-3:C[5]-3:C[6]-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)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]2)	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){1|C<3>,5|C<4>,5|H<1>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]2){1|Fe<10>,10|H<1>,2|C<3>,4|C<4>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	109.9740	0.342	2	109.9740	0.117	2	109.9530	0.060	3	109.9530	0.060	3	110.1768	0.139	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,6,6]	C[5,6]	4:3:3:	3:4:4:3:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-3:	N[5,6]-3:C[5]-3:C[6]-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)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]Si)	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]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){1|Si<4>,1|C<3>,4|C<4>,5|H<1>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]C[5]Si){10|H<1>,2|C<3>,2|C<4>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[5]C[5]H)(C[6]C[6]H){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	109.9110	0.000	1	109.9110	0.000	1	109.9530	0.060	3	109.9530	0.060	3	110.1768	0.139	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5,6,6]	C[5,6]	4:3:3:	3:4:4:4:	3:3:3:	B[5,6,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6,6]-4:C[6,6]-4:C[5]-4:	N[5,6]-3:C[6]-3:N[5]-3:	N[5,6](B[5,6,6]C[6,6]2C[5])(C[5,6]C[6]N[5])(C[6]C[6]H)	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]N[5]HH)	C[5,6](N[5,6]B[5,6,6]C[6])(C[6]C[6]H)(N[5]C[5]C)	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>}	B[5,6,6](N[5,6]C[5,6]C[6])(C[6,6]C[6]2H)2(C[5]N[5]HH){2|C<3>,3|C<4>,9|H<1>}	C[5,6](N[5,6]B[5,6,6]C[6])(C[6]C[6]H)(N[5]C[5]C){1|C<3>,2|C<4>,4|H<1>}	110.7020	0.000	1	110.7020	0.000	1	110.7020	0.000	1	110.7020	0.000	1	110.1768	0.139	6	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:3:4:	3:3:1:1:	3:3:3:	C[6,6a]-3:C[5,6]-3:B[5]-4:	N[5,6]-3:N[5,5]-3:F-1:F-1:	N[5,6]-3:N[5,5]-3:C[6]-3:	N[5,6](C[6,6a]C[6,6a]N[6a])(C[5,6]N[5,5]C[6])(B[5]N[5,5]FF)	B[5](N[5,6]C[6,6a]C[5,6])(N[5,5]C[5,6]N[5,5])(F)2	C[5,6](N[5,6]C[6,6a]B[5])(N[5,5]N[5,5]B[5])(C[6]C[6]H)	N[5,6](C[6,6a]C[6,6a]N[6a])(C[5,6]N[5,5]C[6])(B[5]N[5,5]FF){1|B<4>,1|H<1>,4|C<3>}	B[5](N[5,6]C[6,6a]C[5,6])(N[5,5]C[5,6]N[5,5])(F)2{1|B<4>,1|N<2>,1|N<3>,3|C<3>}	C[5,6](N[5,6]C[6,6a]B[5])(N[5,5]N[5,5]B[5])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>,4|F<1>}	112.3170	0.000	1	112.3170	0.000	1	112.3170	0.000	1	112.3170	0.000	1	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:3:4:	3:3:4:4:	3:3:3:	C[6,6a]-3:C[5,6]-3:B[5]-4:	C[5,6a]-3:N[5,6]-3:C-4:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CCHH)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC){2|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CCHH)2{1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H){2|C<4>,2|H<1>,4|C<3>}	110.9900	0.000	1	110.9900	0.000	1	111.1948	0.151	5	111.1948	0.151	5	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:3:4:	3:3:4:4:	3:3:3:	C[6,6a]-3:C[5,6]-3:B[5]-4:	C[5,6a]-3:N[5,6]-3:C-4:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CH3)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC){2|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CH3)2{1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H){2|C<4>,2|H<1>,4|C<3>}	111.0657	0.283	3	111.0657	0.080	3	111.1948	0.151	5	111.1948	0.151	5	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:3:4:	3:3:4:4:	3:3:3:	C[6,6a]-3:C[5,6]-3:B[5]-4:	C[5,6a]-3:N[5,6]-3:C-4:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CH3)2	C[5,6](C[5,6a]C[6a,6a]C[5,6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC){2|H<1>,5|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CH3)2{1|H<1>,5|C<3>}	C[5,6](C[5,6a]C[6a,6a]C[5,6a])(N[5,6]C[6,6a]B[5])(C[6]C[6]H){1|H<1>,2|C<4>,5|C<3>}	111.7870	0.000	1	111.7870	0.000	1	111.1948	0.151	5	111.1948	0.151	5	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:1:1:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,5a]-3:N[5,6]-3:Br-1:Br-1:	C[5,5a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]Br2)(C[6]C[6]H)	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(Br)2	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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>}	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(Br)2{1|H<1>,1|S<2>,4|C<3>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|Br<1>,2|H<1>,3|C<3>}	110.6430	0.000	1	110.6430	0.000	1	110.6430	0.000	1	109.8235	1.343	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:1:1:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,6a]-3:N[5,6]-3:Cl-1:Cl-1:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]Cl2)(C[6]C[5,6]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(Cl)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]H)	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>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(Cl)2{2|H<1>,4|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>}	109.0040	0.000	1	109.0040	0.000	1	109.0040	0.000	1	109.8235	1.343	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:1:1:	3:4:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:N[5]-3:H-1:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HH)(C[6]C[6]C)	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(H)2	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(H)2{1|C<4>,2|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	112.3490	0.000	1	112.3490	0.000	1	112.3490	0.000	1	112.3490	0.000	1	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:2:1:	3:4:3:	C[5,6]-3:B[5]-4:C[6]-3:	N[5,6]-3:N[5]-3:O-2:H-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](C[5,6]C[5]C[6])(B[5]N[5]HO)(C[6]C[6]C)	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(OC)(H)	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(N[5]C[6a]C[5])(OC)(H){1|C<4>,2|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]N[5]HH)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	111.4570	0.000	1	111.4570	0.000	1	111.4570	0.000	1	111.4570	0.000	1	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:3:3:	3:3:3:	C[6,6a]-3:B[5]-4:C[5,6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:N[6]-3:	N[5,6](C[6,6a]C[6,6a,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]N[6])	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(N[6]C[6,6a]H)	N[5,6](C[6,6a]C[6,6a,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5,6]C[5,6a]N[6]){2|H<1>,9|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(C[6a]C[6a]2)2{1|H<1>,1|N<3>,4|C<4>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]B[5])(N[6]C[6,6a]H){1|H<1>,7|C<3>}	110.5840	0.000	1	110.5840	0.000	1	110.5840	0.000	1	110.5840	0.000	1	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:4:4:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,5a]-3:N[5,6]-3:C-4:C-4:	C[5,5a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,5a]C[6])(B[5]C[5,5a]CC)(C[6]C[6]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(N[5,6]C[5,6]C[6])(CH3)2	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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>}	B[5](C[5,5a]C[5a,6a]C[5,5a])(N[5,6]C[5,6]C[6])(CH3)2{1|H<1>,1|S<2>,4|C<3>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	112.8710	0.000	1	112.8710	0.000	1	112.8710	0.000	1	112.3050	0.641	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	3:4:3:	3:3:4:4:	3:3:3:	C[5,6]-3:B[5]-4:C[6]-3:	C[5,6a]-3:N[5,6]-3:C-4:C-4:	C[5,6a]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6a]C[6])(B[5]C[5,6a]CC)(C[6]C[6]N)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(CCHH)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H)	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>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(CCHH)2{1|H<1>,1|N<3>,4|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	111.7390	0.000	1	111.7390	0.000	1	111.7390	0.000	1	112.3050	0.641	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-3:C[6a]-3:Cl-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[5,6]C)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]N[5,6]C)	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>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl){1|C<4>,2|H<1>,7|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>}	108.7700	0.315	3	108.7700	0.099	3	109.1962	0.793	4	109.1962	0.793	4	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:1:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-3:C[6a]-3:Cl-1:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]H)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(Cl){3|H<1>,7|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|Cl<1>,2|H<1>,5|C<3>}	110.4750	0.000	1	110.4750	0.000	1	109.1962	0.793	4	109.1962	0.793	4	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,5a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,5a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]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){1|S<2>,2|H<1>,6|C<3>}	B[5](C[5,5a]C[5,5a]C[5a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{1|S<2>,2|H<1>,4|C<4>,7|C<3>}	C[5,6](C[5,5a]C[5,5a]S[5a])(N[5,6]B[5]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	111.8230	0.000	1	111.8230	0.000	1	111.8230	0.000	1	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]N[5,6]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){1|H<1>,1|N<3>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|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>}	111.4950	0.000	1	111.4950	0.000	1	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){1|B<3>,1|H<1>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	113.0125	0.238	2	112.2235	0.325	11	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){1|H<1>,8|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	112.6330	0.134	2	112.2235	0.325	11	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){2|H<1>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|C<4>,4|H<1>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	111.8497	0.599	3	112.2235	0.325	11	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){2|H<1>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	112.0155	0.035	2	112.2235	0.325	11	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5,6]-3:C[6]-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)	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]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){2|H<1>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)2{6|H<1>,8|C<3>}	C[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[5]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	111.7940	0.016	2	112.2235	0.325	11	112.1628	0.340	12	112.1367	0.320	13	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:3:4:	3:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[5]-3:C[6a]-3:C-4:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](B[5]C[6a]C[5]C)(C[5,6]C[5]C[6])(C[6]C[6]H)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(CH3)	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)(CH3){3|H<1>,7|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]C[6a]C[5])(C[6]C[6]H){1|C<4>,2|H<1>,5|C<3>}	111.3240	0.000	1	111.3240	0.000	1	111.3240	0.000	1	111.3240	0.000	1	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:4:1:	3:4:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6a]-3:P[5]-4:Cl-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl)	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]GaH)(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl){1|Ga<4>,1|C<4>,3|H<1>,4|C<3>}	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]GaH)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	117.0100	0.000	1	117.0100	0.000	1	116.7275	0.160	2	116.7275	0.160	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	3:3:4:1:	3:4:3:	B[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:C[6a]-3:P[5]-4:Cl-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](B[5]C[6a]P[5]Cl)(C[5,6]C[5]C[6])(C[6]C[6]C)	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl)	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]HH)(C[6]C[6]H)	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>}	B[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(P[5]C[5]CC)(Cl){1|C<4>,4|C<3>,4|H<1>}	C[5,6](N[5,6]B[5]C[6])(C[5]P[5]HH)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	116.4450	0.000	1	116.4450	0.000	1	116.7275	0.160	2	116.7275	0.160	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5,6]	B[5]	C[5,6]	4:3:3:	4:3:3:1:	4:3:3:	B[5]-4:C[5,6]-3:C[6]-3:	C[5,5]-4:N[5,6]-3:C[6a]-3:Cl-1:	C[5,5]-4:N[5,6]-3:C[6]-3:	N[5,6](B[5]C[5,5]C[6a]Cl)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	B[5](C[5,5]C[5,5]C[5]Fe)(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(Cl)	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C)	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>}	B[5](C[5,5]C[5,5]C[5]Fe)(N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(Cl){2|C<4>,4|C<3>,4|H<1>}	C[5,6](C[5,5]C[5,5]C[5]Fe)(N[5,6]B[5]C[6])(C[6]C[6]C){1|Cl<1>,2|C<3>,2|C<4>,3|H<1>}	113.2575	0.086	2	113.2575	0.007	2	113.2575	0.007	2	113.2575	0.007	2	111.7941	3.027	35	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	3:4:3:	3:3:2:2:	3:3:3:	C[5]-3:B[5]-4:N-3:	C[5,6a]-3:N[5]-3:O-2:O-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]OO)(NC[6a]C)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]N)(OC[6a])2	C[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]B[5]N)	N[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]OO)(NC[6a]C){4|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]N)(OC[6a])2{1|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]B[5]N){2|O<2>,3|H<1>,4|C<3>}	112.0860	0.000	1	112.0860	0.000	1	112.0860	0.000	1	112.0860	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	3:4:3:	3:3:3:3:	3:3:1:	C[6a]-3:B[5]-4:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](C[6a]C[6a,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H)	N[5](C[6a]C[6a,6a]C[6a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H){1|H<1>,6|C<3>}	110.7045	0.039	2	110.7045	0.002	2	110.7045	0.002	2	111.9155	1.983	4	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	3:4:3:	3:3:3:3:	3:3:1:	N[5a]-3:B[5]-4:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H)	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H){1|H<1>,6|C<3>}	113.1265	0.284	2	113.1265	0.080	2	113.1265	0.080	2	111.9155	1.983	4	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:2:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:O-2:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(OC)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]O)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]O)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(OC){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]O){2|H<1>,4|F<1>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]O)(H){1|H<1>,4|C<3>}	114.9580	0.000	1	114.9580	0.000	1	114.9580	0.000	1	114.9580	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:1:1:	3:3:1:	B[5]-4:C[5]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:Cl-1:Cl-1:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]Cl2)(C[5]C[5,6a]H)(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H)	N[5](B[5]C[5,6a]Cl2)(C[5]C[5,6a]H)(C[6a]C[6a]2){2|C<4>,4|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(Cl)2{2|H<1>,4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H){2|Cl<1>,1|H<1>,4|C<3>}	109.8610	0.000	1	109.8610	0.000	1	109.8610	0.000	1	109.8610	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B[5]-4:C[5]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:Cl-1:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]Cl)(C[5]C[5,6a]H)(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)(Cl)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H)	N[5](B[5]C[5,6a]C[6a]Cl)(C[5]C[5,6a]H)(C[6a]C[6a]2){2|C<4>,6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)(Cl){4|H<1>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H){1|Cl<1>,1|H<1>,5|C<3>}	110.5490	0.000	1	110.5490	0.000	1	110.5490	0.000	1	110.5490	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|C<4>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H){1|H<1>,6|C<3>}	110.6652	0.658	5	110.5940	0.244	9	110.5940	0.244	9	110.7426	0.438	10	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])(H){1|H<1>,6|C<3>}	110.5050	0.233	4	110.5940	0.244	9	110.5940	0.244	9	110.7426	0.438	10	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B[5]-4:N[5a]-3:C[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H)	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H){10|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(C[6a]C[6a]2)2{2|H<1>,4|F<1>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H){1|H<1>,6|C<3>}	112.0800	0.000	1	112.0800	0.000	1	112.0800	0.000	1	110.7426	0.438	10	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:3:	4:3:1:	B[5]-4:C[5]-3:C[6a]-3:	N[5,5]-3:N[5]-3:C[6a]-3:C-3:	C[5,5,6]-4:N[5]-3:S-1:	N[5](B[5]N[5,5]C[6a]C)(C[5]C[5,5,6]S)(C[6a]C[6a]2)	B[5](N[5,5]C[5,5,6]C[5])(N[5]C[6a]C[5])(C[6a]C[6a]2)(CC[6a]C)	C[5](C[5,5,6]C[5,6]N[5,5]C[6])(N[5]C[6a]B[5])(S)	N[5](B[5]N[5,5]C[6a]C)(C[5]C[5,5,6]S)(C[6a]C[6a]2){1|C<4>,2|H<1>,6|C<3>}	B[5](N[5,5]C[5,5,6]C[5])(N[5]C[6a]C[5])(C[6a]C[6a]2)(CC[6a]C){1|C<4>,1|S<1>,1|S<2>,2|H<1>,6|C<3>}	C[5](C[5,5,6]C[5,6]N[5,5]C[6])(N[5]C[6a]B[5])(S){1|S<2>,2|H<1>,7|C<3>}	115.4265	0.100	2	115.4265	0.010	2	115.4265	0.010	2	115.4265	0.010	2	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	3:3:3:4:	3:4:4:	B[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	N[5]-3:P[5]-4:C-4:	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(C[5]P[5]C)	B[5](N[5]C[6a]C[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	C[5](N[5]C[6a]B[5])(P[5]C[5]CC)(CC3)	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(C[5]P[5]C){2|C<4>,4|H<1>,6|C<3>}	B[5](N[5]C[6a]C[5])(C[6a]C[6a]2)2(C[5]P[5]HH){3|C<4>,4|H<1>,6|C<3>}	C[5](N[5]C[6a]B[5])(P[5]C[5]CC)(CC3){2|H<1>,4|C<3>}	121.7240	0.000	1	121.7240	0.000	1	121.7240	0.000	1	121.7240	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:3:	6:3:2:2:	6:3:4:	B[5]-4:C[5]-3:C[6a]-3:	C[5x3,6x5,20x6]-6:N[5]-3:O-2:O-2:	C[5x3,6x5,20x6]-6:N[5]-3:C-4:	N[5](B[5]C[5x3,6x5,20x6]OO)(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2)	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(OC)2	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]B[5])(CC3)	N[5](B[5]C[5x3,6x5,20x6]OO)(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2){2|C<3>,2|C<4>,6|B<6>}	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(OC)2{1|C<4>,2|C<3>,4|H<1>,5|B<6>}	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]B[5])(CC3){2|C<3>,2|O<2>,4|H<1>,5|B<6>}	117.3920	0.219	2	117.3920	0.048	2	117.3920	0.048	2	117.3920	0.048	2	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:2:2:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:N[5]-3:O-2:O-2:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]OO)(C[5]C[5,6a]H)(CC[5]CH)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(OC[6a])2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]OO)(C[5]C[5,6a]H)(CC[5]CH){2|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(OC[6a])2{2|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,2|C<3>,2|O<2>}	111.4300	0.000	1	111.4300	0.000	1	111.4300	0.000	1	110.8548	0.121	5	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:2:2:	3:3:1:	B[5]-4:C[5]-3:C[6]-4:	C[5,6a]-3:N[5]-3:O-2:O-2:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]OO)(C[5]C[5,6a]H)(C[6]C[6]2H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(OB[5])(OC[6])	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C[6])(H)	N[5](B[5]C[5,6a]OO)(C[5]C[5,6a]H)(C[6]C[6]2H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(OB[5])(OC[6]){2|C<3>,2|C<4>,3|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C[6])(H){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	110.7110	0.155	4	110.7110	0.024	4	110.7110	0.024	4	110.8548	0.121	5	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:1:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:Cl-1:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]Cl)(C[5]C[5,6a]H)(CC3)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)(Cl)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]Cl)(C[5]C[5,6a]H)(CC3){4|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)(Cl){4|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|Cl<1>,1|H<1>,3|C<3>}	109.6790	0.000	1	109.6790	0.000	1	109.6790	0.000	1	109.6790	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCCH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCCH){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){2|H<1>,4|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,4|C<3>}	111.6620	0.000	1	111.6620	0.000	1	111.6436	0.212	7	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCHH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCHH){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){2|H<1>,4|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,4|C<3>}	111.8370	0.907	2	111.6707	0.494	3	111.6436	0.212	7	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCHH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CCHH){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){2|H<1>,4|F<1>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,4|C<3>}	111.3380	0.000	1	111.6707	0.494	3	111.6436	0.212	7	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CC[6a]HH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CC[6a]HH){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){2|H<1>,4|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,4|C<3>}	111.5305	0.491	2	111.5305	0.242	2	111.6436	0.212	7	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CH3)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(CH3){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){2|H<1>,4|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,4|C<3>}	111.7700	0.000	1	111.7700	0.000	1	111.6436	0.212	7	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](B[5]C[6a]2C[5])(C[5]N[5]H)(CCCH)	B[5](C[6a]C[6a]2)2(C[5]N[5]O)(N[5]C[5]C)	C[5](N[5]B[5]C)(N[5]C[5]C)(H)	N[5](B[5]C[6a]2C[5])(C[5]N[5]H)(CCCH){1|C<4>,1|O<1>,4|C<3>}	B[5](C[6a]C[6a]2)2(C[5]N[5]O)(N[5]C[5]C){1|C<4>,1|H<1>,4|C<3>,4|F<1>}	C[5](N[5]B[5]C)(N[5]C[5]C)(H){1|O<1>,2|C<3>}	109.9090	0.000	1	109.9090	0.000	1	109.9090	0.000	1	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	N[5,5]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5,5]-3:N[5]-3:S-1:	N[5](B[5]N[5,5]C[6a]2)(C[5]N[5,5]S)(CH3)	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](N[5,5]N[5,5]C[5])(N[5]B[5]C)(S)	N[5](B[5]N[5,5]C[6a]2)(C[5]N[5,5]S)(CH3){6|C<3>}	B[5](N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(N[5]C[5]C){1|C<4>,1|S<1>,4|F<1>,6|C<3>}	C[5](N[5,5]N[5,5]C[5])(N[5]B[5]C)(S){1|C<4>,4|C<3>}	115.9570	0.000	1	115.9570	0.000	1	115.9570	0.000	1	111.9301	2.769	9	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:3:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-3:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CH3)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CCO)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CH3){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){1|H<1>,4|C<4>,7|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CCO){1|H<1>,4|C<3>}	112.0050	0.000	1	112.0050	0.000	1	111.9145	0.016	2	111.9145	0.016	2	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:3:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-3:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CH3)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CC[6a]O)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CH3){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){1|H<1>,4|C<4>,7|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CC[6a]O){1|H<1>,4|C<3>}	111.8240	0.000	1	111.8240	0.000	1	111.9145	0.016	2	111.9145	0.016	2	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:3:4:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-4:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CC[6a]HH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CC[6a]HN)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C)(CC[6a]HH){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){1|H<1>,5|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(CC[6a]HN){1|H<1>,4|C<3>}	114.3970	0.000	1	114.3970	0.000	1	114.3970	0.000	1	114.3970	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:3:3:3:	3:4:3:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C[5])(CC[6a]HH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5,6a]N[5]H)(N[5]B[5]C)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]C[5])(CC[6a]HH){1|H<1>,1|N<3>,7|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]C){1|H<1>,5|C<4>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5,6a]N[5]H)(N[5]B[5]C){1|B<3>,1|C<4>,1|H<1>,6|C<3>}	112.4810	0.000	1	112.4810	0.000	1	112.4810	0.000	1	112.4810	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:3:4:	3:4:4:3:	3:3:1:	B[5]-4:C[5]-3:C-4:	C[5,6a]-3:C[6]-4:C[6]-4:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6]2)(C[5]C[5,6a]H)(CC3)	B[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]2H)2(N[5]C[5]C)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]C[6]2)(C[5]C[5,6a]H)(CC3){2|C<3>,2|H<1>,4|C<4>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6]C[6]2H)2(N[5]C[5]C){10|H<1>,2|C<3>,4|C<4>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,2|C<3>,2|C<4>}	109.3280	0.000	1	109.3280	0.000	1	109.3280	0.000	1	109.3280	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:4:3:	3:3:1:1:	3:3:3:	B[5]-4:C[6]-4:C[5]-3:	N[5]-3:B[5]-3:Cl-1:Cl-1:	N[5]-3:N[5]-3:N-3:	N[5](B[5]B[5]Cl2)(C[6]C[6]2H)(C[5]N[5]N)	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2	C[5](N[5]B[5]C[6])2(NCC)	N[5](B[5]B[5]Cl2)(C[6]C[6]2H)(C[5]N[5]N){1|N<3>,3|C<4>,4|H<1>}	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2{1|H<1>,1|N<3>,3|C<4>}	C[5](N[5]B[5]C[6])2(NCC){2|Cl<1>,1|N<3>,2|H<1>,4|C<4>}	110.7950	0.000	1	110.7950	0.000	1	110.7950	0.000	1	110.7950	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	5:SP2_SP2_SP3	N[5]	B[5]	C[5]	4:4:3:	3:3:2:2:	3:3:1:	B[5]-4:C-4:C[5]-3:	C[5,6a]-3:N[5]-3:O-2:O-2:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]OO)(CC[5a]C[6a]H)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(OC[6a])2	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H)	N[5](B[5]C[5,6a]OO)(CC[5a]C[6a]H)(C[5]C[5,6a]H){2|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(OC[6a])2{2|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]B[5]C)(H){1|H<1>,2|C<3>,2|O<2>}	111.5150	0.000	1	111.5150	0.000	1	111.5150	0.000	1	111.5150	0.000	1	112.0794	6.059	45	112.1667	10.341	115
542	786	818	6:SP2_SP2_SP3	N[5,6]	B[5,6]	C[5,6]	3:4:3:	3:3:3:2:	3:3:2:	C[5,6a]-3:B[5,6]-4:C[5,6]-3:	C[5,6a]-3:C[5,6a]-3:N[5,6]-3:O[6]-2:	C[6,6a]-3:N[5,6]-3:O[5]-2:	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]O[5])	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a])	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(O[5]C[5,6a])	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]O[5]){1|H<1>,8|C<3>}	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a]){1|O<2>,2|H<1>,8|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(O[5]C[5,6a]){1|H<1>,1|O<2>,6|C<3>}	122.2740	0.000	1	122.2740	0.000	1	122.2740	0.000	1	121.9645	0.192	2	121.9447	0.097	3	121.9447	0.097	3
542	786	818	6:SP2_SP2_SP3	N[5,6]	B[5,6]	C[5,6]	3:4:3:	3:3:3:2:	3:3:2:	C[5,6a]-3:B[5,6]-4:C[5,6]-3:	C[5,6a]-3:C[5,6a]-3:N[5,6]-3:O[6]-2:	C[6,6a]-3:N[5,6]-3:S[5]-2:	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]S[5])	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a])	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(S[5]C[5,6a])	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]S[5]){1|H<1>,8|C<3>}	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a]){1|S<2>,2|H<1>,8|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(S[5]C[5,6a]){1|H<1>,1|O<2>,6|C<3>}	121.6550	0.000	1	121.6550	0.000	1	121.6550	0.000	1	121.9645	0.192	2	121.9447	0.097	3	121.9447	0.097	3
542	786	818	6:SP2_SP2_SP3	N[5,6]	B[5,6]	C[5,6]	3:4:3:	3:3:3:2:	3:3:3:	C[5,6a]-3:B[5,6]-4:C[5,6]-3:	C[5,6a]-3:C[5,6a]-3:N[5,6]-3:O[6]-2:	C[6,6a]-3:N[5,6]-3:N[5]-3:	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]N[5])	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a])	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(N[5]C[5,6a]C[6a])	N[5,6](C[5,6a]C[5,6a]C[6a])(B[5,6]C[5,6a]2O[6])(C[5,6]C[6,6a]N[5]){1|H<1>,9|C<3>}	B[5,6](C[5,6a]C[5,6a]C[6a])2(N[5,6]C[5,6a]C[5,6])(O[6]C[6,6a]){1|N<3>,2|H<1>,8|C<3>}	C[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]C[5,6a]B[5,6])(N[5]C[5,6a]C[6a]){1|H<1>,1|O<2>,8|C<3>}	121.9050	0.000	1	121.9050	0.000	1	121.9050	0.000	1	121.9050	0.000	1	121.9447	0.097	3	121.9447	0.097	3
542	786	863	0:SP2_SP2_SP3	N[5]	B[5,6]	O	4:4:1:	3:3:3:3:	3:	B[5,6]-4:P[5]-4:O-1:	C[5,6]-3:C[6]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](B[5,6]C[5,6]C[6a]C[6])(P[5]C[6a]2C[5])(O)	B[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)(N[5]P[5]O)	O(N[5]B[5,6]P[5])	N[5](B[5,6]C[5,6]C[6a]C[6])(P[5]C[6a]2C[5])(O){10|C<3>}	B[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)(N[5]P[5]O){1|Si<4>,2|F<1>,9|C<3>}	O(N[5]B[5,6]P[5])	127.2060	0.000	1	127.2060	0.000	1	127.2060	0.000	1	127.2060	0.000	1	127.2060	0.000	1	126.0642	1.299	6
542	786	863	0:SP2_SP2_SP3	N[5]	B[5]	O	4:4:1:	3:3:3:3:	3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	O(N[5]B[5]P[5])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])	126.5155	0.409	2	126.5155	0.168	2	126.5155	0.168	2	126.5155	0.168	2	125.8358	1.233	5	126.0642	1.299	6
542	786	863	0:SP2_SP2_SP3	N[5]	B[5]	O	4:4:1:	3:3:4:3:	3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	O(N[5]B[5]P[5])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])	124.8510	0.000	1	125.8415	1.962	2	125.8415	1.962	2	125.8415	1.962	2	125.8358	1.233	5	126.0642	1.299	6
542	786	863	0:SP2_SP2_SP3	N[5]	B[5]	O	4:4:1:	3:3:4:3:	3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	O(N[5]B[5]P[5])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){3|H<1>,9|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|H<1>,4|F<1>,7|C<3>}	O(N[5]B[5]P[5])	126.8320	0.000	1	125.8415	1.962	2	125.8415	1.962	2	125.8415	1.962	2	125.8358	1.233	5	126.0642	1.299	6
542	786	863	0:SP2_SP2_SP3	N[5]	B[5]	O	4:4:1:	4:3:3:3:	3:	B[5]-4:P[5]-4:O-1:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|Si<4>,3|H<1>,8|C<3>}	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])	124.4650	0.000	1	124.4650	0.000	1	124.4650	0.000	1	124.4650	0.000	1	125.8358	1.233	5	126.0642	1.299	6
542	786	880	0:SP2_SP3_SP3	N[5]	B[5]	Si	4:4:4:	3:3:4:3:	3:4:4:4:	B[5]-4:P[5]-4:Si-4:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:C-4:C-4:C-4:	N[5](B[5]C[6a]2C[5])(P[5]C[5]CC)(SiC3)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]Si)	Si(N[5]B[5]P[5])(CH3)3	N[5](B[5]C[6a]2C[5])(P[5]C[5]CC)(SiC3){1|C<4>,3|H<1>,4|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]Si){1|H<1>,3|C<4>,4|C<3>,4|F<1>}	Si(N[5]B[5]P[5])(CH3)3	116.1160	0.000	1	116.1160	0.000	1	116.1160	0.000	1	116.1160	0.000	1	116.1160	0.000	1	116.1160	0.000	1
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:3:2:	3:3:3:3:	3:4:	B[5]-4:C[5]-3:O-2:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-4:	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(OC)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]O)	O(N[5]B[5]C[5])(CH3)	N[5](B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)(OC){6|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]C[5]O){2|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]C[5])(CH3)	118.1610	0.000	1	118.1610	0.000	1	118.1610	0.000	1	118.1610	0.000	1	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[5,6]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH)	B[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH){10|C<3>}	B[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]2)2(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,7|C<3>}	O(N[5]B[5]P[5])(H)	121.9090	0.000	1	121.9090	0.000	1	121.9090	0.000	1	121.9090	0.000	1	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:4:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){3|H<1>,9|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|H<1>,4|F<1>,7|C<3>}	O(N[5]B[5]P[5])(H)	124.1730	0.000	1	124.1730	0.000	1	124.1730	0.000	1	124.1730	0.000	1	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:4:3:	3:4:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:C-4:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	O(N[5]B[5]P[5])(CC[6a]HH)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(CC[6a]HH)	124.5140	0.000	1	124.5140	0.000	1	124.5140	0.000	1	124.5140	0.000	1	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:4:2:	4:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[5,5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[5,5,6]C[6a]2)(P[5]C[5,5,6]C[6a]2)(OH)	B[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[5,5,6]C[6a]2)(P[5]C[5,5,6]C[6a]2)(OH){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,3|C<4>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(H)	123.4710	0.000	1	123.4710	0.000	1	123.4710	0.000	1	123.4710	0.000	1	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP2_SP3_SP3	N[5]	B[5]	O	4:4:2:	4:3:3:3:	3:4:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-4:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(CC[6a]HH)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(CC[6a]HH)	123.6160	0.127	2	123.6160	0.016	2	123.6160	0.016	2	123.6160	0.016	2	122.7800	4.822	7	122.7800	4.822	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(P[5]C[5,6a]C[6a]2)(OH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[5,6a]C[6a]2)(P[5]C[5,6a]C[6a]2)(OH){10|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]P[5]O){1|H<1>,4|F<1>,8|C<3>}	O(N[5]B[5]P[5])(H)	120.6580	0.000	1	120.6580	0.000	1	120.6580	0.000	1	120.9910	0.083	3	121.8804	1.602	7	121.8804	1.602	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(H)	121.1575	0.001	2	121.1575	0.000	2	121.1575	0.000	2	120.9910	0.083	3	121.8804	1.602	7	121.8804	1.602	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	3:3:4:3:	3:4:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:C-4:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	O(N[5]B[5]P[5])(CC[6a]HH)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(CC[6a]HH)	123.4850	0.000	1	123.4850	0.000	1	123.4850	0.000	1	123.4850	0.000	1	121.8804	1.602	7	121.8804	1.602	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	4:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(H)	123.1010	0.000	1	123.1010	0.000	1	123.1010	0.000	1	123.0635	0.003	2	121.8804	1.602	7	121.8804	1.602	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	4:3:3:3:	3:1:	B[5]-4:P[5]-4:O-2:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:H-1:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(H)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){1|Si<4>,3|H<1>,8|C<3>}	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(H)	123.0260	0.000	1	123.0260	0.000	1	123.0260	0.000	1	123.0635	0.003	2	121.8804	1.602	7	121.8804	1.602	7
542	786	893	0:SP3_SP3_SP3	N[5]	B[5]	O	4:4:2:	4:3:3:3:	3:4:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:C-4:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	O(N[5]B[5]P[5])(CC[6a]CH)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	O(N[5]B[5]P[5])(CC[6a]CH)	120.5780	0.000	1	120.5780	0.000	1	120.5780	0.000	1	120.5780	0.000	1	121.8804	1.602	7	121.8804	1.602	7
542	786	941	0:SP2_SP2_SP3	N[5]	B[5,5]	N	4:4:2:	3:3:3:3:	3:1:	B[5,5]-4:B[5,5]-4:N-2:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:N[5]-3:	N[5]-3:N-1:	N[5](B[5,5]C[5,6a]3)2(NN)	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N)	N(N[5]B[5,5]2)(N)	N[5](B[5,5]C[5,6a]3)2(NN){10|C<3>}	B[5,5](C[5,6a]C[5,6a]C[6a])3(N[5]B[5,5]N){3|F<1>,8|C<3>}	N(N[5]B[5,5]2)(N)	122.4535	1.218	2	122.4535	1.484	2	122.4535	1.484	2	122.4535	1.484	2	122.4535	1.484	2	124.5225	6.830	4
542	786	941	0:SP2_SP2_SP3	N[5]	B[5]	N	4:4:2:	3:3:4:3:	3:2:	B[5]-4:P[5]-4:N-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:N-2:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N)	N(N[5]B[5]P[5])(NC[6a])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	N(N[5]B[5]P[5])(NC[6a])	125.6210	0.000	1	126.5915	1.884	2	126.5915	1.884	2	126.5915	1.884	2	126.5915	1.884	2	124.5225	6.830	4
542	786	941	0:SP2_SP2_SP3	N[5]	B[5]	N	4:4:2:	3:3:4:3:	3:2:	B[5]-4:P[5]-4:N-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:N-2:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N)	N(N[5]B[5]P[5])(NC[6a])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N){2|H<1>,4|F<1>,6|C<3>}	N(N[5]B[5]P[5])(NC[6a])	127.5620	0.000	1	126.5915	1.884	2	126.5915	1.884	2	126.5915	1.884	2	126.5915	1.884	2	124.5225	6.830	4
542	786	951	0:SP2_SP-NON_SP3	N[5]	B[5]	H	4:4:1:	3:3:3:3:	3:	B[5]-4:P[5]-4:H-1:	N[5,5a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](B[5]N[5,5a]C[6a]2)(P[5]C[5,5a]C[6a]2)(H)	B[5](N[5,5a]C[5,5a]N[5a])(C[6a]C[6a]2)2(N[5]P[5]H)	H(N[5]B[5]P[5])	N[5](B[5]N[5,5a]C[6a]2)(P[5]C[5,5a]C[6a]2)(H){1|N<2>,9|C<3>}	B[5](N[5,5a]C[5,5a]N[5a])(C[6a]C[6a]2)2(N[5]P[5]H){1|N<2>,4|F<1>,7|C<3>}	H(N[5]B[5]P[5])	120.8880	0.000	1	120.8880	0.000	1	120.8880	0.000	1	120.8880	0.000	1	120.4505	0.383	2	120.4505	0.383	2
542	786	951	0:SP2_SP-NON_SP3	N[5]	B[5]	H	4:4:1:	3:3:4:3:	3:	B[5]-4:P[5]-4:H-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(H)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]H)	H(N[5]B[5]P[5])	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(H){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]H){2|H<1>,4|F<1>,6|C<3>}	H(N[5]B[5]P[5])	120.0130	0.000	1	120.0130	0.000	1	120.0130	0.000	1	120.0130	0.000	1	120.4505	0.383	2	120.4505	0.383	2
542	786	955	5:SP2_SP3_SP3	N[5]	B[5,6]	P[5]	4:4:1:	3:3:3:3:	3:3:3:3:	B[5,6]-4:P[5]-4:O-1:	C[5,6]-3:C[6]-3:C[6a]-3:N[5]-3:	C[5]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5,6]C[5,6]C[6a]C[6])(P[5]C[6a]2C[5])(O)	B[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)(N[5]P[5]O)	P[5](C[5]C[5,6]C[6a])(C[6a]C[6a]2)2(N[5]B[5,6]O)	N[5](B[5,6]C[5,6]C[6a]C[6])(P[5]C[6a]2C[5])(O){10|C<3>}	B[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6])(C[6a]C[6a]2)(N[5]P[5]O){1|Si<4>,2|F<1>,9|C<3>}	P[5](C[5]C[5,6]C[6a])(C[6a]C[6a]2)2(N[5]B[5,6]O){2|C<4>,2|F<1>,9|C<3>}	114.3670	0.000	1	114.3670	0.000	1	114.3670	0.000	1	114.3670	0.000	1	114.3670	0.000	1	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:3:4:	3:3:3:4:	3:4:4:4:	B[5]-4:C[6a]-3:P[5]-4:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	N[5]-3:C[5]-4:C-4:C-4:	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC)	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH)	P[5](N[5]C[6a]B[5])(C[5]C[5]CH)(CC3)2	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC){1|C<4>,5|H<1>,6|C<3>}	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH){1|H<1>,3|C<4>,4|F<1>,6|C<3>}	P[5](N[5]C[6a]B[5])(C[5]C[5]CH)(CC3)2{2|H<1>,4|C<3>}	113.4280	0.000	1	113.4280	0.000	1	113.5955	0.056	2	113.5955	0.056	2	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:3:4:	3:3:3:4:	3:4:4:4:	B[5]-4:C[6a]-3:P[5]-4:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	N[5]-3:C[5]-4:C-4:C-4:	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC)	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH)	P[5](N[5]C[6a]B[5])(C[5]C[5]CH)(CCCH)2	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC){1|C<4>,5|H<1>,6|C<3>}	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH){1|H<1>,3|C<4>,4|F<1>,6|C<3>}	P[5](N[5]C[6a]B[5])(C[5]C[5]CH)(CCCH)2{2|H<1>,4|C<3>}	113.7630	0.000	1	113.7630	0.000	1	113.5955	0.056	2	113.5955	0.056	2	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:3:4:	3:3:3:4:	4:3:4:4:	B[5]-4:C[6a]-3:P[5]-4:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	C[5]-4:N[5]-3:C-4:C-4:	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC)	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH)	P[5](C[5]C[6a]C[5]H)(N[5]C[6a]B[5])(CC3)2	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC){5|H<1>,7|C<3>}	B[5](N[5]C[6a]P[5])(C[6a]C[6a]2)2(C[5]C[5]HH){1|H<1>,2|C<4>,4|F<1>,7|C<3>}	P[5](C[5]C[6a]C[5]H)(N[5]C[6a]B[5])(CC3)2{2|H<1>,6|C<3>}	114.6140	0.000	1	114.6140	0.000	1	114.6140	0.000	1	114.6140	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:3:4:	4:3:3:3:	4:3:4:4:	B[5]-4:C[6a]-3:P[5]-4:	C[5]-4:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-4:N[5]-3:C-4:C-4:	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC)	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]P[5])(C[6a]C[6a]2)2	P[5](C[5]C[6a]C[5]H)(N[5]C[6a]B[5])(CCCH)2	N[5](B[5]C[6a]2C[5])(C[6a]C[6a]2)(P[5]C[5]CC){4|H<1>,8|C<3>}	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]P[5])(C[6a]C[6a]2)2{1|H<1>,2|C<4>,4|F<1>,9|C<3>}	P[5](C[5]C[6a]C[5]H)(N[5]C[6a]B[5])(CCCH)2{1|H<1>,7|C<3>}	114.7210	0.000	1	114.7210	0.000	1	114.7210	0.000	1	114.7210	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:H-1:	N[5,5a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,5a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]N[5,5a]C[6a]2)(P[5]C[5,5a]C[6a]2)(H)	B[5](N[5,5a]C[5,5a]N[5a])(C[6a]C[6a]2)2(N[5]P[5]H)	P[5](C[5,5a]N[5,5a]C[5a])(C[6a]C[6a]2)2(N[5]B[5]H)	N[5](B[5]N[5,5a]C[6a]2)(P[5]C[5,5a]C[6a]2)(H){1|N<2>,9|C<3>}	B[5](N[5,5a]C[5,5a]N[5a])(C[6a]C[6a]2)2(N[5]P[5]H){1|N<2>,4|F<1>,7|C<3>}	P[5](C[5,5a]N[5,5a]C[5a])(C[6a]C[6a]2)2(N[5]B[5]H){2|N<2>,4|H<1>,7|C<3>}	118.2930	0.000	1	118.2930	0.000	1	118.2930	0.000	1	114.3723	15.246	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O){1|C<4>,4|H<1>,6|C<3>}	114.3400	0.000	1	112.4120	7.434	2	112.4120	7.434	2	114.3723	15.246	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O){2|H<1>,3|C<4>,6|C<3>}	110.4840	0.000	1	112.4120	7.434	2	112.4120	7.434	2	114.3723	15.246	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:H-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(H)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]H)	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]H)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(H){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]H){2|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]H){2|H<1>,4|C<4>,6|C<3>}	116.1750	0.000	1	116.1750	0.000	1	116.1750	0.000	1	116.1500	0.001	2	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]O){2|H<1>,4|C<4>,6|C<3>}	116.1250	0.000	1	116.1250	0.000	1	116.1250	0.000	1	116.1500	0.001	2	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	3:3:4:3:	4:3:3:3:	B[5]-4:P[5]-4:O-1:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	P[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){3|H<1>,9|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|H<1>,4|F<1>,7|C<3>}	P[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)2(N[5]B[5]O){2|H<1>,4|C<4>,8|C<3>}	116.2000	0.000	1	116.2000	0.000	1	116.2000	0.000	1	116.2000	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:1:	4:3:3:3:	3:3:4:3:	B[5]-4:P[5]-4:O-1:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O)	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(O){1|Si<4>,3|H<1>,8|C<3>}	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O){1|Si<4>,1|H<1>,4|C<4>,6|C<3>}	115.2600	0.000	1	115.2600	0.000	1	115.2600	0.000	1	115.2600	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,6]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH)	B[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,6]C[5,6]C[6,6])(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH){10|C<3>}	B[5](C[5,6]C[5,6]C[6])(C[6a]C[6a]2)2(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,7|C<3>}	P[5](C[5,6]C[5,6]C[6,6])(C[6a]C[6a]2)2(N[5]B[5]O){6|C<4>,7|C<3>}	121.9280	0.000	1	121.9280	0.000	1	121.9280	0.000	1	121.9280	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:N-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N)	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]N)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]N){2|H<1>,4|F<1>,6|C<3>}	114.8650	0.000	1	114.8650	0.000	1	116.7870	7.388	2	116.6660	3.738	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:N-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N)	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]N)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(NN){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]N){2|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]N){2|H<1>,4|C<4>,6|C<3>}	118.7090	0.000	1	118.7090	0.000	1	116.7870	7.388	2	116.6660	3.738	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC){4|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O){2|H<1>,4|C<4>,6|C<3>}	116.4240	0.000	1	116.4240	0.000	1	116.4240	0.000	1	116.6660	3.738	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:4:3:	4:3:3:3:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	P[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){3|H<1>,9|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|H<1>,4|F<1>,7|C<3>}	P[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)2(N[5]B[5]O){2|H<1>,4|C<4>,8|C<3>}	119.5950	0.000	1	119.5950	0.000	1	119.5950	0.000	1	119.5950	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	4:3:3:3:	4:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[5,5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,5,6]C[6a]2)(P[5]C[5,5,6]C[6a]2)(OH)	B[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,5,6]C[6a]2)(P[5]C[5,5,6]C[6a]2)(OH){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,3|C<4>,4|F<1>,6|C<3>}	P[5](C[5,5,6]C[5,5,6]2H)(C[6a]C[6a]2)2(N[5]B[5]O){2|H<1>,6|C<3>,7|C<4>}	119.3830	0.000	1	119.3830	0.000	1	119.3830	0.000	1	118.4333	0.681	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	4:3:3:3:	4:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O){3|H<1>,6|C<3>,6|C<4>}	117.9585	0.095	2	117.9585	0.009	2	117.9585	0.009	2	118.4333	0.681	3	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP2_SP3_SP3	N[5]	B[5]	P[5]	4:4:4:	3:3:4:3:	4:3:4:4:	B[5]-4:P[5]-4:Si-4:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[5]-4:N[5]-3:C-4:C-4:	N[5](B[5]C[6a]2C[5])(P[5]C[5]CC)(SiC3)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]Si)	P[5](C[5]C[5]CH)(N[5]B[5]Si)(CC3)2	N[5](B[5]C[6a]2C[5])(P[5]C[5]CC)(SiC3){1|C<4>,3|H<1>,4|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]Si){1|H<1>,3|C<4>,4|C<3>,4|F<1>}	P[5](C[5]C[5]CH)(N[5]B[5]Si)(CC3)2{2|C<3>,2|H<1>}	110.5860	0.000	1	110.5860	0.000	1	110.5860	0.000	1	110.5860	0.000	1	116.0405	8.396	20	115.9608	8.110	21
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,6a]C[6a]2)(P[5]C[5,6a]C[6a]2)(OH)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,6a]C[5,6a]C[6,6a])(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,6a]C[6a]2)(P[5]C[5,6a]C[6a]2)(OH){10|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(N[5]P[5]O){1|H<1>,4|F<1>,8|C<3>}	P[5](C[5,6a]C[5,6a]C[6,6a])(C[6a]C[6a]2)2(N[5]B[5]O){5|C<4>,8|C<3>}	118.9430	0.000	1	118.9430	0.000	1	118.9430	0.000	1	113.2923	24.193	3	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O){1|C<4>,4|H<1>,6|C<3>}	109.9720	0.000	1	110.4670	0.490	2	110.4670	0.490	2	113.2923	24.193	3	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:3:3:	3:3:3:3:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-3:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){1|Si<4>,1|C<4>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]C)(N[5]P[5]O){1|Si<4>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]Si)(N[5]B[5]O){2|H<1>,3|C<4>,6|C<3>}	110.9620	0.000	1	110.4670	0.490	2	110.4670	0.490	2	113.2923	24.193	3	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	3:3:4:3:	3:3:4:3:	B[5]-4:P[5]-4:O-2:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC)	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OC){1|C<4>,3|H<1>,8|C<3>}	B[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]P[5]O){1|C<4>,1|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]CH)(N[5]B[5]O){2|H<1>,4|C<4>,6|C<3>}	116.8560	0.000	1	116.8560	0.000	1	116.8560	0.000	1	116.8560	0.000	1	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	4:3:3:3:	3:3:4:3:	B[5]-4:P[5]-4:O-2:	C[5]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[6a]-3:C[6a]-3:C[5]-4:N[5]-3:	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH)	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O)	N[5](B[5]C[6a]2C[5])(P[5]C[6a]2C[5])(OH){1|Si<4>,3|H<1>,8|C<3>}	B[5](C[5]C[5]SiH)(C[6a]C[6a]2)2(N[5]P[5]O){2|H<1>,4|F<1>,6|C<3>}	P[5](C[6a]C[6a]2)2(C[5]C[5]HH)(N[5]B[5]O){1|Si<4>,1|H<1>,4|C<4>,6|C<3>}	118.6750	0.000	1	118.6750	0.000	1	118.6750	0.000	1	118.6750	0.000	1	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	4:3:3:3:	4:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OC){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O){3|H<1>,6|C<3>,6|C<4>}	115.1520	0.000	1	115.1520	0.000	1	117.5430	11.434	2	117.5430	11.434	2	115.7849	15.690	7	115.7849	15.690	7
542	786	955	5:SP3_SP3_SP3	N[5]	B[5]	P[5]	4:4:2:	4:3:3:3:	4:3:3:3:	B[5]-4:P[5]-4:O-2:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	C[5,6]-4:C[6a]-3:C[6a]-3:N[5]-3:	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH)	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O)	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O)	N[5](B[5]C[5,6]C[6a]2)(P[5]C[5,6]C[6a]2)(OH){2|C<4>,2|H<1>,8|C<3>}	B[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]P[5]O){2|C<4>,3|H<1>,4|F<1>,6|C<3>}	P[5](C[5,6]C[5,6]C[6]H)(C[6a]C[6a]2)2(N[5]B[5]O){3|H<1>,6|C<3>,6|C<4>}	119.9340	0.000	1	119.9340	0.000	1	117.5430	11.434	2	117.5430	11.434	2	115.7849	15.690	7	115.7849	15.690	7
542	786	956	0:SP2_SP3_SP3	N[5]	B[5]	N	3:4:3:	3:3:2:2:	3:3:4:	C[5]-3:B[5]-4:N-3:	C[5,6a]-3:N[5]-3:O-2:O-2:	N[5]-3:C[6a]-3:C-4:	N[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]OO)(NC[6a]C)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]N)(OC[6a])2	N(N[5]B[5]C[5])(C[6a]C[6a]2)(CH3)	N[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]OO)(NC[6a]C){4|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]N)(OC[6a])2{1|H<1>,3|C<3>}	N(N[5]B[5]C[5])(C[6a]C[6a]2)(CH3)	127.4850	0.000	1	127.4850	0.000	1	127.4850	0.000	1	127.4850	0.000	1	127.4850	0.000	1	127.4850	0.000	1
542	786	960	5:SP2_SP2_SP3	N[5]	B[5]	N[5]	4:3:2:	3:3:3:3:	3:3:	B[5]-4:C[6a]-3:N[5]-2:	C[5,6a]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:	N[5](B[5]C[5,6a]C[6a]2)(C[6a]C[6a]2)(N[5]C[5,6a])	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(C[6a]C[6a]2)2	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5])	N[5](B[5]C[5,6a]C[6a]2)(C[6a]C[6a]2)(N[5]C[5,6a]){2|H<1>,8|C<3>}	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(C[6a]C[6a]2)2{1|H<1>,4|F<1>,8|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]B[5]){1|H<1>,6|C<3>}	114.9820	0.000	1	114.9820	0.000	1	114.9820	0.000	1	114.9820	0.000	1	114.9820	0.000	1	114.9820	0.000	1
542	790	818	0:SP2_SP-NON_SP2	N[5]	Cl	C[5]	3:3:1:	3:	3:3:1:	C[5,6a]-3:C[5]-3:Cl-1:	N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(Cl)	Cl(N[5]C[5,6a]C[5])	C[5](N[5]C[5,6a]Cl)(N[5]C[5,6a]H)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(Cl){2|C<3>,2|H<1>}	Cl(N[5]C[5,6a]C[5])	C[5](N[5]C[5,6a]Cl)(N[5]C[5,6a]H)(H){2|C<3>}	125.8930	0.000	1	125.8930	0.000	1	125.8930	0.000	1	125.8930	0.000	1	125.8930	0.000	1	125.8930	0.000	1
542	811	818	0:SP2_SP2_SP3	N[5]	B[6a]	C[5]	4:3:3:	3:3:2:2:	3:3:1:	B[6a]-4:C[5]-3:N[5]-3:	N[5]-3:C[6a]-3:O[6a]-2:O[6a]-2:	N[5]-3:C[5]-3:H-1:	N[5](B[6a]C[6a]O[6a]2)(C[5]C[5]H)(N[5]C[5]H)	B[6a](N[5]C[5]N[5])(C[6a]C[6a]2)(O[6a]B[6a])2	C[5](N[5]B[6a]N[5])(C[5]C[5]H)(H)	N[5](B[6a]C[6a]O[6a]2)(C[5]C[5]H)(N[5]C[5]H){2|B<3>,2|C<3>,2|H<1>}	B[6a](N[5]C[5]N[5])(C[6a]C[6a]2)(O[6a]B[6a])2{1|O<2>,4|H<1>,6|C<3>}	C[5](N[5]B[6a]N[5])(C[5]C[5]H)(H){1|C<3>,2|H<1>,2|O<2>}	131.6630	0.000	1	131.6630	0.000	1	131.6630	0.000	1	131.6630	0.000	1	131.6630	0.000	1	131.6630	0.000	1
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:O-1:	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O)	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|O<1>,2|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O){1|H<1>,5|C<3>}	118.2082	0.729	6	118.2082	0.531	6	119.2770	4.306	8	119.2770	4.306	8	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:O-1:	N[5](C[5]C[5,6a]O)2(N[5a]C[5a]2)	N[5a](C[5a]C[5a]C[6a])(C[5a]C[5a]H)(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O)	N[5](C[5]C[5,6a]O)2(N[5a]C[5a]2){1|H<1>,5|C<3>}	N[5a](C[5a]C[5a]C[6a])(C[5a]C[5a]H)(N[5]C[5]2){1|C<4>,1|H<1>,2|O<1>,4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O){1|H<1>,1|O<1>,4|C<3>}	122.4835	0.261	2	122.4835	0.068	2	119.2770	4.306	8	119.2770	4.306	8	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:2:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[6a]-3:N[5]-3:N[5]-2:	N[5](C[5]C[6a]N[5])(C[5]C[6]N[5])(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[6a]C[6a]N[6a])(N[5]N[5a]C[5])(N[5]N[5])	N[5](C[5]C[6a]N[5])(C[5]C[6]N[5])(N[5a]C[5a]2){1|Fe<6>,1|N<2>,1|N<3>,2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	C[5](C[6a]C[6a]N[6a])(N[5]N[5a]C[5])(N[5]N[5]){1|Fe<6>,1|H<1>,5|C<3>}	127.6200	1.607	2	127.6200	2.581	2	127.6200	2.581	2	127.6200	2.581	2	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-3:	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CC[6a]Si)	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|O<1>,2|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CC[6a]Si){1|H<1>,1|O<1>,4|C<3>}	124.9088	2.013	5	124.9088	4.054	5	124.6195	3.745	6	125.3699	2.837	12	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-3:	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CSiC)	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|O<1>,2|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CSiC){1|H<1>,1|O<1>,4|C<3>}	123.1730	0.000	1	123.1730	0.000	1	124.6195	3.745	6	125.3699	2.837	12	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	N[5]-3:C[6]-3:N[5]-3:	N[5](C[5]C[6]N[5])2(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](N[5]N[5a]C[5])(C[6]C[6]N[6])(N[5]N[5]Fe)	N[5](C[5]C[6]N[5])2(N[5a]C[5a]2){2|Fe<6>,2|H<1>,2|N<3>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	C[5](N[5]N[5a]C[5])(C[6]C[6]N[6])(N[5]N[5]Fe){1|Fe<6>,1|H<1>,5|C<3>}	126.7535	0.549	4	126.7535	0.301	4	126.1203	1.144	6	125.3699	2.837	12	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	N[5]-3:C[6]-3:N[5]-3:	N[5](C[5]C[6a]N[5])(C[5]C[6]N[5])(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](N[5]N[5a]C[5])(C[6]C[6]N[6])(N[5]N[5]Fe)	N[5](C[5]C[6a]N[5])(C[5]C[6]N[5])(N[5a]C[5a]2){1|Fe<6>,1|N<2>,1|N<3>,2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]N[5a]C[5])(C[6]C[6]N[6])(N[5]N[5]Fe){1|H<1>,5|C<3>}	124.8540	0.072	2	124.8540	0.005	2	126.1203	1.144	6	125.3699	2.837	12	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5a]-3:C[5]-3:C[5]-3:	C[5a]-3:C[5a]-3:N[5]-3:	N[5]-3:N[5]-3:C-4:	N[5](N[5a]C[5a]2)(C[5]N[5]C)2	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](N[5]N[5a]C[5])(N[5]N[5]Fe)(CHHN)	N[5](N[5a]C[5a]2)(C[5]N[5]C)2{2|Fe<6>,2|C<3>,2|H<1>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){2|C<4>,2|H<1>,2|N<3>}	C[5](N[5]N[5a]C[5])(N[5]N[5]Fe)(CHHN){1|Fe<6>,1|C<4>,2|C<3>}	126.6035	0.545	2	126.6035	0.297	2	126.6035	0.297	2	126.6035	0.297	2	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	3:4:3:	3:3:3:	3:3:1:	N[5a]-3:B[5]-4:C[5]-3:	C[5a,6a]-3:N[5]-3:C[5a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H)	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H){3|H<1>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H){1|H<1>,6|C<3>}	120.3470	0.000	1	120.3470	0.000	1	120.3470	0.000	1	120.3470	0.000	1	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP2	N[5]	N[5a]	C[5]	4:3:3:	3:3:3:	3:3:1:	B[5]-4:N[5a]-3:C[5]-3:	C[5a,6a]-3:C[5a,6a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H)	N[5a](C[5a,6a]C[5a,6a]C[6a])2(N[5]B[5]C[5])	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H)	N[5](B[5]C[5,6a]C[6a]2)(N[5a]C[5a,6a]2)(C[5]C[5,6a]H){10|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(N[5]B[5]C[5]){3|H<1>,8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H){1|H<1>,6|C<3>}	118.2030	0.000	1	118.2030	0.000	1	118.2030	0.000	1	118.2030	0.000	1	123.2943	13.559	26	123.2943	13.559	26
542	813	818	0:SP2_SP2_SP3	N[5]	N[5a]	C[5]	3:4:3:	3:3:3:	3:3:1:	N[5a]-3:B[5]-4:C[5]-3:	C[5a,6a]-3:N[5]-3:C[5a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H)	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H)	N[5](N[5a]C[5a,6a]C[5a])(B[5]C[5,6a]C[6a]2)(C[5]C[5,6a]H){1|H<1>,9|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(N[5]B[5]C[5])(C[5a]C[5a]H){3|H<1>,6|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]B[5])(H){1|H<1>,6|C<3>}	121.1570	0.000	1	121.1570	0.000	1	121.1570	0.000	1	121.1570	0.000	1	122.8070	5.445	2	122.8070	5.445	2
542	813	818	0:SP2_SP2_SP3	N[5]	N[5a]	C[5]	3:4:3:	3:3:3:	3:3:4:	N[5a]-3:C[5]-4:C[5]-3:	C[5a]-3:C[5a]-3:N[5]-3:	N[5]-3:C[5]-3:C-4:	N[5](N[5a]C[5a]2)(C[5]C[5]CH)(C[5]C[5]C)	N[5a](C[5a]C[5a]C)2(N[5]C[5]2)	C[5](N[5]N[5a]C[5])(C[5]C[5]C)(CH3)	N[5](N[5a]C[5a]2)(C[5]C[5]CH)(C[5]C[5]C){2|C<3>,4|C<4>}	N[5a](C[5a]C[5a]C)2(N[5]C[5]2){1|H<1>,2|C<3>,4|C<4>}	C[5](N[5]N[5a]C[5])(C[5]C[5]C)(CH3){1|H<1>,2|C<3>,2|C<4>}	124.4570	0.000	1	124.4570	0.000	1	124.4570	0.000	1	124.4570	0.000	1	122.8070	5.445	2	122.8070	5.445	2
542	813	818	0:SP3_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:1:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:O-1:	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O)	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|O<1>,2|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(O){1|H<1>,5|C<3>}	117.1830	0.000	1	117.1830	0.000	1	117.1830	0.000	1	117.1830	0.000	1	120.6740	24.374	2	120.6740	24.374	2
542	813	818	0:SP3_SP2_SP2	N[5]	N[5a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N[5a]-3:	C[5a]-3:C[5a]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C-3:	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2)	N[5a](C[5a]C[5a]H)2(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CSiC)	N[5](C[5]C[5,6a]C)(C[5]C[5,6a]O)(N[5a]C[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a]C[5a]H)2(N[5]C[5]2){1|O<1>,2|H<1>,3|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5a]C[5])(CSiC){1|H<1>,1|O<1>,4|C<3>}	124.1650	0.000	1	124.1650	0.000	1	124.1650	0.000	1	124.1650	0.000	1	120.6740	24.374	2	120.6740	24.374	2
542	813	818	5:SP2_SP2_SP2	N[5,6]	N[5,6a]	C[5,6]	3:4:3:	3:3:3:	3:3:2:	N[5,6a]-3:C[6]-4:C[5,6]-3:	C[5,6a]-3:N[5,6]-3:C[6a]-3:	N[5,6]-3:N[6]-3:N[5]-2:	N[5,6](N[5,6a]C[5,6a]C[6a])(C[6]C[6,6]C[6a]H)(C[5,6]N[5]N[6])	N[5,6a](C[5,6a]N[6a]N[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]H)	C[5,6](N[5,6]N[5,6a]C[6])(N[6]C[6,6]H)(N[5]C[5,6a])	N[5,6](N[5,6a]C[5,6a]C[6a])(C[6]C[6,6]C[6a]H)(C[5,6]N[5]N[6]){1|N<2>,2|H<1>,5|C<3>}	N[5,6a](C[5,6a]N[6a]N[5])(N[5,6]C[5,6]C[6])(C[6a]C[6a]H){1|N<3>,2|H<1>,3|C<3>}	C[5,6](N[5,6]N[5,6a]C[6])(N[6]C[6,6]H)(N[5]C[5,6a]){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	104.9250	0.000	1	104.9250	0.000	1	104.9250	0.000	1	104.9250	0.000	1	104.9250	0.000	1	104.9250	0.000	1
542	813	818	6:SP2_SP2_SP2	N[5,6]	N[5a,6]	C[5,6]	3:3:3:	3:3:3:	3:3:3:	N[5a,6]-3:C[5,6]-3:C[5]-3:	C[5a,6]-3:N[5,6]-3:C[5a]-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](N[5a,6]C[5a,6]C[5a])(C[5,6]C[5]C[6])(C[5]N[5]Ir)	N[5a,6](C[5a,6]C[5a]C[6])(N[5,6]C[5,6]C[5])(C[5a]N[5a]Ir)	C[5,6](N[5,6]N[5a,6]C[5])(C[5]N[5]H)(C[6]C[6]H)	N[5,6](N[5a,6]C[5a,6]C[5a])(C[5,6]C[5]C[6])(C[5]N[5]Ir){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5a,6](C[5a,6]C[5a]C[6])(N[5,6]C[5,6]C[5])(C[5a]N[5a]Ir){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]N[5a,6]C[5])(C[5]N[5]H)(C[6]C[6]H){1|Ir<8>,1|C<4>,1|H<1>,2|C<3>}	122.9910	0.000	1	122.9910	0.000	1	122.4545	0.576	2	122.4545	0.576	2	122.4545	0.576	2	122.4545	0.576	2
542	813	818	6:SP2_SP2_SP2	N[5,6]	N[5a,6]	C[5,6]	3:3:3:	3:3:3:	3:3:3:	N[5a,6]-3:C[5,6]-3:C[5]-3:	C[5a,6]-3:N[5,6]-3:C[5a]-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](N[5a,6]C[5a,6]C[5a])(C[5,6]C[5]C[6])(C[5]N[5]Rh)	N[5a,6](C[5a,6]C[5a]C[6])(N[5,6]C[5,6]C[5])(C[5a]N[5a]Rh)	C[5,6](N[5,6]N[5a,6]C[5])(C[5]N[5]H)(C[6]C[6]H)	N[5,6](N[5a,6]C[5a,6]C[5a])(C[5,6]C[5]C[6])(C[5]N[5]Rh){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5a,6](C[5a,6]C[5a]C[6])(N[5,6]C[5,6]C[5])(C[5a]N[5a]Rh){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5,6](N[5,6]N[5a,6]C[5])(C[5]N[5]H)(C[6]C[6]H){1|Rh<6>,1|C<4>,1|H<1>,2|C<3>}	121.9180	0.000	1	121.9180	0.000	1	122.4545	0.576	2	122.4545	0.576	2	122.4545	0.576	2	122.4545	0.576	2