762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:C-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(C)	C[6](C[6]C[6]Pd)(C[6]C[6]C)(CC)	C(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(C){1|Pd<4>,1|C<2>}	C[6](C[6]C[6]Pd)(C[6]C[6]C)(CC){1|C<2>}	C(C[6]C[6]2)	122.3960	0.000	1	122.3960	0.000	1	122.3960	0.000	1	122.3960	0.000	1	121.8640	12.189	10	121.8640	12.189	10
762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:C-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(C)	C[6](C[6]C[6]C)2(CGe[6]O)	C(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(C){1|C<1>,1|C<2>,1|C<4>}	C[6](C[6]C[6]C)2(CGe[6]O){1|C<3>}	C(C[6]C[6]2)	121.7755	1.218	2	121.7755	1.484	2	121.7755	1.484	2	124.4222	10.054	4	121.8640	12.189	10	121.8640	12.189	10
762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:C-1:	C[6]-3:C[6]-3:Si-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(C)	C[6](C[6]C[6]C)2(SiIr2)	C(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(C){1|C<2>,2|C<1>}	C[6](C[6]C[6]C)2(SiIr2){1|C<3>}	C(C[6]C[6]2)	127.0690	0.810	2	127.0690	0.657	2	127.0690	0.657	2	124.4222	10.054	4	121.8640	12.189	10	121.8640	12.189	10
762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:C-1:	C[6]-3:C[6]-3:C-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(C)	C[6](C[6]C[6]C)(C[6]C[6]O)(C)	C(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(C){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]O)(C){1|Cl<1>,1|C<3>,1|O<1>}	C(C[6]C[6]2)	120.8365	1.378	2	120.8365	1.899	2	120.8365	1.899	2	118.9032	5.617	4	121.8640	12.189	10	121.8640	12.189	10
762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:C-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(C)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(O)	C(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(C){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]C)(O){1|Cl<1>,1|C<1>,1|C<3>}	C(C[6]C[6]2)	116.9700	0.023	2	116.9700	0.001	2	116.9700	0.001	2	118.9032	5.617	4	121.8640	12.189	10	121.8640	12.189	10
762	762	899	0:SP2_SP-NON_SP2	C[6]	C[6]	C	4:3:1:	3:4:2:	3:	C[3,6]-4:C[6]-3:C-1:	C[6]-3:C[6]-4:C-2:	C[6]-3:	C[6](C[3,6]C[3]2C[6])(C[6]C[6]C)(C)	C[6](C[6]C[3,6]C)(C[6]N[6]HH)(CN)	C(C[6]C[3,6]C[6])	C[6](C[3,6]C[3]2C[6])(C[6]C[6]C)(C){1|N<3>,1|O<1>,6|H<1>}	C[6](C[6]C[3,6]C)(C[6]N[6]HH)(CN){2|C<3>,2|C<4>}	C(C[6]C[3,6]C[6])	122.9420	0.000	1	122.9420	0.000	1	122.9420	0.000	1	122.9420	0.000	1	121.8640	12.189	10	121.8640	12.189	10
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	2:3:1:	3:3:2:	3:	O[6]-2:C[6]-3:N-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(N)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]C)(N){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CN){2|C<3>}	N(C[6]C[6]O[6])	124.6060	0.000	1	124.6060	0.000	1	124.6060	0.000	1	124.6060	0.000	1	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:N-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(N)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	N(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(N){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	N(C[6]C[6]2)	115.5660	0.000	1	115.5660	0.000	1	121.2082	8.092	6	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:N-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(N)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(N){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)	122.5837	0.588	4	122.5837	0.346	4	121.2082	8.092	6	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:N-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(N)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)	C[6](C[6]C[6]H)2(N){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)	121.3480	0.000	1	121.3480	0.000	1	121.2082	8.092	6	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:N-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(N)	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	N(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(N){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)	120.6532	0.484	4	120.6532	0.234	4	120.6532	0.234	4	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:N-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(N)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(N){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	N(C[6]C[6]N[6])	121.4660	0.000	2	121.4660	0.000	2	121.9760	0.780	3	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:N-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(N)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(N){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N(C[6]C[6]N[6])	122.9960	0.000	1	122.9960	0.000	1	121.9760	0.780	3	121.2146	3.810	13	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:N-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(N)	C[6](C[6]N[6]N)(C[6]N[6]O)(NCdC)	N(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(N){1|N<3>,1|O<1>,1|O<2>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NCdC){1|C<3>,2|C<4>}	N(C[6]C[6]N[6])	122.9590	0.000	1	122.9590	0.000	1	122.9590	0.000	1	122.9590	0.000	1	121.7092	4.271	16	121.7092	4.271	16
762	762	901	0:SP2_SP1_SP2	C[6]	C[6]	N	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:N-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(COO)	N(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(N){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(COO){3|C<3>,3|H<1>}	N(C[6]C[6]2)	123.9920	0.000	1	123.9920	0.000	1	123.9920	0.000	1	123.9920	0.000	1	121.7092	4.271	16	121.7092	4.271	16
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	2:3:1:	3:3:4:	3:3:	P[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:	C[6](P[6]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C)(C[6]P[6]H)(CH3)	P[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)	C[6](P[6]C[5,6])(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]P[6]H)(CH3){1|C<3>,1|P<4>}	P[6](C[5,6]C[5,6]C[5])(C[6]C[6]H){1|P<4>,2|C<3>,2|C<4>}	128.5600	0.000	1	128.5600	0.000	1	128.5600	0.000	1	128.5600	0.000	1	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:P[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(P[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	P[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]C)(P[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|C<3>,1|H<1>}	P[6](C[6]C[6]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<2>,2|C<3>}	128.8810	0.130	2	128.8810	0.017	2	128.8810	0.017	2	128.8810	0.017	2	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:P[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(P[6]C[6])(OSn)	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H)	P[6](C[6]C[6a]C[6])(C[6]C[6]O)	C[6](C[6]C[6]H)(P[6]C[6])(OSn){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H){1|H<1>,3|C<3>}	P[6](C[6]C[6a]C[6])(C[6]C[6]O){2|H<1>,3|C<3>}	123.9560	0.000	1	123.9560	0.000	1	123.9560	0.000	1	123.9560	0.000	1	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:P[6]-2:O-2:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]N[5a]N[6])(P[6]C[6])(OAl)	C[6](N[5a]C[5a]N[5a])(C[6]P[6]O)(N[6]N[6])	P[6](C[6]N[5a]N[6])(C[6]C[6]O)	C[6](C[6]N[5a]N[6])(P[6]C[6])(OAl){1|C<3>,1|N<3>,2|N<2>}	C[6](N[5a]C[5a]N[5a])(C[6]P[6]O)(N[6]N[6]){1|C<4>,3|C<3>}	P[6](C[6]N[5a]N[6])(C[6]C[6]O){1|C<3>,1|N<3>,2|N<2>}	120.7210	0.000	1	120.7210	0.000	1	120.7210	0.000	1	120.7210	0.000	1	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:P[6]-2:P-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	P[6](C[6]C[6]P)2	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|C<4>}	P[6](C[6]C[6]P)2{1|C<3>,2|C<4>}	123.8690	0.202	2	123.8690	0.041	2	123.9260	0.030	3	123.9260	0.030	3	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:P[6]-2:P-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	P[6](C[6]C[6]Si)(C[6]C[6]P)	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|H<1>}	P[6](C[6]C[6]Si)(C[6]C[6]P){1|C<3>,1|C<4>,1|H<1>}	124.0400	0.000	1	124.0400	0.000	1	123.9260	0.030	3	123.9260	0.030	3	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:P[6]-2:Si-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(P[6]C[6])(SiC3)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	P[6](C[6]C[6]Si)(C[6]C[6]P)	C[6](C[6]C[6]H)(P[6]C[6])(SiC3){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	P[6](C[6]C[6]Si)(C[6]C[6]P){1|C<3>,1|C<4>,1|H<1>}	121.0470	0.000	1	121.1095	0.008	2	121.1095	0.008	2	121.1095	0.008	2	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:P[6]-2:Si-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(P[6]C[6])(SiC3)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	P[6](C[6]C[6]Si)(C[6]C[6]P)	C[6](C[6]C[6]H)(P[6]C[6])(SiC3){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	P[6](C[6]C[6]Si)(C[6]C[6]P){1|C<3>,1|C<4>,1|H<1>}	121.1720	0.000	1	121.1095	0.008	2	121.1095	0.008	2	121.1095	0.008	2	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:P[6]-2:Si-4:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]C[6])(P[6]C[6])(SiC3)	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H)	P[6](C[6]C[6]Si)2	C[6](C[6]C[6a]C[6])(P[6]C[6])(SiC3){1|Si<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H){2|H<1>,4|C<3>}	P[6](C[6]C[6]Si)2{3|C<3>}	120.7165	0.039	2	120.7165	0.002	2	120.7165	0.002	2	120.7165	0.002	2	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:P[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6])	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	P[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|C<4>,1|P<2>,2|C<3>}	P[6](C[6]C[6]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<2>,2|C<3>}	119.3970	0.361	2	119.3970	0.130	2	119.3970	0.130	2	122.3626	7.381	5	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:P[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6])	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	P[6](C[6]C[6a]C[6])(C[6]C[6]O)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]){1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	P[6](C[6]C[6a]C[6])(C[6]C[6]O){2|H<1>,3|C<3>}	124.5290	0.000	1	124.5290	0.000	1	124.3397	0.039	3	122.3626	7.381	5	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:P[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6])	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	P[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]){2|H<1>,5|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	P[6](C[6]C[6a]C[6])2{2|H<1>,5|C<3>}	124.2450	0.156	2	124.2450	0.024	2	124.3397	0.039	3	122.3626	7.381	5	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6]-3:P[6]-2:	C[6]-3:C[6]-3:P[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6])	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6])	P[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	P[6](C[6]C[6]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<2>,2|C<3>}	120.7090	0.351	2	120.7090	0.123	2	120.7090	0.123	2	120.7090	0.123	2	123.1905	8.905	20	123.1905	8.905	20
762	762	904	6:SP2_SP-NON_SP2	C[6]	C[6]	P[6]	3:4:2:	3:3:4:	3:3:	C[6]-3:P-4:P[6]-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(PC[6a]2B)(P[6]C[6])	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	P[6](C[6]C[6]Si)(C[6]C[6]P)	C[6](C[6]C[6]C)(PC[6a]2B)(P[6]C[6]){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|H<1>}	P[6](C[6]C[6]Si)(C[6]C[6]P){1|C<3>,1|C<4>,1|H<1>}	124.1500	0.000	1	124.1500	0.000	1	124.1500	0.000	1	124.1500	0.000	1	123.1905	8.905	20	123.1905	8.905	20
762	762	907	6:SP2_SP2_SP3	C[6]	C[6]	Ge[4,6]	4:3:3:	3:4:1:	3:3:4:4:	Ge[4,6]-4:C[6a]-3:C[6]-3:	C[6]-3:Ge[6]-4:H-1:	C[4]-3:C[6]-3:Ge[4]-4:Si[6]-4:	C[6](Ge[4,6]Ge[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Ge[6]H)	C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H)	Ge[4,6](C[4]C[6a]C[4])(C[6]C[6a]C[6])(Ge[4]C[4]Si2)(Si[6]Si[6]CC)	C[6](Ge[4,6]Ge[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Ge[6]H){5|Si<4>,2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H){1|Ge<4>,1|Si<4>,2|C<4>,3|C<3>}	Ge[4,6](C[4]C[6a]C[4])(C[6]C[6a]C[6])(Ge[4]C[4]Si2)(Si[6]Si[6]CC){1|Ge<4>,2|C<4>,2|H<1>,4|C<3>}	123.6290	0.000	1	123.6290	0.000	1	123.6290	0.000	1	123.5595	0.010	2	123.5595	0.010	2	123.5595	0.010	2
762	762	907	6:SP2_SP2_SP3	C[6]	C[6]	Ge[4,6]	4:3:3:	3:4:1:	3:3:4:4:	Ge[4,6]-4:C[6a]-3:C[6]-3:	C[6]-3:Si[6]-4:H-1:	C[4]-3:C[6]-3:Si[4]-4:Si[6]-4:	C[6](Ge[4,6]Si[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Si[6]H)	C[6](C[6]Ge[4,6]C[6a])(Si[6]Si[6]Si2)(H)	Ge[4,6](C[4]C[6a]C[4])(C[6]C[6a]C[6])(Si[4]C[4]Si2)(Si[6]Si[6]CC)	C[6](Ge[4,6]Si[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Si[6]H){5|Si<4>,2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]Ge[4,6]C[6a])(Si[6]Si[6]Si2)(H){2|Si<4>,2|C<4>,3|C<3>}	Ge[4,6](C[4]C[6a]C[4])(C[6]C[6a]C[6])(Si[4]C[4]Si2)(Si[6]Si[6]CC){1|Si<4>,2|C<4>,2|H<1>,4|C<3>}	123.4900	0.000	1	123.4900	0.000	1	123.4900	0.000	1	123.5595	0.010	2	123.5595	0.010	2	123.5595	0.010	2
762	762	909	0:SP2_SP2_SP2	C[6,6]	C[6,6]	S	4:3:2:	4:3:3:	3:3:	C[3x6]-4:C[6,6]-3:S-2:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:C-3:	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(SC)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]S)(COO)	S(C[6,6]C[3x6]C[6,6])(COO)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(SC){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]S)(COO){1|H<1>,4|C<3>}	S(C[6,6]C[3x6]C[6,6])(COO)	124.5820	0.000	1	124.5820	0.000	1	124.5820	0.000	1	124.5820	0.000	1	124.5820	0.000	1	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:2:	2:3:2:	3:4:	S[6]-2:C[6]-3:S-2:	S[6]-2:C[6]-3:S-2:	C[6]-3:C-4:	C[6](S[6]C[5,6])(C[6]S[6]S)(SC)	C[6](S[6]C[5,6])(C[6]S[6]S)(SC)	S(C[6]C[6]S[6])(CH3)	C[6](S[6]C[5,6])(C[6]S[6]S)(SC){2|C<3>}	C[6](S[6]C[5,6])(C[6]S[6]S)(SC){2|C<3>}	S(C[6]C[6]S[6])(CH3)	122.6815	3.753	2	122.6815	14.082	2	122.4413	7.214	3	122.4413	7.214	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:2:	2:3:2:	3:4:	S[6]-2:C[6]-3:S-2:	S[6]-2:C[6]-3:S-2:	C[6]-3:C-4:	C[6](S[6]C[6,6a])(C[6]S[6]S)(SC)	C[6](S[6]C[6,6a])(C[6]S[6]S)(SC)	S(C[6]C[6]S[6])(CH3)	C[6](S[6]C[6,6a])(C[6]S[6]S)(SC){1|C<3>,1|N<2>}	C[6](S[6]C[6,6a])(C[6]S[6]S)(SC){1|C<3>,1|N<2>}	S(C[6]C[6]S[6])(CH3)	121.9610	0.000	1	121.9610	0.000	1	122.4413	7.214	3	122.4413	7.214	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:2:	3:3:1:	3:3:	N[6]-2:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a])	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(C[6a]C[6a]2)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a]){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	S(C[6]C[6]N[6])(C[6a]C[6a]2)	113.7340	0.000	1	113.7340	0.000	1	113.7340	0.000	1	113.7340	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:2:	3:3:1:	3:4:	N[6]-2:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[5,6])(C[6]C[6]H)(SC)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[6a]HH)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	S(C[6]C[6]N[6])(CC[6a]HH)	112.9660	0.000	1	112.9660	0.000	1	112.9660	0.000	1	112.9660	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:3:	3:3:1:	5:3:	S-2:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:H-1:	B[3x3,3x5,12x6]-5:C[6]-3:	C[6](SB[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(B[3x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]N[6])	C[6](SB[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(B[3x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]N[6])	126.8800	0.000	1	126.8800	0.000	1	126.8800	0.000	1	122.7260	28.000	5	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:3:	3:3:1:	5:3:	S-2:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:H-1:	C[3x3,3x5,12x6]-5:C[6]-3:	C[6](SC[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]N[6])	C[6](SC[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]N[6])	126.3995	1.249	2	126.3995	1.561	2	126.3995	1.561	2	122.7260	28.000	5	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:3:	3:3:1:	5:3:	S-2:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Ir)(C[6]C[6]H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]N[6])	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	S(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]N[6])	116.8040	0.000	1	116.8040	0.000	1	116.9755	0.059	2	122.7260	28.000	5	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:3:	3:3:1:	5:3:	S-2:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Rh)(C[6]C[6]H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]N[6])	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Rh)(C[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	S(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]N[6])	117.1470	0.000	1	117.1470	0.000	1	116.9755	0.059	2	122.7260	28.000	5	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	2:3:3:	3:3:1:	6:3:	S-2:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:	C[6](SC[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]N[6])	C[6](SC[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	S(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]N[6])	116.2150	0.000	1	116.2150	0.000	1	116.2150	0.000	1	116.2150	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:2:2:	3:3:	C[6]-3:S[6]-2:S-2:	C[6]-3:S[6]-2:S-2:	C[6]-3:C-3:	C[6](C[6]S[6]S)(S[6]C[6])(SC)	C[6](C[6]S[6]S)(S[6]C[6])(SSn)	S(C[6]C[6]S[6])(COO)	C[6](C[6]S[6]S)(S[6]C[6])(SC){1|C<4>,2|H<1>}	C[6](C[6]S[6]S)(S[6]C[6])(SSn){1|C<4>,2|H<1>}	S(C[6]C[6]S[6])(COO)	122.1625	0.678	2	122.1625	0.460	2	122.1625	0.460	2	122.1625	0.460	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:S-2:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a])	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H)	S(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a]){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	S(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	121.9630	0.000	1	121.9630	0.000	1	121.9630	0.000	1	121.9630	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:3:1:	3:4:	C[6]-3:N[6]-2:S-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]N[6]H)(N[6]C[6])(SC)	C[6](N[6]C[6]Co)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[6a]HH)	C[6](C[6]N[6]H)(N[6]C[6])(SC){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	S(C[6]C[6]N[6])(CC[6a]HH)	118.1380	0.000	1	118.1380	0.000	1	118.1380	0.000	1	121.2400	18.146	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:3:1:	3:4:	C[6]-3:O[6]-2:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(O[6]B[6])(SC)	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H)	S(C[6]C[6]O[6])(CH3)	C[6](C[6]C[6]H)(O[6]B[6])(SC){1|C<3>,1|O<2>,2|F<1>}	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H){1|B<4>,2|C<3>}	S(C[6]C[6]O[6])(CH3)	119.4850	0.000	1	119.4850	0.000	1	119.4850	0.000	1	121.2400	18.146	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:3:1:	3:4:	C[6]-3:S[6]-2:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(S[6]C[6])(SC)	C[6](C[6]S[6]S)2(H)	S(C[6]C[6]S[6])(CCHH)	C[6](C[6]C[6]H)(S[6]C[6])(SC){1|C<3>,1|O<2>,2|S<2>}	C[6](C[6]S[6]S)2(H){1|C<4>}	S(C[6]C[6]S[6])(CCHH)	126.0970	0.000	1	126.0970	0.000	1	126.0970	0.000	1	121.2400	18.146	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	3:3:2:	3:4:	C[6]-3:S[6]-2:S-2:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:C-4:	C[6](C[6]C[5a]O[6])(S[6]C[6])(SC)	C[6](C[5a]C[5a]S[5a])(C[6]S[6]S)(O[6]C[6])	S(C[6]C[6]S[6])(CH3)	C[6](C[6]C[5a]O[6])(S[6]C[6])(SC){1|S<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]S[6]S)(O[6]C[6]){1|C<4>,1|H<1>,3|C<3>}	S(C[6]C[6]S[6])(CH3)	123.1020	0.000	1	123.1020	0.000	1	123.1020	0.000	1	123.1020	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	4:3:3:	3:4:	C[6]-3:S[6]-2:S-2:	C[6]-4:C[6]-3:C-3:	C[6]-3:C-4:	C[6](C[6]C[6]C)(S[6]C[6])(SC)	C[6](C[6]C[5a]C[6]H)(C[6]S[6]S)(CC[5a]O)	S(C[6]C[6]S[6])(CH3)	C[6](C[6]C[6]C)(S[6]C[6])(SC){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a]C[6]H)(C[6]S[6]S)(CC[5a]O){1|C<2>,1|S<2>,2|C<3>}	S(C[6]C[6]S[6])(CH3)	121.6790	0.000	1	121.6790	0.000	1	120.6807	1.320	3	120.6807	1.320	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	4:3:3:	3:4:	C[6]-3:S[6]-2:S-2:	C[6]-4:C[6]-3:C-3:	C[6]-3:C-4:	C[6](C[6]C[6]C)(S[6]C[6])(SC)	C[6](C[6]C[6]HH)(C[6]S[6]S)(CC[6a]O)	S(C[6]C[6]S[6])(CH3)	C[6](C[6]C[6]C)(S[6]C[6])(SC){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]S[6]S)(CC[6a]O){1|C<4>,2|H<1>}	S(C[6]C[6]S[6])(CH3)	119.4250	0.000	1	119.4250	0.000	1	120.6807	1.320	3	120.6807	1.320	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:2:2:	4:3:3:	3:4:	C[6]-3:S[6]-2:S-2:	C[6]-4:C[6]-3:C-3:	C[6]-3:C-4:	C[6](C[6]C[6]C)(S[6]C[6])(SC)	C[6](C[6]N[6]HH)(C[6]S[6]S)(CC[6a]O)	S(C[6]C[6]S[6])(CH3)	C[6](C[6]C[6]C)(S[6]C[6])(SC){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]S[6]S)(CC[6a]O){1|C<3>,1|C<4>}	S(C[6]C[6]S[6])(CH3)	120.9380	0.000	1	120.9380	0.000	1	120.6807	1.320	3	120.6807	1.320	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:2:1:	3:4:	C[5,6]-3:C[6]-3:S-2:	C[6]-3:O[6]-2:O-1:	C[6]-3:C-4:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]O[6]O)(SC)	C[6](C[6]C[5,6]S)(O[6]C[6])(O)	S(C[6]C[5,6]C[6])(CF3)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]O[6]O)(SC){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]S)(O[6]C[6])(O){1|C<3>,1|C<4>,2|H<1>}	S(C[6]C[5,6]C[6])(CF3)	115.9680	0.000	1	115.9680	0.000	1	115.9680	0.000	1	116.3085	0.232	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:2:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-2:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6])(H)	S(C[6]C[6]2)(CHHS)	C[6](C[6]C[6]H)2(SC){1|H<1>,1|N<2>}	C[6](C[6]C[6]S)(C[6]N[6])(H){1|C<3>,1|H<1>}	S(C[6]C[6]2)(CHHS)	116.6490	0.000	1	116.6490	0.000	1	116.6490	0.000	1	116.3085	0.232	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:2:1:	4:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-2:H-1:	C[6,6]-4:C[6]-3:	C[6](C[6]C[6]H)2(SC[6,6])	C[6](C[6]C[6]S)(C[6]C[6])(H)	S(C[6,6]C[6,6]2H)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6,6]){1|C<3>,1|H<1>}	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,2|H<1>}	S(C[6,6]C[6,6]2H)(C[6]C[6]2)	124.8750	0.000	1	124.8750	0.000	1	124.8750	0.000	1	124.8750	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:2:3:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-2:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)2(SC[6a])	C[6](C[6]C[6]S)(C[6]C[6])(CCC)	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	C[6](C[6]C[6]C)2(SC[6a]){1|C<2>}	C[6](C[6]C[6]S)(C[6]C[6])(CCC){1|C<2>,1|C<3>}	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	118.8325	0.738	4	118.8325	0.545	4	118.8325	0.545	4	118.8325	0.545	4	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-2:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CC[6a])	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CC[6a])	121.5460	4.589	4	121.5460	21.056	4	121.5460	21.056	4	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	S(C[6]C[6]2)(SC[6])	120.3654	5.357	16	120.7226	24.160	34	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(SC[6])	121.4995	6.841	2	120.7226	24.160	34	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(SC[6])	120.9235	3.610	4	120.7226	24.160	34	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(SC[6])	121.0023	5.014	12	120.7226	24.160	34	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6a])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	S(C[6]C[6]2)(SC[6a])	120.2810	3.948	2	120.8593	19.817	6	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)2(SS)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(SC[6a])	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(SC[6a])	121.1485	5.244	4	120.8593	19.817	6	120.7431	22.986	40	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)(N[6]C[6]H)(SS)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(SC[6a])	C[6](C[6]C[6]H)(N[6]C[6]H)(SS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(C[6]C[6]N[6])(SC[6a])	121.6200	0.000	1	121.6200	0.000	1	127.4998	11.155	5	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-2:	C[6](C[6]C[6]H)(N[6]C[6]O)(SS)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(SC[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(SS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6]C[6]N[6])(SC[6])	128.9698	0.684	4	128.9698	0.468	4	127.4998	11.155	5	121.4981	25.149	49	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H)	S(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a]){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	S(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	123.6800	0.312	3	123.6800	0.097	3	123.6800	0.097	3	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|C<4>,1|H<1>,3|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	117.0973	0.921	13	117.0973	0.848	13	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|C<4>,1|H<1>,3|C<3>}	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	117.2550	0.000	1	117.2550	0.000	1	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	110.9290	0.000	1	112.5233	2.090	3	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){2|H<1>,3|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	113.3205	0.606	2	112.5233	2.090	3	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a]){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|H<1>,1|N<3>,3|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	118.2420	0.000	1	118.2420	0.000	1	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|H<1>,1|S<2>,3|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	116.0325	1.602	2	116.0325	2.565	2	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a]){2|C<3>,2|O<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|H<1>,1|S<2>,1|S<4>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	116.6470	0.000	1	116.6470	0.000	1	116.3830	3.639	21	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[5])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[5]C[5]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[5]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	S(C[5]C[5]2)(C[6]C[6]2)	120.2425	5.167	2	120.2425	26.696	2	120.2425	26.696	2	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)2	C[6](C[6]C[6]H)2(SC[6]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	S(C[6]C[6]2)2	119.9345	3.302	8	119.9345	10.906	8	119.9345	10.906	8	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	S(C[6a]C[5,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	S(C[6a]C[5,6a]C[6a])(C[6]C[6]2)	120.5070	0.000	1	120.5070	0.000	1	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	S(C[6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|S<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	S(C[6a]C[6,6a]C[6a])(C[6]C[6]2)	120.8420	0.000	1	120.8420	0.000	1	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|C<3>,1|N<2>,1|O<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	127.1050	0.000	1	126.5110	0.371	3	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	126.2140	0.461	2	126.5110	0.371	3	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a]){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.0697	1.637	4	120.0697	2.681	4	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a])	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a]){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.2400	6.602	2	120.2400	43.580	2	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6a])	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.9617	0.458	4	120.9617	0.210	4	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6a])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	121.1970	6.036	2	120.9583	15.270	10	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6a])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.8100	5.145	2	120.9583	15.270	10	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6a])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.8645	3.929	4	120.9583	15.270	10	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(SC[6a])	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	121.0555	5.293	2	120.9583	15.270	10	121.4028	11.766	25	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]S)2(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a]){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]S)2(O){1|C<3>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	118.8517	0.992	4	118.8517	0.985	4	118.8517	0.985	4	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:N[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]O)(SC[6a])	C[6](C[6]C[6]S)(N[6]C[6]H)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]O)(SC[6a]){1|C<4>,3|H<1>}	C[6](C[6]C[6]S)(N[6]C[6]H)(O){1|C<4>,1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	117.0130	0.000	1	117.0130	0.000	1	117.0130	0.000	1	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a])	C[6](N[6]C[6]Zn)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a]){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]S)(H){1|C<3>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.3910	7.153	2	120.3910	51.167	2	120.3910	51.167	2	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(SC[6a])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(SC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	S(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	124.3150	0.000	1	124.3150	0.000	1	124.3150	0.000	1	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[5a,6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a])	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H)	S(C[6]N[5a,6]C[6])(C[6a]C[6a]2)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a]){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	S(C[6]N[5a,6]C[6])(C[6a]C[6a]2)	123.6020	0.895	2	123.6020	0.801	2	123.6020	0.801	2	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC[6])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])2	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC[6]){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])2	111.1225	0.363	2	111.1225	0.132	2	115.3968	3.695	30	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])2	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])2	114.8774	0.673	14	115.5052	2.146	26	115.3968	3.695	30	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])2	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<7>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])2	116.4782	1.905	6	115.5052	2.146	26	115.3968	3.695	30	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])2	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])2	115.9970	1.843	6	115.5052	2.146	26	115.3968	3.695	30	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SC[6])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])2	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])2	118.2620	0.341	2	118.2620	0.116	2	115.3968	3.695	30	118.3509	14.395	99	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H)	S(C[6]C[6,6a]C[6])(CC3)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	S(C[6]C[6,6a]C[6])(CC3)	120.3340	0.000	1	120.3340	0.000	1	120.3340	0.000	1	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(O){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	S(C[6]C[6]2)(CCHH)	111.9180	0.181	2	111.9180	0.033	2	111.9180	0.033	2	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:B-4:	C[6](C[6]C[6]H)2(SB)	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	S(C[6]C[6]2)(BMo2B)	C[6](C[6]C[6]H)2(SB){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6]C[6]2)(BMo2B)	120.0155	2.018	4	120.0155	4.071	4	120.0155	4.071	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|C<3>,1|N<2>,1|O<1>}	S(C[6]C[6]2)(CCHH)	126.3505	0.398	2	126.3505	0.158	2	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]N)(SC)	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)(C[6]C[6]N)(SC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	S(C[6]C[6]2)(CH3)	125.6550	0.000	1	125.6550	0.000	1	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(SC)	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	S(C[6]C[6]2)(CH3)	127.6910	0.000	1	127.6910	0.000	1	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]N[6]C)(SC)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]N[6]C)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	S(C[6]C[6]2)(CCHH)	123.1880	0.000	1	123.1880	0.000	1	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)2(SC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	S(C[6]C[6]2)(CH3)	116.4800	0.000	1	116.4800	0.000	1	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]C)(H)	S(C[6]C[6]2)(CC[6a]HH)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|C<3>}	C[6](C[6]C[6]S)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CC[6a]HH)	120.2549	4.657	8	120.2549	21.688	8	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CCHH)	121.2648	4.265	10	121.2492	21.770	20	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CCHH)	121.5290	4.998	2	121.2492	21.770	20	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CCHH)	121.0160	7.089	4	121.2492	21.770	20	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CCHH)	121.3035	4.959	4	121.2492	21.770	20	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)2(SC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CH3)	125.4280	0.000	1	125.4280	0.000	1	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CHHS)	C[6](C[6]C[6]H)2(SC){1|H<1>,1|N<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	S(C[6]C[6]2)(CHHS)	125.1700	0.000	1	121.3876	26.017	9	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CHHS)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	S(C[6]C[6]2)(CHHS)	120.5405	5.226	4	121.3876	26.017	9	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	S(C[6]C[6]2)(CHHS)	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	S(C[6]C[6]2)(CHHS)	121.2890	6.028	4	121.3876	26.017	9	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H)	S(C[6]C[6]2)(CCCH)	C[6](C[6]C[6]H)2(SC){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	S(C[6]C[6]2)(CCCH)	119.9255	4.775	24	119.9255	22.804	24	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(SC)	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)2(SC){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	S(C[6]C[6]2)(CH3)	119.7825	4.102	8	119.7825	16.826	8	120.8833	21.735	76	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(SC)	C[6](C[6]C[6]H)(C[6]C[6]S)(O)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(O){1|C<3>,1|H<1>,1|S<2>}	S(C[6]C[6]2)(CH3)	112.8820	0.000	1	112.8820	0.000	1	111.5017	1.466	3	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6]O)(C[6]C[6]S)(SC)	C[6](C[6]C[6]S)2(O)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]O)(C[6]C[6]S)(SC){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]S)2(O){1|C<3>,2|S<2>}	S(C[6]C[6]2)(CCHH)	110.8115	0.272	2	110.8115	0.074	2	111.5017	1.466	3	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]N[6,6]O)(C[6]C[6]O)(SC)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]S)(O)	S(C[6]C[6]2)(CCHH)	C[6](C[6]N[6,6]O)(C[6]C[6]O)(SC){1|H<1>,3|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]S)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	S(C[6]C[6]2)(CCHH)	117.0530	0.000	1	117.0530	0.000	1	117.0530	0.000	1	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC)	C[6](N[6]C[6,6a]H)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]S)(H){1|S<2>,2|C<3>}	S(C[6]C[6]2)(CH3)	121.6045	0.950	2	121.6045	0.902	2	119.8585	4.367	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]C)(C[6]N[6]H)(SC)	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H)	S(C[6]C[6]2)(CC[6a]HH)	C[6](C[6]C[6]C)(C[6]N[6]H)(SC){1|Ni<5>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	S(C[6]C[6]2)(CC[6a]HH)	118.1125	0.080	2	118.1125	0.006	2	119.8585	4.367	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(SC)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CH3)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(SC){1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	S(C[6]C[6]N[6])(CH3)	127.2420	0.000	1	127.2420	0.000	1	127.2420	0.000	1	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[5]HH)	C[6](C[6]C[6]H)(N[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(C[6]C[6]N[6])(CC[5]HH)	126.9220	0.000	1	126.9220	0.000	1	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[6a]HH)	C[6](C[6]C[6]H)(N[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(C[6]C[6]N[6])(CC[6a]HH)	128.8715	0.366	2	128.8715	0.134	2	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CHHS)	C[6](C[6]C[6]H)(N[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	S(C[6]C[6]N[6])(CHHS)	119.7900	0.000	1	119.7900	0.000	1	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]O)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]O)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6]C[6]N[6])(CCHH)	128.7686	0.613	5	128.7686	0.375	5	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]O)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[6a]HH)	C[6](C[6]C[6]H)(N[6]C[6]O)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6]C[6]N[6])(CC[6a]HH)	128.6225	0.682	10	128.6225	0.465	10	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]O)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CHHS)	C[6](C[6]C[6]H)(N[6]C[6]O)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	S(C[6]C[6]N[6])(CHHS)	128.8520	0.478	2	128.8520	0.228	2	128.2013	4.178	21	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[5]HH)	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<8>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])(CC[5]HH)	116.9660	0.000	1	116.9660	0.000	1	118.8635	3.831	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CPdCH)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])(CPdCH)	118.3760	0.000	1	118.3760	0.000	1	118.8635	3.831	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SC)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CC[5]HH)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<4>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])(CC[5]HH)	118.5050	0.000	1	118.5050	0.000	1	118.8635	3.831	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(SC)	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(CCHH)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(SC){1|O<2>,2|F<1>,3|C<3>}	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H){1|B<4>,3|C<3>}	S(C[6]C[6]N[6])(CCHH)	121.6070	0.000	1	121.6070	0.000	1	118.8635	3.831	4	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SP)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[6]C[6]N[6])(PRuCC)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	S(C[6]C[6]N[6])(PRuCC)	116.4540	0.290	3	116.4540	0.084	3	116.4540	0.084	3	121.5553	28.459	120	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:	C[6](C[6]C[6]H)2(SC[6,6])	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	S(C[6,6]C[6,6]2H)(C[6]C[6]2)	C[6](C[6]C[6]H)2(SC[6,6]){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	S(C[6,6]C[6,6]2H)(C[6]C[6]2)	116.3000	0.000	1	116.3000	0.000	1	116.3000	0.000	1	118.1620	6.934	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:1:	4:3:	N[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[5])	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	S(C[5]C[5,6a]C[5]Pd)(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[5]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	S(C[5]C[5,6a]C[5]Pd)(C[6]C[6]N[6])	120.0240	0.000	1	120.0240	0.000	1	120.0240	0.000	1	118.1620	6.934	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:1:	C[6]-3:C[6]-3:S-2:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:H-1:	C[6](C[6]C[5a]O[6])2(SH)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6])	S(C[6]C[6]2)(H)	C[6](C[6]C[5a]O[6])2(SH){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	S(C[6]C[6]2)(H)	120.5495	0.224	2	120.5495	0.050	2	120.5495	0.050	2	120.5495	0.050	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:2:	C[6]-3:C[6]-3:S-2:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:S-2:	C[6](C[6]C[5a]O[6])2(SS)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6])	S(C[6]C[6]2)(SC[6])	C[6](C[6]C[5a]O[6])2(SS){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	S(C[6]C[6]2)(SC[6])	120.7565	0.735	4	120.7565	0.540	4	120.7565	0.540	4	120.7565	0.540	4	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6]-3:S-2:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:C-3:	C[6](C[6]C[5a]O[6])2(SC)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6])	S(C[6]C[6]2)(CCO)	C[6](C[6]C[5a]O[6])2(SC){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]S)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	S(C[6]C[6]2)(CCO)	120.3915	0.586	4	120.3915	0.343	4	120.3915	0.343	4	121.5560	4.732	6	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:S-2:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a])	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(SC[6a]){1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	123.8850	2.522	2	123.8850	6.358	2	123.8850	6.358	2	121.5560	4.732	6	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:4:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(SC)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC)	S(C[6]C[6,6a]C[6])(CCHH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(SC){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC){1|H<1>,2|C<3>}	S(C[6]C[6,6a]C[6])(CCHH)	118.8370	1.322	2	118.8370	1.748	2	118.8370	1.748	2	121.5784	38.428	7	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:4:	C[6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:C-4:	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(SC)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(SC){1|N<3>,2|C<3>,2|H<1>}	S(C[6]C[6]2)(CH3)	120.0875	1.232	2	120.0875	1.519	2	120.0875	1.519	2	121.5784	38.428	7	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]N)(SC)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[6]H)(C[6]C[6]N)(SC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NC){1|C<3>,2|H<1>}	S(C[6]C[6]2)(CH3)	113.3420	0.000	1	113.3420	0.000	1	113.3420	0.000	1	121.5784	38.428	7	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:2:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C-4:	C[6](C[6]C[6]O)(C[6]C[6]S)(SC)	C[6](C[6]C[6]O)(C[6]C[6]S)(SC)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]O)(C[6]C[6]S)(SC){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]O)(C[6]C[6]S)(SC){1|C<3>,1|O<1>,1|S<2>}	S(C[6]C[6]2)(CCHH)	129.9290	0.723	2	129.9290	0.522	2	129.9290	0.522	2	121.5784	38.428	7	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:3:	3:2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:S-2:	C[6](C[6]C[6]C)(N[6]C[6]H)(SS)	C[6](C[6]C[6]H)(C[6]N[6]S)(COO)	S(C[6]C[6]N[6])(SC[6a])	C[6](C[6]C[6]C)(N[6]C[6]H)(SS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(COO){1|C<3>,2|H<1>}	S(C[6]C[6]N[6])(SC[6a])	122.1250	0.000	1	122.1250	0.000	1	122.1250	0.000	1	122.1250	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:N[5]-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N[5])(SC[6a]){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	119.4790	0.000	1	119.4790	0.000	1	119.4790	0.000	1	119.4790	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:3:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:N[6]-3:C-3:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]N[6]C)(SC)	C[6](C[6]C[6]S)(N[6]C[6]H)(COO)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]N[6]C)(SC){1|C<3>,2|H<1>}	C[6](C[6]C[6]S)(N[6]C[6]H)(COO){1|C<3>,2|H<1>}	S(C[6]C[6]2)(CCHH)	119.4970	0.000	1	119.4970	0.000	1	119.4970	0.000	1	118.0255	4.331	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:3:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:C-4:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]H)(SC)	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]S)	S(C[6]C[6]N[6])(CH3)	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]H)(SC){5|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]S){3|H<1>,6|C<3>}	S(C[6]C[6]N[6])(CH3)	116.5540	0.000	1	116.5540	0.000	1	116.5540	0.000	1	118.0255	4.331	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:C-4:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(CH3)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(CH3){1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.6191	0.755	12	120.6191	0.570	12	120.6614	0.546	13	120.7589	0.637	14	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:C-4:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(CH3)	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(CH3){1|O<1>,2|C<3>}	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	121.1690	0.000	1	121.1690	0.000	1	120.6614	0.546	13	120.7589	0.637	14	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:4:	3:3:	N[6]-3:C[6]-3:S-2:	N[6]-3:C[6]-3:C-4:	C[6]-3:C-3:	C[6](N[6]C[5,6]C[6a])(C[6]N[6]C)(SC)	C[6](N[6]C[5,6]C)(C[6]N[6]S)(CH3)	S(C[6]C[6]N[6])(CCC)	C[6](N[6]C[5,6]C[6a])(C[6]N[6]C)(SC){1|Se<2>,1|C<4>,3|C<3>}	C[6](N[6]C[5,6]C)(C[6]N[6]S)(CH3){3|C<3>}	S(C[6]C[6]N[6])(CCC)	122.0260	0.000	1	122.0260	0.000	1	122.0260	0.000	1	120.7589	0.637	14	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:4:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C-4:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(SC)	C[6](C[6]C[5,6,6]O)(C[6]C[6]S)(CH3)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(SC){1|O<1>,1|S<2>,2|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]S)(CH3){1|H<1>,1|O<1>,2|C<4>}	S(C[6]C[6]2)(CH3)	119.7150	0.000	1	119.7150	0.000	1	121.3017	1.895	3	121.3017	1.895	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	3:3:4:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C-4:	C[6](C[6]C[6]C)(C[6]N[6]H)(SC)	C[6](C[6]C[6]S)2(CH3)	S(C[6]C[6]2)(CC[6a]HH)	C[6](C[6]C[6]C)(C[6]N[6]H)(SC){1|Ni<5>,1|C<3>,1|S<2>}	C[6](C[6]C[6]S)2(CH3){1|N<3>,2|H<1>}	S(C[6]C[6]2)(CC[6a]HH)	122.0950	0.117	2	122.0950	0.014	2	121.3017	1.895	3	121.3017	1.895	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[5,6]-4:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]S)(O)	S(C[6a]C[5,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]S)(O){3|C<3>,4|H<1>}	S(C[6a]C[5,6a]C[6a])(C[6]C[6]2)	119.4510	0.000	1	119.4510	0.000	1	119.4510	0.000	1	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6,6]-4:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a])	C[6](C[6,6]C[6]2S[6])(C[6]C[6]S)(O)	S(C[6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|S<2>,2|C<4>}	C[6](C[6,6]C[6]2S[6])(C[6]C[6]S)(O){1|O<2>,2|H<1>,4|C<3>}	S(C[6a]C[6,6a]C[6a])(C[6]C[6]2)	117.9000	0.000	1	117.9000	0.000	1	117.9000	0.000	1	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(SC[6])	C[6](C[6]C[6]HH)(C[6]C[6]S)(O)	S(C[6]C[6]2)2	C[6](C[6]C[6]N)(C[6]C[6]O)(SC[6]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(O){1|N<3>,3|C<4>}	S(C[6]C[6]2)2	118.2370	0.305	2	118.2370	0.093	2	118.6040	0.451	3	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]O)2(SC[6])	C[6](C[6]C[6]HH)(C[6]C[6]S)(O)	S(C[6]C[6]2)2	C[6](C[6]C[6]O)2(SC[6]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(O){1|O<2>,3|C<4>}	S(C[6]C[6]2)2	119.3380	0.000	1	119.3380	0.000	1	118.6040	0.451	3	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]HH)(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(O){2|C<4>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	116.0350	0.505	8	116.0350	0.255	8	116.6113	2.316	10	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]HH)(C[6]C[6]S)(O)	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(O){2|C<4>,2|H<1>}	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	117.2170	0.000	1	117.2170	0.000	1	116.6113	2.316	10	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]O)(SC[6a])	C[6](C[6]C[6]HH)(C[6]C[6]S)(O)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]O)(SC[6a]){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(O){1|N<3>,1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	120.6160	0.000	1	120.6160	0.000	1	116.6113	2.316	10	117.2851	2.612	15	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:4:	C[6,6a]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]S)(H)	S(C[6]C[6,6a]C[6])(CF3)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]S)(H){1|S<4>,6|C<3>}	S(C[6]C[6,6a]C[6])(CF3)	117.9140	0.000	1	117.9140	0.000	1	118.9963	0.950	3	119.0385	0.641	4	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:4:	C[6,6a]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H)	S(C[6]C[6,6a]C[6])(CF3)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H){6|C<3>}	S(C[6]C[6,6a]C[6])(CF3)	119.5375	0.378	2	119.5375	0.143	2	118.9963	0.950	3	119.0385	0.641	4	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:1:	3:4:	C[6]-3:C[6]-3:S-2:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(SC)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]S)(C[6]C[6]S)(O)	S(C[6]C[6]2)(CH3)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(SC){1|O<1>,1|S<2>,2|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]S)(C[6]C[6]S)(O){2|C<3>,2|H<1>,3|C<4>}	S(C[6]C[6]2)(CH3)	119.1650	0.000	1	119.1650	0.000	1	119.1650	0.000	1	119.0385	0.641	4	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:2:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]O)2(SC[6])	C[6](C[6]C[6]HH)(C[6]C[6]S)(OH)	S(C[6]C[6]2)2	C[6](C[6]C[6]O)2(SC[6]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(OH){1|O<1>,3|C<4>}	S(C[6]C[6]2)2	120.4860	0.000	1	120.4860	0.000	1	120.4860	0.000	1	120.1267	0.115	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:2:	3:3:	C[6]-3:C[6]-3:S-2:	S[6]-4:C[6]-3:S-2:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a])	C[6](S[6]C[6,6a]OO)(C[6]C[6]S)(SC[6a])	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a]){2|C<3>,2|O<1>}	C[6](S[6]C[6,6a]OO)(C[6]C[6]S)(SC[6a]){1|O<1>,2|C<3>}	S(C[6a]C[6a]2)(C[6]C[6]2)	119.8130	0.000	1	119.8130	0.000	1	119.8130	0.000	1	120.1267	0.115	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:2:	3:3:	C[6]-3:N[6]-3:S-2:	C[6]-4:C[6]-3:C-2:	C[6]-3:C[6a]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(SC[6a])	C[6](C[6]C[6a]C[6]H)(C[6]N[6]S)(CN)	S(C[6]C[6]N[6])(C[6a]C[6a]2)	C[6](C[6]C[6]C)(N[6]C[6]H)(SC[6a]){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]S)(CN){1|C<2>,1|H<1>,3|C<3>}	S(C[6]C[6]N[6])(C[6a]C[6a]2)	120.0810	0.000	1	120.0810	0.000	1	120.0810	0.000	1	120.1267	0.115	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:2:	3:4:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:O-2:	C[6]-3:C-4:	C[6](C[6]N[6,6]O)(C[6]C[6]O)(SC)	C[6](C[6]C[6,6]CH)(C[6]C[6]S)(OC)	S(C[6]C[6]2)(CCHH)	C[6](C[6]N[6,6]O)(C[6]C[6]O)(SC){1|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]S)(OC){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	S(C[6]C[6]2)(CCHH)	121.8090	0.000	1	121.8090	0.000	1	121.8090	0.000	1	121.8090	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:3:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(SC[6])	C[6](C[6]C[6]HH)(C[6]C[6]S)(NC[6a]H)	S(C[6]C[6]2)2	C[6](C[6]C[6]N)(C[6]C[6]O)(SC[6]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(NC[6a]H){1|O<1>,3|C<4>}	S(C[6]C[6]2)2	119.8780	0.202	2	119.8780	0.041	2	119.8780	0.041	2	119.8780	0.041	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:3:	3:4:	C[6]-3:N[6]-3:S-2:	C[6]-4:C[6]-3:N-3:	C[6]-3:C-4:	C[6](C[6]C[6]N)(N[6]C[6]C)(SC)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]S)(NOO)	S(C[6]C[6]N[6])(CH3)	C[6](C[6]C[6]N)(N[6]C[6]C)(SC){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]S)(NOO){1|C<4>,1|N<3>,3|C<3>}	S(C[6]C[6]N[6])(CH3)	124.4595	1.428	2	124.4595	2.038	2	124.4595	2.038	2	124.4595	2.038	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:4:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:C-4:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]HH)(C[6]C[6]S)(CH3)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(CH3){1|C<4>,1|O<1>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	121.6230	0.446	8	121.6230	0.199	8	121.5497	0.222	9	121.5497	0.222	9	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:3:2:	4:3:4:	3:3:	C[6]-3:C[6]-3:S-2:	C[6]-4:C[6]-3:C-4:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a])	C[6](C[6]C[6]HH)(C[6]C[6]S)(CH3)	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(SC[6a]){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]S)(CH3){1|C<4>,1|O<1>,2|H<1>}	S(C[6a]C[6a]N[6a])(C[6]C[6]2)	120.9630	0.000	1	120.9630	0.000	1	121.5497	0.222	9	121.5497	0.222	9	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:4:2:	4:3:3:	3:3:	C[6]-3:C[6]-4:S-2:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(SC[6a])	C[6](C[5,6]C[5,5]C[5,6]N)(C[6a]C[6a]2)(C[6]C[6]S)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(SC[6a]){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,5]C[5,6]N)(C[6a]C[6a]2)(C[6]C[6]S){2|C<3>,2|C<4>,2|O<2>,6|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	119.8560	0.000	1	119.8560	0.000	1	119.8560	0.000	1	121.3633	2.021	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	3:4:2:	4:3:3:	3:3:	C[6]-3:C[6]-4:S-2:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]O[6]HH)(SC[6a])	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]S)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]O[6]HH)(SC[6a]){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]S){1|C<4>,1|O<2>,4|C<3>,6|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	122.1170	0.796	2	122.1170	0.634	2	122.1170	0.634	2	121.3633	2.021	3	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6a])	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6a]){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ti<9>,1|C<3>,1|H<1>,1|O<2>}	S(C[6a]C[6a]2)(C[6]C[6]2)	121.4882	0.808	4	121.4882	0.653	4	121.4882	0.653	4	120.0653	5.297	6	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:S-2:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]CH)(C[6]N[6]H)(SC[6a])	C[6](C[6]C[6]S)(N[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]N[6]H)(SC[6a]){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]S)(N[6]C[6]S)(H){1|C<3>,2|C<4>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	116.8810	0.000	1	116.8810	0.000	1	117.2195	0.229	2	120.0653	5.297	6	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:S-2:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(SC[6a])	C[6](C[6]C[6]S)(N[6]C[6]S)(H)	S(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(SC[6a]){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]S)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	S(C[6a]C[6a]2)(C[6]C[6]2)	117.5580	0.000	1	117.5580	0.000	1	117.2195	0.229	2	120.0653	5.297	6	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:2:	3:3:	S[6]-4:C[6]-3:S-2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6a]-3:	C[6](S[6]C[6,6a]OO)(C[6]C[6]S)(SC[6a])	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a])	S(C[6]C[6]S[6])(C[6a]C[6a]2)	C[6](S[6]C[6,6a]OO)(C[6]C[6]S)(SC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]S[6]S)(SC[6a]){2|C<3>,2|O<1>}	S(C[6]C[6]S[6])(C[6a]C[6a]2)	127.6410	0.000	1	127.6410	0.000	1	127.6410	0.000	1	127.6410	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:3:	3:3:	C[5,6]-4:C[6]-3:S-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6a]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(SC[6a])	C[6](C[6]C[5,6]O)(C[6]C[5,6]S)(CC[6a]O)	S(C[6]C[5,6]C[6])(C[6a]C[6a]2)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(SC[6a]){1|O<1>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]O)(C[6]C[5,6]S)(CC[6a]O){2|H<1>,3|C<4>}	S(C[6]C[5,6]C[6])(C[6a]C[6a]2)	121.9450	0.000	1	121.9450	0.000	1	121.9450	0.000	1	121.9450	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:3:	3:4:	C[6]-4:C[6]-3:S-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C-4:	C[6](C[6]C[6]CH)(C[6]C[6]C)(SC)	C[6](C[6]C[6]O)(C[6]C[6]S)(CC[6a]O)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]CH)(C[6]C[6]C)(SC){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]C[6]S)(CC[6a]O){1|C<3>,1|C<4>,3|H<1>}	S(C[6]C[6]2)(CCHH)	117.9160	0.000	1	117.9160	0.000	1	117.9160	0.000	1	117.3300	0.687	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	3:3:3:	3:4:	C[6]-4:C[6]-3:S-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C-4:	C[6](C[6]C[6]HH)(C[6]C[6]N)(SC)	C[6](C[6]C[6]O)(C[6]C[6]S)(NCH)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]HH)(C[6]C[6]N)(SC){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]O)(C[6]C[6]S)(NCH){1|C<4>,4|H<1>}	S(C[6]C[6]2)(CCHH)	116.7440	0.000	1	116.7440	0.000	1	116.7440	0.000	1	117.3300	0.687	2	120.3366	19.955	388	120.3475	19.950	389
762	762	909	0:SP2_SP2_SP2	C[6]	C[6]	S	4:3:2:	4:3:4:	3:4:	C[6]-4:C[6]-3:S-2:	C[6]-4:C[6]-3:C-4:	C[6]-3:C-4:	C[6](C[6]C[6]CC)(C[6]C[6]C)(SC)	C[6](C[6]C[6]CH)(C[6]C[6]S)(CHHO)	S(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]CC)(C[6]C[6]C)(SC){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]S)(CHHO){1|C<3>,1|H<1>,2|C<4>}	S(C[6]C[6]2)(CCHH)	120.0000	0.000	1	120.0000	0.000	1	120.0000	0.000	1	120.0000	0.000	1	120.3366	19.955	388	120.3475	19.950	389
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[4x6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6])	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,5|C<3>}	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6]){1|C<4>,2|H<1>,4|C<3>}	120.0120	0.000	1	120.0120	0.000	1	120.3060	0.173	2	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[4x6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6])	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6]){1|C<4>,2|H<1>,4|C<3>}	120.6000	0.000	1	120.6000	0.000	1	120.3060	0.173	2	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|C<4>,2|H<1>,4|C<3>}	116.5515	0.165	2	116.5515	0.027	2	116.9455	2.948	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|O<2>,2|H<1>,4|C<3>}	119.3640	0.000	1	119.3640	0.000	1	116.9455	2.948	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|S<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|S<2>,2|H<1>,4|C<3>}	115.3150	0.000	1	115.3150	0.000	1	116.9455	2.948	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,5|C<3>}	118.3552	0.250	5	118.2787	0.085	6	117.2559	2.426	9	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,5|C<3>}	117.8960	0.000	1	118.2787	0.085	6	117.2559	2.426	9	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6,6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[5,6])(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,5|C<3>}	115.2103	0.274	3	115.2103	0.075	3	117.2559	2.426	9	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[5a,6]C[5a,6a]N[5a,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|F<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[5a,6]C[5a,6a]N[5a,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,5|C<3>}	117.0020	0.000	1	117.7280	1.054	2	117.7280	1.054	2	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[5a,6]C[5a,6a]N[5a,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[5a,6]C[5a,6a]N[5a,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,5|C<3>}	118.4540	0.000	1	117.7280	1.054	2	117.7280	1.054	2	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6]){1|B<4>,1|H<1>,1|N<2>,4|C<3>}	119.3520	0.000	1	119.3520	0.000	1	119.3468	6.912	5	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6,6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[6,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])2	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[6,6])(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])2{1|B<4>,2|H<1>,4|C<3>}	116.7245	0.052	2	116.7245	0.003	2	119.3468	6.912	5	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6,6]-3:	C[6,6](N[6,6]C[6]2)(N[6]C[6,6])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[6,6]C[6])2	C[6,6](N[6,6]C[6]2)(N[6]C[6,6])(C[6]C[6]H){1|N<3>,2|C<3>,4|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[6,6]C[6])2{1|C<4>,2|H<1>,4|C<3>}	121.9665	0.409	2	121.9665	0.168	2	119.3468	6.912	5	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](N[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,2|O<1>,3|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H){1|H<1>,1|S<4>,2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6]){1|S<4>,2|H<1>,4|C<3>}	119.6500	0.000	1	119.6500	0.000	1	117.7183	1.672	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6a]N[6,6a]C[6a])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H){1|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	N[6](C[6,6a]N[6,6a]C[6a])(C[6,6]N[6,6]C[6]){1|Ge<3>,2|H<1>,4|C<3>}	117.1155	0.170	2	117.0743	0.020	3	117.7183	1.672	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6a]N[6,6a]C[6a])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	N[6](C[6,6a]N[6,6a]C[6a])(C[6,6]N[6,6]C[6]){1|Ge<3>,2|H<1>,4|C<3>}	116.9920	0.000	1	117.0743	0.020	3	117.7183	1.672	4	117.9523	3.667	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:O-2:	C[5a,6]-3:C[6,6]-3:	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]O)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OC)	N[6](C[5a,6]N[5a,6]C[5a])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]O){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OC){1|B<4>,1|H<1>,2|C<3>}	N[6](C[5a,6]N[5a,6]C[5a])(C[6,6]N[6,6]C[6]){1|B<4>,1|O<2>,5|C<3>}	117.9720	0.566	2	117.9720	0.320	2	117.9720	0.320	2	117.9720	0.320	2	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:2:3:	3:4:3:	3:3:	N[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-4:C-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](N[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]C)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]HH)(CC[5a]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])	C[6,6](N[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]C){1|C<4>,1|S<1>,2|C<3>,4|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]HH)(CC[5a]H){1|C<4>,2|C<3>,2|H<1>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6]){1|H<1>,2|C<4>,4|C<3>}	117.4750	0.000	1	117.4750	0.000	1	117.4750	0.000	1	117.4750	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:2:2:	3:2:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-2:N-2:	C[6,6]-3:C[6]-2:	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC)	N[6](C[6,6]C[6,6]C[6])(C[6]C[6])	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6]){2|C<2>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC){3|C<2>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]){1|N<2>,3|C<2>}	118.1900	0.371	2	118.1900	0.137	2	118.1900	0.137	2	118.1900	0.137	2	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:2:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:O[6]-2:	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]C[6,6]C[6])(O[6]C[5,6])	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6]){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	N[6](C[6,6]C[6,6]C[6])(O[6]C[5,6]){1|H<1>,2|C<3>,3|C<4>}	114.6710	0.000	1	114.6710	0.000	1	114.6710	0.000	1	114.6710	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6a]-3:C[6,6]-3:O-1:	C[6,6]-3:N[6]-3:	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(N[6]N[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6])(O)	N[6](C[6,6]C[6,6]C[6])(N[6]C[6,6]C[6a])	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(N[6]N[6]){1|O<1>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6])(O){1|H<1>,1|N<3>,4|C<3>}	N[6](C[6,6]C[6,6]C[6])(N[6]C[6,6]C[6a]){1|N<2>,1|O<1>,5|C<3>}	111.8850	0.000	1	111.8850	0.000	1	111.8850	0.000	1	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[3x6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[3x6]C[6])(C[6]C[6]N[6])	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[3x6]C[6])(C[6]C[6]N[6]){1|B<4>,2|C<3>,2|C<4>,3|H<1>}	119.5040	0.065	2	119.5040	0.004	2	120.4500	0.780	8	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[3x6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[3x6]C[6])(C[6]C[6a]N[6])	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,2|N<3>,3|C<3>}	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[3x6]C[6])(C[6]C[6a]N[6]){1|B<4>,2|H<1>,4|C<3>}	119.7605	0.098	2	119.7605	0.010	2	120.4500	0.780	8	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[3x6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[3x6]C[6])(C[6]C[6a]O[6])	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|F<1>,1|H<1>,1|N<2>,2|C<3>,2|O<2>}	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[3x6]C[6])(C[6]C[6a]O[6]){1|B<4>,1|H<1>,4|C<3>}	121.2678	0.102	4	121.2678	0.010	4	120.4500	0.780	8	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:Cl-1:	C[6,6]-3:N[6]-3:	C[6,6](N[6,6]C[6]2)(C[6]C[6]Cl)(N[6]N[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(Cl)	N[6](C[6,6]N[6,6]C[6])(N[6]C[6]H)	C[6,6](N[6,6]C[6]2)(C[6]C[6]Cl)(N[6]N[6]){1|C<3>,1|C<4>,1|N<2>,3|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(Cl){1|H<1>,1|N<3>,2|C<3>}	N[6](C[6,6]N[6,6]C[6])(N[6]C[6]H){1|Cl<1>,1|C<4>,1|H<1>,3|C<3>}	121.1870	0.000	1	121.1870	0.000	1	121.1870	0.000	1	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[5a]O[6])	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[5a]O[6]){1|B<4>,1|H<1>,1|O<2>,3|C<3>}	118.9680	0.000	1	119.1240	0.085	3	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[5a]O[6])	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[5a]O[6]){1|B<4>,1|H<1>,4|C<3>}	119.2020	0.366	2	119.1240	0.085	3	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|F<1>,2|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6]){1|B<4>,1|H<1>,4|C<3>}	119.0310	0.618	2	119.0310	0.382	2	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6]){1|B<4>,1|H<1>,5|C<3>}	115.8400	0.000	1	115.8400	0.000	1	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,1|O<2>,2|C<3>,2|F<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6]){1|B<4>,1|H<1>,4|C<3>}	116.7915	0.423	4	116.7915	0.179	4	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C){1|B<4>,1|H<1>,2|C<3>}	116.5953	0.219	3	116.8830	0.530	6	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|F<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C){1|B<4>,1|H<1>,2|C<3>}	117.7560	0.000	2	116.8830	0.530	6	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|O<2>,2|F<1>,3|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	N[6](C[6,6]N[6,6]C[6])(C[6]O[6]C){1|B<4>,1|H<1>,2|C<3>}	116.0000	0.000	1	116.8830	0.530	6	117.4836	1.559	16	118.3235	5.038	26	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:4:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H)	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H){1|C<3>,2|C<4>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO){1|C<4>,2|C<3>,3|H<1>}	114.0040	0.000	1	114.0040	0.000	1	114.0040	0.000	1	117.7317	11.529	3	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:4:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]HH)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|N<2>,5|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]HH){1|C<4>,2|C<3>,3|H<1>}	118.5430	0.000	1	118.5430	0.000	1	119.5955	2.216	2	117.7317	11.529	3	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:1:	3:4:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]CC)	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]CC){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	120.6480	0.000	1	120.6480	0.000	1	119.5955	2.216	2	117.7317	11.529	3	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:3:	3:4:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:C-3:	C[6,6]-3:C[6]-4:	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]C)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(CC[6a]O)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]HH)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]C)(N[6]C[6]){1|C<3>,1|C<4>,1|N<2>,5|H<1>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(CC[6a]O){2|C<3>,2|C<4>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6]HH){1|C<4>,2|H<1>,3|C<3>}	118.2370	0.000	1	118.2370	0.000	1	118.2370	0.000	1	118.2370	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	3:3:2:	3:3:4:	3:3:	N[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:N[6]-3:C-4:	C[6,6]-3:C[6]-3:	C[6,6](N[6,6]C[5,6,6]C[6])(C[6]N[6]C)(N[6]C[6])	C[6](C[6,6]N[6,6]N[6])(N[6]C[6]H)(CCCH)	N[6](C[6,6]N[6,6]C[6])(C[6]C[6,6]O)	C[6,6](N[6,6]C[5,6,6]C[6])(C[6]N[6]C)(N[6]C[6]){1|C<3>,2|C<4>,2|H<1>,3|O<2>}	C[6](C[6,6]N[6,6]N[6])(N[6]C[6]H)(CCCH){1|C<3>,1|O<1>,2|C<4>}	N[6](C[6,6]N[6,6]C[6])(C[6]C[6,6]O){1|C<3>,1|N<3>,1|O<2>,3|C<4>}	120.0720	0.000	1	120.0720	0.000	1	120.0720	0.000	1	120.0720	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	4:2:3:	3:3:2:	3:3:	C[6,6]-4:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:S-2:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]N[6]O[6]H)(N[6]C[6,6a])(C[6]C[6]S)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]S)(SMo)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]N[6]O[6]H)(N[6]C[6,6a])(C[6]C[6]S){1|C<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]S)(SMo){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,1|S<2>,2|N<3>}	122.5605	0.704	2	122.5605	0.495	2	122.5605	0.495	2	122.5605	0.495	2	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	4:3:2:	3:3:1:	3:3:	C[6,6]-4:C[6]-3:N[6]-2:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6]H)(N[6]C[6,6a])	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6]H)(N[6]C[6,6a]){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H){2|C<4>,3|C<3>,3|O<2>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|C<4>,2|H<1>,2|O<2>,3|C<3>}	119.7650	0.000	1	119.7650	0.000	1	119.7650	0.000	1	119.7650	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6,6]	C[6]	N[6]	4:3:2:	3:3:1:	3:4:	C[3x6]-4:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(N[6]C[6])	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H)	N[6](C[6,6]C[3x6]C[6])(C[6]N[6,6]HH)	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(N[6]C[6]){1|N<3>,3|C<3>,7|H<1>}	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,3|C<4>}	N[6](C[6,6]C[3x6]C[6])(C[6]N[6,6]HH){1|H<1>,2|C<4>,3|C<3>}	118.0140	0.000	1	118.0140	0.000	1	118.0140	0.000	1	118.0140	0.000	1	118.2395	4.565	67	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:3:	3:3:	N[6]-2:N[6]-3:C[6]-3:	N[6]-2:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]Co)(C[6]N[6]2)	C[6](N[6]C[6,6a])(N[6]C[6]Co)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(N[6]C[6]Co)(C[6]N[6]2){1|N<2>,4|C<3>}	C[6](N[6]C[6,6a])(N[6]C[6]Co)(C[6]N[6]2){1|N<2>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|Co<5>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	119.2160	0.072	2	119.2160	0.005	2	119.1803	0.068	8	119.1803	0.068	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:3:	3:3:	N[6]-2:N[6]-3:C[6]-3:	N[6]-2:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]Fe)(C[6]N[6]2)	C[6](N[6]C[6,6a])(N[6]C[6]Fe)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(N[6]C[6]Fe)(C[6]N[6]2){1|N<2>,4|C<3>}	C[6](N[6]C[6,6a])(N[6]C[6]Fe)(C[6]N[6]2){1|N<2>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|Fe<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	119.2400	0.403	2	119.2400	0.162	2	119.1803	0.068	8	119.1803	0.068	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:3:	3:3:	N[6]-2:N[6]-3:C[6]-3:	N[6]-2:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(N[6]C[6]Ni)(C[6]N[6]2)	C[6](N[6]C[6,6a])(N[6]C[6]Ni)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(N[6]C[6]Ni)(C[6]N[6]2){1|N<2>,4|C<3>}	C[6](N[6]C[6,6a])(N[6]C[6]Ni)(C[6]N[6]2){1|N<2>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|Ni<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	119.1325	0.309	4	119.1325	0.095	4	119.1803	0.068	8	119.1803	0.068	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(N[6]S[6])	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6])(N[6]S[6]){1|Br<1>,1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){1|S<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])2{1|S<3>,2|C<3>,2|N<3>}	116.4365	0.282	2	116.4365	0.080	2	116.3995	0.394	4	115.8074	0.954	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])2	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6])2{1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])2{1|Ni<6>,2|N<3>,3|C<3>}	116.3625	1.047	2	116.3625	1.097	2	116.3995	0.394	4	115.8074	0.954	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:S[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(N[6]S[6])	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	N[6](C[6]C[6]N[6])(S[6]N[6]Br)	C[6](C[6]C[6]N[6])(N[6]C[6])(N[6]S[6]){1|Br<1>,1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){1|S<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])(S[6]N[6]Br){1|N<3>,2|C<3>}	115.2965	0.736	2	115.2965	0.542	2	115.2965	0.542	2	115.8074	0.954	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-2:	N[6,6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]N[6,6]C[6])(N[6]C[6,6a])(N[6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](C[6]N[6,6]C[6])(N[6]C[6,6a])(N[6]C[6]){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2){1|C<4>,3|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|H<1>,1|N<3>,4|C<3>}	114.1040	0.000	1	114.1040	0.000	1	114.1040	0.000	1	115.8074	0.954	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-2:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6,6]C[6])(N[6]C[6,6a])(N[6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6,6a]O)(C[6]C[6]N[6])	C[6](C[6]N[6,6]C[6])(N[6]C[6,6a])(N[6]C[6]){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2){1|C<4>,3|H<1>,4|C<3>}	N[6](C[6]C[6,6a]O)(C[6]C[6]N[6]){1|N<3>,3|C<3>}	116.1640	0.000	1	116.1640	0.000	1	116.1640	0.000	1	115.8074	0.954	8	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a]H)(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a]H)(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){2|H<1>,2|N<3>,3|C<3>}	117.5840	0.000	1	117.5840	0.000	1	117.5840	0.000	1	118.5130	0.673	3	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-3:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(N[6]C[6]Co)	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(N[6]C[6]Co){1|H<1>,5|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|Co<6>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	118.8170	0.000	1	118.8170	0.000	1	118.9775	0.052	2	118.5130	0.673	3	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N[6]-3:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(N[6]C[6]Zn)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(N[6]C[6]Zn){1|H<1>,5|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6]){1|Zn<4>,1|H<1>,1|N<3>,4|C<3>}	119.1380	0.000	1	119.1380	0.000	1	118.9775	0.052	2	118.5130	0.673	3	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cd)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Cd)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Cd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	117.3485	0.231	4	117.3485	0.053	4	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Cu)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	117.8035	0.332	2	117.8035	0.110	2	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Eu)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Eu)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Eu)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Eu)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Eu<9>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	116.0970	0.287	4	116.0970	0.082	4	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Fe)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Fe)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.7758	0.601	14	119.7758	0.361	14	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Mn)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	117.7943	0.806	27	117.7943	0.649	27	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ni<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.4463	0.308	4	119.1665	0.176	8	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	118.8868	0.328	4	119.1665	0.176	8	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	118.5472	0.647	12	118.4643	0.423	14	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	117.9670	0.564	2	118.4643	0.423	14	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.5163	0.984	18	119.4502	0.920	20	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	118.8545	0.480	2	119.4502	0.920	20	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Re)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Re)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.4764	0.985	18	119.4764	0.970	18	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.6810	0.973	2	119.6810	0.947	2	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ti)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Ti)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](N[6]C[6]Ti)(C[6]N[6]2)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Ti)(C[6]N[6]2)(N[6]C[6]){1|H<1>,4|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ti<10>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.2160	0.976	2	119.2160	0.952	2	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Zn)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Zn)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	117.7855	1.283	2	117.7855	1.647	2	118.7305	1.460	117	118.7305	1.460	117	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:2:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-2:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]N[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])(N[6]C[6]){1|Cu<4>,1|N<3>,3|C<3>}	117.3950	0.000	1	117.3950	0.000	1	117.6958	3.664	4	118.2098	2.833	6	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:2:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-2:	C[6](C[6]C[6]N[6])(N[6]N[6]Ag)(N[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Ag)(N[6]N[6]){1|Ag<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	N[6](C[6]C[6]N[6])(N[6]C[6]){1|Ag<6>,2|C<3>,2|N<3>}	116.4610	0.423	2	116.4610	0.179	2	117.6958	3.664	4	118.2098	2.833	6	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:2:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-2:	C[6](C[6]C[6]N[6])(N[6]N[6]Re)(N[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Re)(N[6]N[6]){1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<2>}	N[6](C[6]C[6]N[6])(N[6]C[6]){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	120.4660	0.000	1	120.4660	0.000	1	117.6958	3.664	4	118.2098	2.833	6	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:2:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:S[6]-2:	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]S[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(S[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]S[6]){1|H<1>,1|N<2>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|S<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])(S[6]N[6]){1|Fe<5>,1|N<3>,2|C<3>}	119.2380	0.052	2	119.2380	0.003	2	119.2380	0.003	2	118.2098	2.833	6	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6,6a])	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])2(N[6]C[6,6a]){2|Cu<4>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){1|H<1>,2|N<3>,4|C<3>}	111.8090	0.165	2	111.8090	0.027	2	111.8090	0.027	2	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]N[6])2(N[6]C[6]){2|Ag<5>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	113.2240	0.000	1	113.2240	0.000	1	113.5950	0.175	3	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]N[6])2(N[6]C[6]){2|Cu<4>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	113.7805	0.380	2	113.7805	0.144	2	113.5950	0.175	3	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(N[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	N[6](N[6]C[6]Pt)(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(N[6]N[6]){2|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[6](N[6]C[6]Pt)(C[6]C[6]2){1|C<4>,1|N<3>,3|C<3>}	112.6013	0.981	3	112.6013	0.963	3	112.6013	0.963	3	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	N[5,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	N[6](C[6]C[6]2)(C[6]N[6]H)	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6]){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	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[6](C[6]C[6]2)(C[6]N[6]H){1|Br<1>,1|Zn<4>,1|N<3>,2|C<3>}	113.8590	0.000	1	113.8590	0.000	1	113.8590	0.000	1	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]H)(N[6]N[6])	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]H)(N[6]N[6]){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){1|C<3>,2|N<3>,3|H<1>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	118.1310	0.000	1	118.1310	0.000	1	118.1310	0.000	1	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6,6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pu)(N[6]C[6,6])	C[6](N[6]C[6,6a]Pu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Pu)(N[6]C[6,6]){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6,6a]Pu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]N[6]){1|Pu<11>,1|C<3>,1|N<2>,1|N<3>,4|C<4>}	117.5595	0.302	4	117.5595	0.091	4	117.5595	0.091	4	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(N[6]C[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(N[6]C[6]){1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Cd<5>,1|N<3>,2|C<3>}	119.3790	0.832	2	119.3790	0.691	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(N[6]C[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Cd<5>,1|N<2>,1|N<3>,3|C<3>}	119.9710	0.191	2	119.9710	0.036	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Co<6>,1|N<3>,2|C<3>}	117.3310	0.000	1	116.8030	0.558	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Co<6>,1|N<3>,2|C<3>}	116.2750	0.000	1	116.8030	0.558	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6]){1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])2{2|Co<6>,2|N<3>,3|C<3>}	116.7802	0.469	11	116.7349	0.350	23	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6]){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])2{2|Co<6>,2|N<3>,3|C<3>}	116.6933	0.705	12	116.7349	0.350	23	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Co<6>,1|N<2>,1|N<3>,3|C<3>}	121.7108	0.877	6	121.7108	0.769	6	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	117.9415	0.728	2	117.9415	0.529	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	117.3690	0.547	2	117.3690	0.300	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Cu<5>,1|N<3>,2|C<3>}	117.3361	0.482	10	117.3361	0.232	10	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Cu<4>,1|N<2>,1|N<3>,3|C<3>}	117.0220	0.000	1	117.0220	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(N[6]C[6]){1|C<3>,1|H<1>,2|N<2>,2|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Cu<5>,1|N<3>,2|C<3>}	117.6630	0.030	2	117.6630	0.001	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(N[6]C[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Eu<13>,1|N<2>,1|N<3>,3|C<3>}	117.4190	1.121	2	117.6005	0.508	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(N[6]C[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Eu<8>,1|N<2>,1|N<3>,3|C<3>}	117.7820	0.366	2	117.6005	0.508	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6]){1|H<1>,2|C<4>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	115.8210	0.000	1	115.8210	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Fe<6>,1|N<3>,2|C<3>}	118.1030	0.404	3	118.1030	0.163	3	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	121.2305	0.838	2	123.6490	4.116	6	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Fe<6>,1|N<3>,4|C<3>}	124.8582	0.881	4	123.6490	4.116	6	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(N[6]C[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Ir<6>,1|N<3>,4|C<3>}	115.8435	2.638	2	115.8435	6.960	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(N[6]C[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Li<5>,1|N<2>,1|N<3>,3|C<3>}	118.8430	0.000	1	118.8430	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Mn<6>,1|N<3>,2|C<3>}	116.1840	0.000	1	116.1840	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Mn<5>,1|N<2>,1|N<3>,3|C<3>}	120.7442	0.846	6	120.2248	0.772	18	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Mn<6>,1|N<2>,1|N<3>,3|C<3>}	120.3829	0.627	8	120.2248	0.772	18	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Mn<8>,1|N<2>,1|N<3>,3|C<3>}	119.1298	0.240	4	120.2248	0.772	18	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Ni<6>,1|N<3>,2|C<3>}	117.1110	0.294	2	116.7490	0.436	3	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Ni<6>,1|N<3>,2|C<3>}	116.0250	0.000	1	116.7490	0.436	3	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])2{1|Ni<6>,2|N<3>,3|C<3>}	122.5495	0.012	2	122.5495	0.000	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Ni<6>,1|N<2>,1|N<3>,3|C<3>}	122.4337	0.594	22	122.4337	0.353	22	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(N[6]C[6]){1|C<3>,1|H<1>,2|N<2>,2|N<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Ni<6>,1|N<3>,2|C<3>}	117.3465	0.530	2	117.3465	0.281	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(N[6]C[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Pd<4>,1|N<3>,2|C<3>}	117.4340	0.000	1	117.4340	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6]){1|H<1>,1|N<2>,1|N<3>,1|N<4>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Re<6>,1|N<3>,2|C<3>}	117.8210	0.000	1	117.8210	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])2	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6]){1|H<1>,1|N<3>,1|O<2>,4|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){1|C<4>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])2{2|Re<6>,1|C<4>,2|C<3>,2|N<3>}	115.1503	0.764	6	115.1503	0.584	6	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Re<6>,1|N<2>,1|N<3>,3|C<3>}	118.0265	1.234	2	118.0265	1.523	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	119.2505	0.189	2	119.1358	0.124	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6]){2|H<1>,4|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	119.0210	0.532	2	119.1358	0.124	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6]){3|C<3>,3|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cl<1>,1|Ru<6>,1|N<3>,2|C<3>}	118.9380	0.260	2	118.9380	0.068	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6]){1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Ru<6>,1|N<3>,2|C<3>}	124.1040	0.451	2	124.1040	0.204	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Ru<6>,1|N<3>,4|C<3>}	124.3637	0.485	10	124.3637	0.235	10	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(N[6]C[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Sm<13>,1|N<2>,1|N<3>,3|C<3>}	117.7530	0.450	2	117.7530	0.202	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(N[6]C[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(N[6]C[6]){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|Zn<6>,1|N<3>,2|C<3>}	116.2050	0.000	1	116.2050	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(N[6]C[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(N[6]C[6]){1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]N[6]){1|Zn<6>,1|N<2>,1|N<3>,3|C<3>}	120.5160	0.262	2	120.5160	0.068	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]C[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Cu<5>,1|N<2>,1|N<3>,4|C<3>}	119.5790	0.000	1	119.5790	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]C[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Cu<4>,1|N<2>,1|N<3>,4|C<3>}	119.0137	0.402	3	119.0137	0.161	3	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Eu)(N[6]C[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Eu)(N[6]C[6]){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Eu<13>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	117.3620	0.231	2	117.3620	0.053	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Mn)(N[6]C[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Mn)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Mn<6>,1|N<2>,1|N<3>,4|C<3>}	117.6430	0.359	2	117.6430	0.129	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Mo)(N[6]C[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Mo)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Mo<9>,1|N<2>,1|N<3>,4|C<3>}	119.9350	0.000	1	119.9350	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Ni)(N[6]C[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Ni)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Ni<6>,1|N<2>,1|N<3>,4|C<3>}	118.5637	0.944	4	118.5637	0.892	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]C[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]C[6]){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pd<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	120.0710	1.670	4	120.0710	2.789	4	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6]){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pt<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	120.1290	0.000	1	120.1290	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Pt<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	119.4970	0.000	1	120.2525	1.142	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]C[6]){1|H<1>,4|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Pt<4>,1|N<2>,1|N<3>,4|C<3>}	121.0080	0.000	1	120.2525	1.142	2	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(N[6]C[6]){1|H<1>,1|N<2>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Ru<6>,1|N<2>,1|N<3>,4|C<3>}	121.5360	0.000	1	121.5360	0.000	1	119.4448	7.391	171	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6]){1|H<1>,2|C<4>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Cu<4>,1|C<3>,1|O<1>,2|N<3>}	116.0830	0.000	1	116.9823	1.515	3	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6]){1|H<1>,2|C<4>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Cu<4>,1|C<3>,1|O<1>,2|N<3>}	117.4320	1.348	2	116.9823	1.515	3	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]Cu)	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(N[6]N[6]){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	N[6](C[6]C[6]N[6])(N[6]C[6]Cu){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	117.3090	0.000	1	117.3090	0.000	1	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Fe)(N[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Fe)(N[6]N[6]){1|C<4>,1|H<1>,4|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Fe<6>,1|C<3>,1|O<1>,2|N<3>}	122.3170	2.328	3	122.3170	5.418	3	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6]){1|C<4>,1|H<1>,4|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Pd<4>,1|C<3>,1|O<1>,2|N<3>}	123.0390	0.451	2	119.7880	7.047	6	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6]){1|H<1>,2|C<4>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Pd<4>,1|C<3>,1|O<1>,2|N<3>}	118.1625	1.053	4	119.7880	7.047	6	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	N[6](C[6]C[6]N[6])(N[6]C[6]C)	C[6](C[6]C[6]N[6])(N[6]N[6]Pt)(N[6]N[6]){1|H<1>,2|C<4>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](C[6]C[6]N[6])(N[6]C[6]C){1|Pt<4>,1|C<3>,1|O<1>,2|N<3>}	119.0200	0.000	1	119.0200	0.000	1	119.4968	7.496	14	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	N[6](N[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]N[6]Pd)(N[6]N[6]){1|C<4>,1|H<1>,4|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	N[6](N[6]C[6a]C[6])(C[6]C[6]N[6]){1|Pd<4>,2|H<1>,2|N<3>,3|C<3>}	117.7510	0.000	1	117.7510	0.000	1	117.7510	0.000	1	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	0:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]C)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|C<3>,2|C<4>,2|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]C){1|O<2>,2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	121.6100	0.000	1	121.6100	0.000	1	121.6100	0.000	1	119.1135	8.745	201	118.8862	5.947	343	118.7806	5.767	410
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[4x6]	N[6]	3:2:3:	4:3:3:	3:3:	C[4x6]-3:N[6]-2:C[6]-3:	C[4x6]-4:C[3x6]-3:C[6,6]-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	C[4x6](C[4x6]C[6,6,6a]C[6,6a]C[6,6])(C[3x6]C[3x6]C[6])(C[6,6]C[6]N[6])	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6])	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,5|C<3>}	C[4x6](C[4x6]C[6,6,6a]C[6,6a]C[6,6])(C[3x6]C[3x6]C[6])(C[6,6]C[6]N[6]){1|O<1>,3|H<1>,6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6]){1|C<4>,2|H<1>,4|C<3>}	123.8290	0.000	1	123.5480	0.158	2	123.5480	0.158	2	123.5480	0.158	2	123.5480	0.158	2	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[4x6]	N[6]	3:2:3:	4:3:3:	3:3:	C[4x6]-3:N[6]-2:C[6]-3:	C[4x6]-4:C[3x6]-3:C[6,6]-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	C[4x6](C[4x6]C[6,6,6a]C[6,6a]C[6,6])(C[3x6]C[3x6]C[6])(C[6,6]C[6]N[6])	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6])	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,5|C<3>}	C[4x6](C[4x6]C[6,6,6a]C[6,6a]C[6,6])(C[3x6]C[3x6]C[6])(C[6,6]C[6]N[6]){1|O<1>,3|H<1>,6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[4x6]C[6]){1|C<4>,2|H<1>,4|C<3>}	123.2670	0.000	1	123.5480	0.158	2	123.5480	0.158	2	123.5480	0.158	2	123.5480	0.158	2	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C[6]-2:	C[6,6]-3:N[6]-3:C[6]-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a])(C[6]C[6])	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a])(C[6]C[6]){3|C<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H){1|H<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|H<1>,1|N<3>,4|C<3>}	121.5350	0.000	1	121.5350	0.000	1	121.5350	0.000	1	121.5350	0.000	1	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:O[6]-2:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(O[6]C[6,6a])	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(O[6]C[6,6a]){1|H<1>,1|N<3>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|O<2>,2|H<1>,4|C<3>}	124.4050	0.000	1	124.4050	0.000	1	124.4050	0.000	1	126.2075	6.498	2	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-3:S[6]-2:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(S[6]C[6,6a])	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(S[6]C[6,6a]){1|H<1>,1|N<3>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|S<2>,2|H<1>,4|C<3>}	128.0100	0.000	1	128.0100	0.000	1	128.0100	0.000	1	126.2075	6.498	2	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:2:3:	3:4:3:	3:3:	C[6,6]-3:N[6]-2:C[6]-3:	C[6,6]-3:C[6]-4:C[6]-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CC)(C[6]C[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CC)(C[6]C[6]H){1|H<1>,1|O<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){1|C<4>,2|H<1>,4|C<3>}	124.4120	0.089	2	124.4120	0.008	2	124.4120	0.008	2	124.4120	0.008	2	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:2:4:	4:3:3:	3:3:	C[6,6]-3:N[6]-2:C[6]-4:	C[6]-4:C[6,6]-3:C[6]-3:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]HH)	C[6,6](C[6]C[6,6a]C[6a]H)(C[6,6]C[6]N[6])(C[6]C[6]O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]HH){1|H<1>,1|O<1>,3|C<3>,3|C<4>}	C[6,6](C[6]C[6,6a]C[6a]H)(C[6,6]C[6]N[6])(C[6]C[6]O){1|C<4>,4|C<3>,4|H<1>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]){2|C<4>,3|C<3>,3|H<1>}	122.0360	0.000	1	122.0360	0.000	1	122.0360	0.000	1	122.0360	0.000	1	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:2:2:	3:2:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-2:C[6]-2:	C[6,6]-3:C[6]-2:	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6])2	N[6](C[6,6]C[6,6]C[6])(C[6]C[6])	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6]){2|C<2>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6])2{1|N<2>,2|C<2>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]){1|N<2>,3|C<2>}	122.3140	0.528	3	122.3140	0.279	3	122.3140	0.279	3	122.3140	0.279	3	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:2:	3:3:	C[5,6]-3:C[6,6]-3:N[6]-2:	C[6,6]-3:N[6]-3:O[6]-2:	C[6,6]-3:N[6]-3:	C[6,6](C[5,6]N[5,6]S[5])(C[6,6]N[6]O[6])(N[6]N[6])	C[6,6](C[6,6]C[5,6]N[6])(N[6]B[6]H)(O[6]B[6])	N[6](C[6,6]C[5,6]C[6,6])(N[6]C[6a]B[6])	C[6,6](C[5,6]N[5,6]S[5])(C[6,6]N[6]O[6])(N[6]N[6]){1|H<1>,2|B<4>,3|C<3>}	C[6,6](C[6,6]C[5,6]N[6])(N[6]B[6]H)(O[6]B[6]){1|S<2>,2|N<3>,4|F<1>}	N[6](C[6,6]C[5,6]C[6,6])(N[6]C[6a]B[6]){1|O<2>,1|S<2>,2|C<3>,2|F<1>,2|N<3>}	124.6665	0.330	2	124.6665	0.109	2	124.6665	0.109	2	124.4822	4.508	6	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6,6]-3:S[6]-2:	C[6,6]-3:C[6]-3:	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6])	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]N[6])	N[6](C[6,6]C[6,6]N[6])(C[6]C[5a]N[6])	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6]){1|H<1>,2|C<3>,2|N<2>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]N[6]){1|C<4>,1|S<2>,2|C<3>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[5a]N[6]){1|C<4>,2|S<2>,3|C<3>}	122.0440	0.000	2	122.0440	0.000	2	122.0440	0.000	2	124.4822	4.508	6	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6,6]-3:S[6]-2:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6,6a])	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a])	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6])	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6,6a]){1|H<1>,1|N<2>,3|C<3>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a]){1|C<4>,1|S<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6]){1|C<4>,1|H<1>,1|S<2>,4|C<3>}	126.3390	0.000	1	126.3390	0.000	1	126.7360	0.315	2	124.4822	4.508	6	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6,6]-3:S[6]-2:	C[6,6a]-3:C[6,6]-3:	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6,6a])	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a])	N[6](C[6,6a]C[6,6a]N[6a])(C[6,6]C[6,6]N[6])	C[6,6](C[6,6]C[6]S[6])(N[6]C[5a,6]C)(N[6]C[6,6a]){1|H<1>,2|C<3>,2|N<2>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a]){1|C<4>,1|N<2>,1|S<2>,2|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6,6]C[6,6]N[6]){1|C<4>,1|N<2>,1|S<2>,3|C<3>}	127.1330	0.000	1	127.1330	0.000	1	126.7360	0.315	2	124.4822	4.508	6	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6,6]-3:C[6]-3:	C[6,6]-3:N[6]-3:	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(N[6]N[6])	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]N[6])(C[6]C[6,6a]O)	N[6](C[6,6]C[6,6]C[6])(N[6]C[6,6]C[6a])	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(N[6]N[6]){1|O<1>,5|C<3>}	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]N[6])(C[6]C[6,6a]O){1|N<3>,2|O<1>,4|C<3>}	N[6](C[6,6]C[6,6]C[6])(N[6]C[6,6]C[6a]){1|N<2>,1|O<1>,5|C<3>}	125.8010	0.000	1	125.8010	0.000	1	125.8010	0.000	1	122.8432	2.974	9	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6,6]-3:C[6]-3:C[6]-3:	C[6,6]-3:C[6]-3:	C[6,6](C[6,6]C[6]2)(N[6]C[6]Ru)(N[6]C[6])	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]O)	C[6,6](C[6,6]C[6]2)(N[6]C[6]Ru)(N[6]C[6]){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Ru<6>,2|C<3>,2|H<1>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]O){1|Ru<6>,1|H<1>,3|C<3>}	121.8473	0.359	4	121.8473	0.129	4	121.8473	0.129	4	122.8432	2.974	9	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6,6]-3:N[6]-3:C[6]-3:	C[6,6]-3:C[6]-3:	C[6,6](C[6,6]C[6]N[6])(N[6]C[6]C)(N[6]C[6])	C[6,6](C[6,6]N[6]2)(N[6]C[6]Co)(C[6]N[6]O)	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C)	C[6,6](C[6,6]C[6]N[6])(N[6]C[6]C)(N[6]C[6]){1|Co<6>,1|C<3>,1|C<4>,1|N<3>,1|O<1>,1|O<2>}	C[6,6](C[6,6]N[6]2)(N[6]C[6]Co)(C[6]N[6]O){1|H<1>,2|C<3>,2|C<4>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C){1|N<3>,2|C<3>,2|C<4>}	121.4600	0.000	1	121.4600	0.000	1	122.2057	0.418	3	122.8432	2.974	9	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-3:N[6]-2:	C[6,6]-3:N[6]-3:C[6]-3:	C[6,6]-3:C[6]-3:	C[6,6](C[6,6]C[6]N[6])(N[6]C[6]C)(N[6]C[6])	C[6,6](C[6,6]N[6]2)(N[6]C[6]Cu)(C[6]N[6]O)	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)	C[6,6](C[6,6]C[6]N[6])(N[6]C[6]C)(N[6]C[6]){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>}	C[6,6](C[6,6]N[6]2)(N[6]C[6]Cu)(C[6]N[6]O){1|H<1>,2|C<3>,2|C<4>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.5785	0.035	2	122.5785	0.001	2	122.2057	0.418	3	122.8432	2.974	9	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	N[6]-3:C[6,6]-3:N[6]-2:	C[6,6]-3:C[6]-3:C[6]-3:	C[6,6]-3:C[6]-3:	C[6,6](N[6]C[5]C[6])(C[6,6]C[6]2)(N[6]C[6])	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O)	N[6](C[6,6]C[6,6]N[6])(C[6]N[6]O)	C[6,6](N[6]C[5]C[6])(C[6,6]C[6]2)(N[6]C[6]){1|C<4>,1|N<3>,1|O<2>,2|H<1>,2|N<2>,2|O<1>}	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O){1|C<4>,2|C<3>}	N[6](C[6,6]C[6,6]N[6])(C[6]N[6]O){1|C<4>,3|C<3>}	125.7820	0.000	1	125.7820	0.000	1	125.7820	0.000	1	122.8432	2.974	9	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:4:3:	3:4:	C[6,6]-3:C[6]-3:N[6]-2:	C[6,6]-3:C[6]-4:C[6]-3:	C[6,6]-3:C[6]-4:	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CH)(C[6]N[6]O)	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CH)(C[6]N[6]O){1|C<3>,1|C<4>,3|H<1>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO){1|C<4>,2|C<3>,3|H<1>}	124.2520	0.000	1	124.2520	0.000	1	124.2520	0.000	1	124.2520	0.000	1	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	3:4:4:	3:3:	C[6,6a]-3:C[6,6]-3:N[6]-2:	C[6,6]-3:C[6]-4:C[6]-4:	C[6,6]-3:C[5,6]-3:	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(N[6]C[5,6])	C[6,6](C[6,6]C[6,6a]N[6])(C[6]N[5,6]HH)(C[6]C[6]HH)	N[6](C[6,6]C[6,6a]C[6,6])(C[5,6]N[5,6]S[5])	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(N[6]C[5,6]){1|C<4>,1|N<3>,1|S<2>,2|C<3>,5|H<1>}	C[6,6](C[6,6]C[6,6a]N[6])(C[6]N[5,6]HH)(C[6]C[6]HH){2|H<1>,4|C<3>}	N[6](C[6,6]C[6,6a]C[6,6])(C[5,6]N[5,6]S[5]){2|C<4>,4|C<3>}	123.5665	0.238	2	123.5665	0.057	2	123.5665	0.057	2	123.5665	0.057	2	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:3:2:	4:3:3:	3:2:	C[6,6]-3:C[6]-3:N[6]-2:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:O[6]-2:	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6])	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]N[6])(C[6]C[6]H)	N[6](C[6,6]C[6,6]C[6])(O[6]C[5,6])	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6]){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]N[6])(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	N[6](C[6,6]C[6,6]C[6])(O[6]C[5,6]){1|H<1>,2|C<3>,3|C<4>}	125.6740	0.000	1	125.6740	0.000	1	125.6740	0.000	1	125.6740	0.000	1	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:4:2:	3:4:2:	3:3:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-3:C[6]-3:	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]C[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]N[6])	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]N[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]C[6]){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]N[6]){1|Pu<11>,1|C<3>,2|H<1>,3|C<4>}	N[6](C[6,6]C[6,6]C[6])(C[6]C[6]N[6]){1|Pu<11>,1|C<3>,1|N<2>,1|N<3>,4|C<4>}	119.5168	0.496	4	119.5168	0.246	4	119.5168	0.246	4	120.1286	0.727	8	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:4:2:	3:4:2:	3:3:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-3:N[6]-3:	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]N[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]C[6])	N[6](C[6,6]C[6,6]C[6])(N[6]C[6]Pu)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]N[6]){1|Pu<11>,1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CC)(N[6]C[6]){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	N[6](C[6,6]C[6,6]C[6])(N[6]C[6]Pu){1|C<3>,1|N<2>,4|C<4>}	120.7405	0.673	4	120.7405	0.452	4	120.7405	0.452	4	120.1286	0.727	8	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6,6]	C[6,6]	N[6]	3:4:2:	3:4:2:	4:3:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-3:C[6]-4:N[6]-2:	C[6,6]-4:C[6,6]-3:	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]MoH)(N[6]C[6,6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]MoH)(N[6]C[6,6])	N[6](C[6,6]C[6,6]C[6]Mo)(C[6,6]C[6,6]C[6])	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]MoH)(N[6]C[6,6]){1|Mo<9>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]MoH)(N[6]C[6,6]){1|Mo<9>,2|H<1>,3|C<4>}	N[6](C[6,6]C[6,6]C[6]Mo)(C[6,6]C[6,6]C[6]){1|Mo<9>,1|N<2>,2|H<1>,4|C<4>}	122.8905	0.209	2	122.8905	0.044	2	122.8905	0.044	2	122.8905	0.044	2	122.8448	4.742	38	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[3x6]	N[6]	3:3:2:	3:4:3:	3:3:	C[3x6]-3:C[6a]-3:N[6]-2:	C[3x6]-3:C[3x6]-4:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[3x6]C[3x6]2)(C[6a]C[6a]2)(N[6]N[6])	C[3x6](C[3x6]C[3x6]C[6])(C[3x6]C[6,6]2H)(C[6]C[6a]N[6])	N[6](C[6]C[3x6]C[6a])(N[6]C[6]Ir)	C[6](C[3x6]C[3x6]2)(C[6a]C[6a]2)(N[6]N[6]){1|Ir<6>,3|C<3>,3|C<4>,3|H<1>}	C[3x6](C[3x6]C[3x6]C[6])(C[3x6]C[6,6]2H)(C[6]C[6a]N[6]){1|N<3>,2|C<4>,3|C<3>,5|H<1>}	N[6](C[6]C[3x6]C[6a])(N[6]C[6]Ir){1|C<4>,4|C<3>}	121.7123	0.453	3	121.7123	0.206	3	121.7123	0.206	3	121.7123	0.206	3	121.7123	0.206	3	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H){1|O<2>,2|F<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H){1|H<1>,1|N<3>,3|C<3>}	124.4740	0.144	2	124.4740	0.021	2	124.5743	0.041	3	122.9121	15.809	8	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H){1|H<1>,4|C<3>}	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H){1|H<1>,1|N<3>,3|C<3>}	124.7750	0.000	1	124.7750	0.000	1	124.5743	0.041	3	122.9121	15.809	8	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	N[6](C[6]C[6,6]H)(C[6]C[6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,2|C<3>,2|F<1>}	N[6](C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	123.8080	0.338	2	124.1128	0.234	4	124.1128	0.234	4	122.9121	15.809	8	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	N[6](C[6]C[6,6]H)(C[6]C[6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,4|C<3>}	N[6](C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	124.4175	0.466	2	124.1128	0.234	4	124.1128	0.234	4	122.9121	15.809	8	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:O-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(O)	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O)	N[6](C[6]C[6,6]O)(C[6]N[6]O)	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(O){1|O<1>,2|N<2>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O){1|C<4>,2|C<3>}	N[6](C[6]C[6,6]O)(C[6]N[6]O){2|C<3>}	113.1230	0.000	1	113.1230	0.000	1	113.1230	0.000	1	122.9121	15.809	8	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:1:	3:4:3:	3:3:	C[6,6]-3:N[6]-2:O-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(O)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CH)(C[6]N[6]O)	N[6](C[6]C[6,6]O)(C[6]C[6]C)	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(O){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]CH)(C[6]N[6]O){1|C<3>,1|C<4>,3|H<1>}	N[6](C[6]C[6,6]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|H<1>}	117.0530	0.000	1	117.0530	0.000	1	117.0530	0.000	1	117.0530	0.000	1	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-2:	N[6,6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CN)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CN){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	126.5715	0.210	2	126.5715	0.044	2	126.6567	0.044	3	126.6567	0.044	3	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-2:	N[6,6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CN)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CN){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	126.8270	0.000	1	126.8270	0.000	1	126.6567	0.044	3	126.6567	0.044	3	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-3:	C[6,6,6a]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6])(N[6]N[6])(COO)	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6,6a]C[6a])(C[6]C[6,6]C)	C[6](C[6,6]C[6,6,6a]C[6])(N[6]N[6])(COO){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<2>,2|C<4>,2|N<3>}	N[6](N[6]C[6,6a]C[6a])(C[6]C[6,6]C){1|N<2>,4|C<3>}	123.9470	0.000	1	123.9470	0.000	1	123.9470	0.000	1	123.0168	3.154	4	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-3:	N[6,6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CCO)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CCO){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	123.7050	0.000	1	123.7050	0.000	1	123.8790	0.061	2	123.0168	3.154	4	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-3:	N[6,6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(COO)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(COO){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	124.0530	0.000	1	124.0530	0.000	1	123.8790	0.061	2	123.0168	3.154	4	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:N-3:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(NHH)	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O)	N[6](C[6]C[6,6]N)(C[6]N[6]H)	C[6](C[6,6]C[6,6]C[6])(N[6]C[6])(NHH){1|H<1>,1|N<3>,1|O<1>,2|N<2>}	C[6,6](C[6,6]N[6]2)(C[6]N[6]N)(C[6]N[6]O){1|C<4>,2|C<3>}	N[6](C[6]C[6,6]N)(C[6]N[6]H){1|C<4>,2|C<3>}	120.3620	0.000	1	120.3620	0.000	1	120.3620	0.000	1	123.0168	3.154	4	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-4:	N[6,6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(CH3)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(CH3){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C){1|O<2>,2|F<1>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C){1|H<1>,1|N<3>,3|C<3>}	122.1825	0.503	2	122.1825	0.253	2	122.1825	0.253	2	122.8740	1.561	3	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6,6]-3:N[6]-2:C-4:	N[6,6]-3:C[6]-3:C[6]-3:	N[6]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CH3)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C)	C[6](C[6,6]N[6,6]C[6])(N[6]N[6])(CH3){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	N[6](N[6]C[6a]B[6])(C[6]C[6,6]C){1|N<3>,2|F<1>,3|C<3>}	124.2570	0.000	1	124.2570	0.000	1	124.2570	0.000	1	122.8740	1.561	3	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6,6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6,6]-3:C[6a]-3:N[6]-2:	N[6,6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6a]C[6a]2)(N[6]C[6,6a])	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6a]N[6])(C[6]C[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C[6a])	C[6](C[6,6]N[6,6]C[6])(C[6a]C[6a]2)(N[6]C[6,6a]){1|B<4>,3|H<1>,5|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6a]N[6])(C[6]C[6]H){1|O<2>,2|F<1>,5|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C[6a]){1|H<1>,1|N<3>,5|C<3>}	122.2225	0.250	2	122.2225	0.062	2	122.2225	0.062	2	122.2225	0.062	2	123.1169	9.996	21	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	2:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|C<2>,1|H<1>,3|C<3>}	123.7070	0.000	1	123.7070	0.000	1	123.0760	0.796	2	123.0760	0.796	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	2:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	N[6](C[6,6a]N[5a,6a]C[6,6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](C[6,6a]N[5a,6a]C[6,6a])(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	122.4450	0.000	1	122.4450	0.000	1	123.0760	0.796	2	123.0760	0.796	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H){2|C<3>,2|N<3>}	N[6](C[5,6]N[5,6]C[5])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	124.3020	0.000	1	124.3020	0.000	1	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	123.7260	0.000	1	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Cd<6>,1|H<1>,1|N<2>,2|C<3>}	123.6770	0.000	1	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	124.0230	0.000	1	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	124.0965	0.250	2	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	124.4160	0.000	1	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	124.6248	0.151	4	124.2534	0.158	10	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){3|N<3>}	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]H){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	125.7030	1.099	2	125.7030	1.207	2	124.4802	0.514	13	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	N[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6,6]N[6,6]N[6])(C[6]C[6]H){1|C<3>,1|H<1>,4|C<4>}	121.6220	0.000	1	121.6220	0.000	1	121.6220	0.000	1	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H)	N[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|S<2>}	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H){1|C<3>,1|S<2>}	N[6](C[5,6]C[5,6]S[5])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	126.1680	0.000	1	126.1680	0.000	1	126.1680	0.000	1	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H)	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)	C[6](N[6]C[6,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	123.4910	0.123	2	123.4910	0.015	2	123.4910	0.015	2	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	123.2670	0.000	1	123.2670	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H){4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.5647	0.187	3	122.5647	0.035	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	123.7540	0.962	2	123.7540	0.925	2	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	122.7410	0.000	1	122.7410	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	123.7060	0.000	1	123.3353	0.103	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.1500	0.025	2	123.3353	0.103	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H){1|H<1>,1|N<3>,2|C<3>}	124.4130	0.000	1	124.4130	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	123.8730	0.000	1	123.8730	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	123.2870	0.000	1	124.2513	1.541	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	123.8150	0.000	1	124.2513	1.541	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	125.6520	0.000	1	124.2513	1.541	3	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.8240	0.000	1	122.8240	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H)	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.9430	0.000	1	123.9430	0.000	1	123.4719	0.691	17	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:O-1:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(C[6]C[6]H)(O)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]O)	C[6](N[6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){2|C<3>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]O){1|Ru<6>,1|H<1>,3|C<3>}	119.0627	0.461	4	119.0627	0.212	4	119.0627	0.212	4	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	3:3:	N[6]-2:C[6]-3:O-1:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(O)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)	C[6](N[6]C[6,6a])(C[6]C[6]H)(O){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O){2|H<1>,3|C<3>}	117.0730	0.000	1	117.0730	0.000	1	117.0730	0.000	1	123.2144	4.155	39	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	4:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	125.7287	0.141	4	125.7287	0.020	4	125.7225	0.043	6	125.6935	0.036	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	4:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H){1|C<2>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	125.4330	0.000	1	125.4330	0.000	1	125.7225	0.043	6	125.6935	0.036	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	4:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H)	N[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Fe<10>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H){1|Fe<10>,2|C<4>}	N[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	125.9870	0.000	1	125.9870	0.000	1	125.7225	0.043	6	125.6935	0.036	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:1:	4:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	N[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mo<9>,2|C<4>}	N[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	125.6065	0.128	2	125.6065	0.016	2	125.6065	0.016	2	125.6935	0.036	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:2:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(CN)	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]C[6]C)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(CN){2|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H){1|C<2>,1|C<4>,3|C<3>}	124.7010	0.000	1	124.7010	0.000	1	124.7010	0.000	1	124.7010	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:3:	3:3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO)	N[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO){2|C<3>}	N[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H){1|H<1>,4|C<3>}	126.7510	0.000	1	126.7510	0.000	1	126.7510	0.000	1	124.0086	1.657	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:3:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(CHN)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(CHN){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.6225	0.957	2	123.6225	0.915	2	123.5515	0.234	6	124.0086	1.657	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:3:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(CHN)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(CHN){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.4770	0.253	2	123.4770	0.064	2	123.5515	0.234	6	124.0086	1.657	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:3:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(CNO)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(CNO){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.8460	0.000	1	123.8460	0.000	1	123.5515	0.234	6	124.0086	1.657	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	3:3:3:	3:3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(COO)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(COO){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.2640	0.000	1	123.2640	0.000	1	123.5515	0.234	6	124.0086	1.657	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:1:	4:3:4:	3:3:	N[6]-2:C[6]-3:H-1:	S[6]-4:C[6]-3:C-4:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]S[6]C)(H)	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3)	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)	C[6](N[6]C[5,6])(C[6]S[6]C)(H){1|N<3>,1|S<2>,2|O<1>}	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>}	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]H){1|S<4>,3|C<4>}	128.5170	0.000	1	128.5170	0.000	1	128.5170	0.000	1	128.5170	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:2:	2:3:3:	3:3:	N[6]-2:C[6]-3:O-2:	S[6]-2:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]S[6]C)(OC)	C[6](S[6]C[6,6a])(C[6]N[6]O)(CC[6a]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)	C[6](N[6]C[6,6a])(C[6]S[6]C)(OC){2|C<3>}	C[6](S[6]C[6,6a])(C[6]N[6]O)(CC[6a]H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O){1|H<1>,1|S<2>,3|C<3>}	129.1540	0.000	1	129.1540	0.000	1	129.1540	0.000	1	129.1540	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:2:	3:3:1:	4:3:	N[6]-2:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(SC)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	N[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]S)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	N[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]S){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	124.7800	0.000	1	124.7800	0.000	1	124.9885	0.087	2	124.9885	0.087	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:2:	3:3:1:	4:3:	N[6]-2:C[6]-3:S-2:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a])	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]S)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a]){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	N[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]S){1|C<2>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	125.1970	0.000	1	125.1970	0.000	1	124.9885	0.087	2	124.9885	0.087	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:2:	3:3:3:	3:3:	N[6]-2:C[6]-3:O-2:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(OH)	C[6](N[6]C[6,6a]Zn)(C[6]N[6]O)(COO)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)	C[6](N[6]C[6,6a])(C[6]N[6]C)(OH){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]N[6]O)(COO){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O){1|H<1>,1|N<3>,3|C<3>}	122.5090	0.000	1	122.5090	0.000	1	122.5090	0.000	1	122.5090	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:2:	3:3:4:	3:3:	N[6]-2:C[6]-3:O-2:	N[6]-3:C[6]-3:C-4:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(OC)	C[6](N[6]C[6,6a]Ru)(C[6]N[6]O)(CCHH)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)	C[6](N[6]C[6,6a])(C[6]N[6]C)(OC){1|Ru<5>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]N[6]O)(CCHH){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	124.4920	0.000	1	124.4920	0.000	1	124.4920	0.000	1	124.4920	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:1:	3:3:	N[6]-2:C[6]-3:C-3:	O[6]-2:C[6]-3:O-1:	C[3x6]-3:C[6]-3:	C[6](N[6]C[3x6])(C[6]O[6]O)(CCC)	C[6](O[6]C[3x6])(C[6]N[6]C)(O)	N[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]C)	C[6](N[6]C[3x6])(C[6]O[6]O)(CCC){2|C<4>}	C[6](O[6]C[3x6])(C[6]N[6]C)(O){1|C<3>,2|C<4>}	N[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]C){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	117.7860	0.000	1	117.7860	0.000	1	117.7860	0.000	1	119.0880	3.390	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:1:	3:3:	N[6]-2:C[6]-3:C-3:	O[6]-2:C[6]-3:O-1:	C[5,6,6]-3:C[6]-3:	C[6](N[6]C[5,6,6])(C[6]O[6]O)(CCH)	C[6](O[6]C[5,6,6])(C[6]N[6]C)(O)	N[6](C[5,6,6]C[5,5,6]C[5,6,6])(C[6]C[6]C)	C[6](N[6]C[5,6,6])(C[6]O[6]O)(CCH){2|C<4>}	C[6](O[6]C[5,6,6])(C[6]N[6]C)(O){1|C<3>,1|C<4>,1|H<1>}	N[6](C[5,6,6]C[5,5,6]C[5,6,6])(C[6]C[6]C){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	120.3900	0.000	1	120.3900	0.000	1	120.3900	0.000	1	119.0880	3.390	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	2:3:2:	3:3:	N[6]-2:C[6]-3:N-3:	O[6]-2:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]O[6]N)(NC[6a]H)	C[6](O[6]C[6,6a])(C[6]N[6]N)(NC[6a])	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)	C[6](N[6]C[6,6a])(C[6]O[6]N)(NC[6a]H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]N[6]N)(NC[6a]){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	121.4500	0.000	1	121.4500	0.000	1	121.4500	0.000	1	121.4500	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|N<3>,2|C<3>,2|H<1>}	122.4530	0.000	1	122.4530	0.000	1	122.6805	0.104	2	123.6610	1.318	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO)	C[6](N[6]C[6,6a]Pt)(C[6]N[6]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|N<3>,2|C<3>,2|H<1>}	122.9080	0.000	1	122.9080	0.000	1	122.6805	0.104	2	123.6610	1.318	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	3:3:1:	3:3:	N[6]-2:C[6]-3:N-3:	N[6]-3:C[6]-3:S-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]S)(NC[6]H)	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(S)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)	C[6](N[6]C[6,6a])(C[6]N[6]S)(NC[6]H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(S){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N){1|H<1>,1|N<3>,1|S<1>,2|C<3>}	124.6960	0.000	1	124.6960	0.000	1	124.6415	0.006	2	123.6610	1.318	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	3:3:1:	3:3:	N[6]-2:C[6]-3:N-3:	N[6]-3:C[6]-3:S-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]S)(NHN)	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(S)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)	C[6](N[6]C[6,6a])(C[6]N[6]S)(NHN){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(S){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N){1|H<1>,1|N<3>,1|S<1>,2|C<3>}	124.5870	0.000	1	124.5870	0.000	1	124.6415	0.006	2	123.6610	1.318	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	4:3:1:	3:3:	N[6]-2:C[6]-3:C-3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(COO)	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(COO){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(H){4|C<3>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|C<4>,2|C<3>,2|H<1>}	122.9720	0.000	1	122.9720	0.000	1	122.9720	0.000	1	122.9720	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:3:	4:3:1:	4:3:	N[6]-2:C[6a]-3:C[6]-3:	C[6]-4:C[6]-3:O-1:	C[5,6,6]-4:C[6]-3:	C[6](N[6]C[5,6,6])(C[6a]C[6a]2)(C[6]C[6]O)	C[6](C[6]C[5,6,6]OO)(C[6]C[6a]N[6])(O)	N[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6a]C[6])	C[6](N[6]C[5,6,6])(C[6a]C[6a]2)(C[6]C[6]O){2|C<4>,2|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[5,6,6]OO)(C[6]C[6a]N[6])(O){1|N<2>,2|C<3>,2|C<4>}	N[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6a]C[6]){1|N<2>,2|H<1>,2|O<1>,3|C<3>,3|C<4>}	120.7540	0.000	1	120.7540	0.000	1	120.7540	0.000	1	120.7540	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	2:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-2:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5a,6])(C[6]N[6]C)(H)	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>}	C[6](C[6]N[5a,6])(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	120.0770	0.000	1	120.0770	0.000	1	120.0770	0.000	1	120.0770	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	2:3:2:	3:3:	N[6]-2:C[6]-3:C-4:	S[6]-2:C[6]-3:N-2:	N[5a,6]-3:C[6]-3:	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3)	C[6](S[6]C[5a,6])(C[6]N[6]C)(NN)	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C)	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3){2|C<3>}	C[6](S[6]C[5a,6])(C[6]N[6]C)(NN){1|N<2>,1|N<3>}	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]C){1|C<3>,1|S<2>,3|N<2>}	127.2905	0.859	2	127.2905	0.738	2	127.2905	0.738	2	127.2905	0.738	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	122.5520	0.000	1	122.5520	0.000	1	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	122.5770	0.000	1	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	123.1978	0.834	5	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	122.5980	0.000	1	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	122.4680	0.000	1	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	122.6320	0.000	1	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	122.8560	0.280	4	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	122.5480	0.117	2	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	122.2210	0.000	1	122.8128	0.302	16	122.7975	0.287	17	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]C){1|H<1>,1|N<3>,2|C<3>}	126.6320	1.394	2	126.6320	1.944	2	125.0193	8.774	3	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	N[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	N[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C){1|H<1>,3|C<3>}	121.7940	0.000	1	121.7940	0.000	1	125.0193	8.774	3	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,3|C<3>}	120.7340	0.000	1	120.7340	0.000	1	120.7340	0.000	1	123.0166	2.010	21	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	6:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	Nb[3,3,6]-6:C[6]-3:	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	C[6](C[6]N[6]C)2(H)	N[6](Nb[3,3,6]N[3,5]4N[6])(C[6]C[6]C)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|C<4>,1|N<2>,4|N<3>}	C[6](C[6]N[6]C)2(H){1|Nb<6>}	N[6](Nb[3,3,6]N[3,5]4N[6])(C[6]C[6]C){1|H<1>,5|C<3>}	121.4955	3.120	2	121.4955	9.737	2	121.4955	9.737	2	121.4955	9.737	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:1:	7:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:H-1:	Nb[3,3,6]-7:C[6]-3:	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	C[6](C[6]N[6]C)2(H)	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|Cl<1>,1|C<4>,5|N<3>}	C[6](C[6]N[6]C)2(H){1|Nb<7>,1|H<1>}	N[6](Nb[3,3,6]N[3,5]4N[6]Cl)(C[6]C[6]C){2|H<1>,5|C<3>}	118.7870	0.000	1	118.7870	0.000	1	118.7870	0.000	1	118.7870	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	N[6]-3:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3)	C[6](N[6]C[6,6a]Re)(C[6]N[6]C)(CCN)	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3){1|Re<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]C)(CCN){2|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]C){1|C<4>,1|N<3>,3|C<3>}	119.8700	0.000	1	119.8700	0.000	1	119.8700	0.000	1	119.8700	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:C-4:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(CH3)	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]N[6]C)(CH3){1|C<3>,1|N<2>}	N[6](C[5,6]N[5,6]N[5])(C[6]C[6]C){1|Ru<9>,1|C<4>,1|N<2>,2|C<3>}	123.7880	0.000	1	123.7880	0.000	1	123.7880	0.000	1	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-3:C[6]-3:C-4:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(CH3)	N[6](C[5a,6]N[5a,6]2)(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(CH3){1|C<3>,1|N<2>}	N[6](C[5a,6]N[5a,6]2)(C[6]C[6]C){1|N<2>,2|C<3>,2|C<4>}	123.4800	0.000	1	123.4800	0.000	1	123.4800	0.000	1	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	N[6]-3:C[6]-3:C-4:	C[6,6]-3:C[6]-3:	C[6](N[6]C[6,6])(C[6]N[6]C)(CH3)	C[6](N[6]C[6,6]Co)(C[6]N[6]C)(CH3)	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C)	C[6](N[6]C[6,6])(C[6]N[6]C)(CH3){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6]Co)(C[6]N[6]C)(CH3){2|C<3>}	N[6](C[6,6]C[6,6]N[6])(C[6]C[6]C){1|N<3>,2|C<3>,2|C<4>}	122.4740	0.000	1	122.4740	0.000	1	122.4740	0.000	1	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	N[6]-3:C[6]-3:C-4:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CBrHH)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CBrHH){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	119.8990	0.000	1	119.8990	0.000	1	123.1580	4.329	7	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	N[6]-3:C[6]-3:C-4:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH)	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CBrHH){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]N[6]C)(CBrHH){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	124.5263	1.343	4	124.5263	1.804	4	123.1580	4.329	7	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	3:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	N[6]-3:C[6]-3:C-4:	C[6,6a]-3:C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3)	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](N[6]C[6,6a])(C[6]N[6]C)(CH3){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(CH3){2|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	122.0510	0.011	2	122.0510	0.000	2	123.1580	4.329	7	123.1848	2.993	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-3:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5,6]C[5a]H)(C[6]N[6]C)(COO)	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5,6]C[5a]H)(C[6]N[6]C)(COO){1|S<2>,3|C<3>}	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){1|C<4>,3|C<3>}	121.8920	0.000	1	121.8920	0.000	1	122.4358	0.282	6	122.3753	0.166	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-3:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(COO)	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(COO){4|C<3>}	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){1|C<4>,3|C<3>}	122.5955	0.579	4	122.5446	0.264	5	122.4358	0.282	6	122.3753	0.166	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-3:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(COO)	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(COO){4|C<3>}	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){2|C<3>,2|C<4>}	122.3410	0.000	1	122.5446	0.264	5	122.4358	0.282	6	122.3753	0.166	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-3:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(CNO)	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(CNO){4|C<3>}	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C){1|C<4>,3|C<3>}	122.6990	0.262	2	122.6990	0.068	2	122.3580	0.143	21	122.3753	0.166	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:3:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-3:	C[5a,6]-3:C[6]-3:	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3)	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(COO)	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C)	C[6](N[6]C[5a,6])(C[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(COO){4|C<3>}	N[6](C[5a,6]N[5a,6]S[5a])(C[6]C[6]C){1|C<4>,3|C<3>}	122.3221	0.376	19	122.3221	0.141	19	122.3580	0.143	21	122.3753	0.166	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	2:3:4:	4:3:4:	3:3:	N[6]-2:C[6]-3:C-4:	C[6]-4:C[6]-3:C-4:	C[5,6]-3:C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]C)(CCHH)	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(CCHH)	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C)	C[6](N[6]C[5,6])(C[6]C[6]C)(CCHH){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(CCHH){4|C<3>}	N[6](C[5,6]N[5,6]S[5])(C[6]C[6]C){1|C<3>,3|C<4>}	123.2153	0.080	6	123.2153	0.006	6	123.2153	0.006	6	123.2153	0.006	6	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	2:3:2:	3:3:	C[6]-3:N[6]-2:H-1:	O[6]-2:C[6]-3:O-2:	N[6]-3:C[6]-3:	C[6](C[6]O[6]O)(N[6]N[6])(H)	C[6](O[6]B[5,6])(C[6]N[6]H)(OC)	N[6](N[6]B[5,6]P)(C[6]C[6]H)	C[6](C[6]O[6]O)(N[6]N[6])(H){1|B<4>,1|P<3>}	C[6](O[6]B[5,6])(C[6]N[6]H)(OC){1|N<3>,2|O<2>}	N[6](N[6]B[5,6]P)(C[6]C[6]H){4|O<2>}	122.1575	0.009	2	122.1575	0.000	2	122.1575	0.000	2	122.1575	0.000	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>}	121.4307	3.060	3	121.4307	9.361	3	123.0565	4.723	8	123.0565	4.723	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|S<2>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|C<2>,1|H<1>,1|S<2>}	124.2090	0.000	1	124.2090	0.000	1	123.0565	4.723	8	123.0565	4.723	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<2>,2|H<1>}	124.1795	0.646	2	123.8103	0.617	3	123.0565	4.723	8	123.0565	4.723	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<2>,1|C<3>,1|H<1>}	123.0720	0.000	1	123.8103	0.617	3	123.0565	4.723	8	123.0565	4.723	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|C<2>,1|C<3>,1|N<2>,2|H<1>}	124.5200	0.000	1	124.5200	0.000	1	123.0565	4.723	8	123.0565	4.723	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:3:	3:2:	C[6]-3:N[6]-2:H-1:	C[6]-3:O[6]-2:N-3:	C[6]-3:O[6]-2:	C[6](C[6]O[6]N)(N[6]O[6])(H)	C[6](C[6]N[6]H)(O[6]B[6])(NCC)	N[6](C[6]C[6]H)(O[6]B[6])	C[6](C[6]O[6]N)(N[6]O[6])(H){1|B<4>}	C[6](C[6]N[6]H)(O[6]B[6])(NCC){1|O<2>,2|F<1>}	N[6](C[6]C[6]H)(O[6]B[6]){1|N<3>,1|O<2>,2|F<1>}	123.7890	0.000	1	123.7890	0.000	1	123.7890	0.000	1	123.7890	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:2:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<2>,1|C<3>,1|H<1>}	124.7090	0.000	1	124.7090	0.000	1	124.7090	0.000	1	124.7090	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	2:3:	C[6]-3:N[6]-2:O-1:	N[5,6]-3:C[6]-3:O-1:	N[6]-2:C[6]-3:	C[6](C[6]N[5,6]O)(N[6]N[6])(O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[6](N[6]C[5,6])(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]N[6])(O){2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<2>,1|S<4>,2|H<1>}	N[6](N[6]C[5,6])(C[6]C[6]O){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	115.2880	0.000	1	115.2880	0.000	1	115.2880	0.000	1	115.2880	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:2:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	124.8430	0.000	1	124.8430	0.000	1	123.2620	5.249	4	121.5452	18.674	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:2:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	125.4400	0.000	1	125.4400	0.000	1	123.2620	5.249	4	121.5452	18.674	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:2:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	122.2310	0.000	1	122.2310	0.000	1	123.2620	5.249	4	121.5452	18.674	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:2:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	120.5340	0.000	1	120.5340	0.000	1	123.2620	5.249	4	121.5452	18.674	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:2:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:	C[6](C[6]C[6]H)(N[6]N[6])(O)	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(N[6]C[6])	C[6](C[6]C[6]H)(N[6]N[6])(O){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,1|N<2>}	N[6](C[6]C[6]O)(N[6]C[6]){1|C<3>,1|C<4>,1|H<1>}	114.6780	0.000	1	114.6780	0.000	1	114.6780	0.000	1	121.5452	18.674	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Br-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6])(Br)	C[6](C[6]N[6]Br)(C[6]C[6]H)(O)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]C[6]O)(N[6]C[6])(Br){1|C<3>,2|H<1>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(O){1|C<3>,1|H<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|C<3>,1|H<1>,1|O<1>}	124.1050	0.000	1	124.1050	0.000	1	124.1050	0.000	1	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Br-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Br)	C[6](C[6]N[6]Br)(N[6]C[6]Co)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Br)(N[6]C[6]Co)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|N<3>,2|H<1>}	124.0100	0.000	1	124.0100	0.000	1	123.7420	0.052	4	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Br-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Br)	C[6](C[6]N[6]Br)(N[6]C[6]Ni)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Br)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|N<3>,2|H<1>}	123.6080	0.000	1	123.6080	0.000	1	123.7420	0.052	4	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Br-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Br)	C[6](C[6]N[6]Br)(N[6]C[6]Re)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Br)(N[6]C[6]Re)(H){1|C<3>,1|N<3>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|H<1>,2|N<3>}	123.6750	0.239	2	123.6750	0.057	2	123.7420	0.052	4	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]Cl)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]Cl){1|B<4>,1|C<3>,1|H<1>}	125.1717	0.576	3	124.8720	0.228	13	124.8720	0.228	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]Cl)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|H<1>,2|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]Cl){1|B<4>,1|C<3>,1|H<1>}	124.8987	0.251	9	124.8720	0.228	13	124.8720	0.228	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]Cl)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,3|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]Cl){1|B<4>,1|C<3>,1|H<1>}	123.7330	0.000	1	124.8720	0.228	13	124.8720	0.228	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(Cl)	N[6](C[6]C[6]Cl)(C[6]C[6]O)	C[6](C[6]C[6]Cl)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(Cl){1|Cl<1>,1|C<3>}	N[6](C[6]C[6]Cl)(C[6]C[6]O){2|Cl<1>,1|C<3>}	124.4515	0.340	2	124.4515	0.116	2	124.4515	0.116	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H){1|Fe<10>,1|Pd<4>,1|C<3>,2|C<4>}	N[6](C[6]C[6]Cl)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	125.9540	0.000	1	125.9540	0.000	1	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|H<1>,2|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,2|C<3>}	N[6](C[6]C[6]Cl)(C[6]N[6]H){1|Ru<6>,1|C<3>,1|H<1>}	124.8060	0.000	1	124.8060	0.000	1	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<1>,2|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]N[6]N){1|C<3>,2|H<1>}	127.3550	0.000	1	126.5300	0.584	8	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]N[6]N){1|C<3>,2|H<1>}	126.9433	0.361	4	126.5300	0.584	8	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>}	N[6](C[6]C[6]Cl)(C[6]N[6]N){1|Fe<5>,1|C<3>,1|H<1>}	125.4890	0.071	2	126.5300	0.584	8	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[6]Cl)(C[6]N[6]N){1|Fe<6>,1|C<3>,1|H<1>}	126.1340	0.000	1	126.5300	0.584	8	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>}	N[6](C[6]C[6]Cl)(C[6]N[6]N){1|C<3>,1|H<1>}	125.9990	0.000	1	125.9990	0.000	1	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	N[6](C[6]C[6]Cl)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<3>,2|O<1>}	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]N[6]O){1|C<3>,2|H<1>}	127.8715	0.093	2	127.8715	0.009	2	126.5186	0.940	13	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	N[6](C[6]C[6]Cl)(N[6]C[6]C)	C[6](C[6]C[6]H)(N[6]N[6])(Cl){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|N<3>}	N[6](C[6]C[6]Cl)(N[6]C[6]C){1|Pd<4>,1|C<3>,1|H<1>}	125.0420	0.000	1	125.0420	0.000	1	124.8610	0.066	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	N[6](C[6]C[6]Cl)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(Cl){1|C<3>,2|H<1>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){2|N<3>}	N[6](C[6]C[6]Cl)(N[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	124.6800	0.000	1	124.6800	0.000	1	124.8610	0.066	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]Co)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Cl)(N[6]C[6]Co)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	123.7270	0.000	1	123.7270	0.000	1	123.8669	0.414	16	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]Fe)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Cl)(N[6]C[6]Fe)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	124.3350	0.000	1	124.3350	0.000	1	123.8669	0.414	16	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]Ni)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]N[6]Cl)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	124.0040	0.000	1	124.0040	0.000	1	123.8669	0.414	16	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]O)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]Cl)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	125.6250	0.000	1	125.6250	0.000	1	123.8669	0.414	16	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]Zn)(H)	N[6](C[6]C[6]Cl)2	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Cl<1>,1|Zn<4>,1|C<3>}	C[6](C[6]N[6]Cl)(N[6]C[6]Zn)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)2{1|N<3>,2|H<1>}	123.6817	0.473	12	123.6817	0.223	12	123.8669	0.414	16	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	N[6](C[6]N[6,6]N)(C[6]C[6]H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]N)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	123.5130	0.000	1	123.5130	0.000	1	123.5970	0.014	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	N[6](C[6]N[6,6]O)(C[6]C[6]H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]O)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	123.6810	0.000	1	123.6810	0.000	1	123.5970	0.014	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Br)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]Br)(N[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(Br){1|Ru<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Br<1>,1|Ru<5>,1|C<3>}	121.3055	0.740	2	121.3055	0.548	2	121.6073	0.547	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Br)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]Br)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(Br){1|Co<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Br<1>,1|Co<6>,1|C<3>}	122.2110	0.000	1	122.2110	0.000	1	121.6073	0.547	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Cl)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]Cl)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(Cl){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Cl<1>,1|C<3>,1|H<1>}	122.9240	0.000	1	122.9240	0.000	1	121.6290	1.266	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Cl)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]Cl)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(Cl){1|Ru<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cl<1>,1|Ru<6>,1|N<3>,2|C<3>}	120.9815	0.128	2	120.9815	0.016	2	121.6290	1.266	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(F)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]F)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(F){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|C<3>,1|F<1>,1|H<1>}	119.8410	0.000	1	119.8410	0.000	1	120.9530	1.062	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(F)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]F)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(F){1|Ir<6>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|Ir<6>,1|F<1>,3|C<3>}	121.5090	0.519	2	121.5090	0.269	2	120.9530	1.062	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>}	125.7900	0.000	1	125.7900	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>}	114.9650	0.000	1	114.9650	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,2|C<3>}	123.6240	0.000	1	123.6240	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|C<3>,1|H<1>,1|O<1>}	122.0710	0.000	1	122.0710	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>}	124.8440	0.000	1	122.4360	11.597	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,3|H<1>}	120.0280	0.000	1	122.4360	11.597	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>}	124.4700	0.000	1	124.4700	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,3|H<1>}	116.0690	0.000	1	116.0690	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|C<3>,1|H<1>,2|C<4>}	123.3840	0.000	1	123.3840	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ni<5>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Ni<5>,1|C<3>,1|H<1>}	123.6985	0.896	2	123.3607	0.481	4	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<5>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Zn<5>,1|C<3>,1|H<1>}	123.0230	0.429	2	123.3607	0.481	4	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Ir<8>,1|C<3>,1|H<1>}	122.8090	0.000	1	122.8590	0.005	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|H<1>,1|V<7>}	122.9090	0.000	1	122.8590	0.005	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<8>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Co<8>,1|C<3>,1|H<1>}	123.9140	0.000	1	123.6652	0.436	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Ir<8>,1|C<3>,1|H<1>}	124.3340	0.000	1	123.6652	0.436	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,1|H<1>,1|V<7>}	124.0270	0.000	1	123.6652	0.436	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Rh<8>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Rh<8>,1|C<3>,1|H<1>}	123.4040	0.000	1	123.6652	0.436	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ru<9>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Ru<9>,1|C<3>,1|H<1>}	122.6470	0.000	1	123.6652	0.436	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<6>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Co<6>,1|C<3>,1|H<1>}	122.9993	0.146	3	123.1358	0.281	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<5>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Cu<5>,1|C<3>,1|H<1>}	123.3405	0.971	2	123.1358	0.281	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>}	123.9545	1.067	2	123.9545	1.139	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|C<3>,1|H<1>}	122.2370	0.000	1	122.5574	0.067	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,1|C<3>,1|H<1>}	122.5185	0.275	2	122.5574	0.067	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Li<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Li<5>,1|C<3>,1|H<1>}	122.7565	0.090	2	122.5574	0.067	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,2|H<1>}	124.2723	0.446	3	124.2723	0.199	3	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	123.4695	0.879	2	123.4695	0.773	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){3|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Co<6>,1|C<3>,1|H<1>}	122.8530	0.000	1	122.8530	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|S<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|C<3>,2|H<1>}	121.2440	0.000	1	121.2440	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|Zn<4>,1|C<3>,1|H<1>}	120.5490	0.000	1	120.5490	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|S<2>}	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|C<3>,2|H<1>}	126.3450	0.000	1	126.3450	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){2|H<1>,3|C<3>}	125.0920	0.000	1	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.6030	0.000	1	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	122.9010	0.000	1	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	122.7980	0.670	3	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.4450	0.000	1	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<6>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	123.2157	0.093	3	123.1082	0.657	10	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[5a]N[6])(C[6]C[6]H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.9813	0.165	3	122.9746	0.021	7	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]C[5a]N[6])(C[6]C[6]H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	123.1040	0.000	1	122.9746	0.021	7	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[5a]N[6])(C[6]C[6]H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.9247	0.152	3	122.9746	0.021	7	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]2)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|C<4>,2|H<1>}	124.8005	0.250	2	124.8005	0.062	2	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|C<4>,1|H<1>}	122.9730	0.000	1	122.5349	1.218	30	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Co<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Co<6>,1|C<3>,1|H<1>}	122.2094	1.391	10	122.5349	1.218	30	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Cu<5>,1|C<3>,1|H<1>}	122.4080	0.000	1	122.5349	1.218	30	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Ir<6>,1|C<3>,1|H<1>}	123.2600	0.580	2	122.5349	1.218	30	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|Ni<6>,1|C<3>,1|H<1>}	122.6282	1.004	16	122.5349	1.218	30	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|C<4>,1|H<1>}	122.5570	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|H<1>}	122.6393	0.294	3	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|W<7>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|H<1>,1|W<7>}	122.4910	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,1|C<3>,1|H<1>}	123.2280	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,1|H<1>}	121.6420	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	122.9428	0.611	4	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Re<6>,1|C<3>,1|H<1>}	122.8830	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|U<16>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|U<16>,1|C<3>,1|H<1>}	121.4000	0.000	1	122.6069	0.384	13	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,2|H<1>}	124.4718	0.184	12	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Cu<6>,1|C<3>,1|H<1>}	122.4400	0.000	1	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Zn<4>,1|C<3>,1|H<1>}	123.9425	0.026	2	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,1|C<4>,1|H<1>}	123.3925	0.073	2	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,2|H<1>}	124.2879	0.522	29	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|O<1>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|C<3>,1|H<1>,1|O<1>}	122.4960	0.000	1	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Cd<6>,1|C<3>,1|H<1>}	123.2840	0.000	1	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Cu<4>,1|C<3>,1|H<1>}	122.8546	0.421	7	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Cu<5>,1|C<3>,1|H<1>}	123.1570	0.831	11	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Fe<6>,1|C<3>,1|H<1>}	123.0803	0.374	4	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Ir<8>,1|C<3>,1|H<1>}	124.5318	0.545	5	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Ni<4>,1|C<3>,1|H<1>}	123.6377	0.497	3	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Ni<6>,1|C<3>,1|H<1>}	123.8420	0.511	2	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Pd<4>,1|C<3>,1|H<1>}	122.4800	0.100	2	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]N){1|Zn<4>,1|C<3>,1|H<1>}	123.5890	0.000	1	123.8281	0.658	83	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|Cu<5>,1|C<3>,1|H<1>}	123.5400	0.000	1	123.5400	0.000	1	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|C<3>,2|H<1>}	123.2443	1.862	3	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ag<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Ag<4>,1|C<3>,1|H<1>}	123.8850	0.000	1	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|C<3>,2|H<1>}	124.5467	0.375	3	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Ni<6>,1|C<3>,1|H<1>}	123.9937	0.134	6	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Pd<4>,1|C<3>,1|H<1>}	124.0650	0.478	2	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pt<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Pt<5>,1|C<3>,1|H<1>}	122.9040	0.175	2	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Sn<7>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Sn<7>,1|C<3>,1|H<1>}	123.8503	0.743	3	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|Re<6>,1|C<3>,1|H<1>}	120.2360	0.000	1	123.6640	1.278	21	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	122.8400	1.071	2	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.5748	0.177	4	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cr<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cr<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.8690	0.000	1	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.5825	0.213	2	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Eu<9>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Eu<9>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.4512	0.604	4	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.7138	0.620	14	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.7279	0.991	28	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ni<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.4963	0.409	4	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.7488	0.245	4	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.6565	0.343	14	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.2330	0.387	2	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.2494	1.063	19	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	122.8080	0.000	1	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	123.4690	0.246	2	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.7735	0.677	18	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	122.4550	0.724	3	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<5>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	124.0245	0.786	2	122.6504	0.616	124	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	123.3013	0.132	3	123.3839	1.000	18	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|Ir<6>,1|H<1>,3|C<3>}	123.5159	1.271	11	123.3839	1.000	18	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|Pt<4>,1|H<1>,3|C<3>}	123.1230	0.000	1	123.3839	1.000	18	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|Pt<6>,1|H<1>,3|C<3>}	123.2420	0.232	2	123.3839	1.000	18	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]H){1|Ru<6>,1|H<1>,3|C<3>}	122.7250	0.000	1	123.3839	1.000	18	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Cu<6>,1|H<1>,3|C<3>}	122.3720	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ir<8>,1|C<4>,1|H<1>,2|C<3>}	123.2440	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ir<8>,1|H<1>,3|C<3>}	122.6400	0.716	2	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Mn<6>,1|H<1>,3|C<3>}	122.5000	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ni<6>,1|H<1>,3|C<3>}	123.1550	0.809	2	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	123.5730	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,3|C<3>}	122.8793	0.578	15	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Re<6>,1|H<1>,3|C<3>}	121.5968	1.063	4	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	123.1545	2.087	2	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	123.2630	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Rh<8>,1|H<1>,3|C<3>}	121.6725	2.565	2	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	123.3215	0.803	4	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<6>,1|H<1>,3|C<3>}	122.6585	0.337	4	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<9>,1|C<3>}	N[6](C[6]N[5]N[6])(C[6]C[6]H){1|Ru<9>,1|H<1>,3|C<3>}	123.1110	0.000	1	122.7513	0.847	41	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]N[5a]N[6])(C[6]C[6]H){1|Mn<6>,1|H<1>,3|C<3>}	123.6760	0.000	1	123.6274	0.889	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]N[5a]N[6])(C[6]C[6]H){1|Pd<4>,1|H<1>,3|C<3>}	122.7150	0.492	2	123.6274	0.889	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[5a]N[6])(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	N[6](C[6]N[5a]N[6])(C[6]C[6]H){1|Rh<8>,1|H<1>,3|C<3>}	124.5155	0.264	2	123.6274	0.889	5	123.0556	1.349	396	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	123.6655	0.425	6	123.6655	0.180	6	123.6655	0.180	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Ca)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Ca)(C[6]C[6]H){1|H<1>,2|C<3>}	123.7865	0.302	2	123.7865	0.091	2	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Co)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Co)(C[6]C[6]H){1|H<1>,2|C<3>}	123.3920	0.000	1	123.7398	0.045	5	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Co)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Co)(C[6]C[6]H){1|C<3>,2|H<1>}	123.8268	0.099	4	123.7398	0.045	5	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Li)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Li)(C[6]C[6]H){1|H<1>,2|C<3>}	123.3460	0.000	1	123.3460	0.000	1	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Mg)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Mg)(C[6]C[6]H){1|H<1>,2|C<3>}	123.5510	0.000	1	123.5510	0.000	1	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Ni)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,2|H<1>}	123.9660	0.504	10	123.9660	0.254	10	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Pd)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	123.4723	1.038	4	123.4723	1.077	4	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Re)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Re)(C[6]C[6]H){1|C<3>,2|H<1>}	123.7560	0.000	1	123.7560	0.000	1	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Ru)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|H<1>}	124.5320	0.000	1	124.5320	0.000	1	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](N[6]C[6]Zn)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	N[6](N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>}	124.1942	0.330	4	124.1942	0.109	4	123.8546	0.292	29	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	121.1055	0.344	2	121.1055	0.119	2	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	123.1765	0.516	4	123.0716	0.255	5	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.6520	0.000	1	123.0716	0.255	5	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.8647	0.562	3	123.8647	0.316	3	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.1016	0.897	13	123.0569	0.674	16	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|S<1>}	N[6](C[6]C[6]H)2{1|H<1>,1|N<3>,1|S<1>}	122.4300	0.000	1	123.0569	0.674	16	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.0800	0.202	2	123.0569	0.674	16	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	121.7240	0.079	2	121.0200	2.801	12	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	119.5775	4.917	2	121.0200	2.801	12	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|H<1>,2|N<3>}	121.2046	0.415	8	121.0200	2.801	12	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){2|C<3>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.4240	0.000	1	121.4240	0.000	1	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.2570	0.076	2	122.8377	0.530	3	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|H<1>,1|N<3>,1|S<1>}	121.9990	0.000	1	122.8377	0.530	3	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<2>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<2>}	122.0225	1.132	6	122.2930	1.165	8	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<3>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<3>}	123.1045	0.013	2	122.2930	1.165	8	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	121.6244	1.325	14	121.5283	1.348	20	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	121.3040	0.685	6	121.5283	1.348	20	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	124.2140	0.000	1	124.2140	0.000	1	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|O<1>,1|S<4>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	123.5910	0.000	1	123.5910	0.000	1	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.4826	0.431	10	123.5752	0.262	11	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	124.5010	0.000	1	123.5752	0.262	11	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]V)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]V)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	125.9840	0.498	2	125.9840	0.248	2	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]W)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]N[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.7900	0.112	2	122.7900	0.012	2	122.4579	2.147	87	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(S)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]S)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(S){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|H<1>,1|N<3>,1|S<1>}	126.5780	0.000	1	126.5780	0.000	1	126.1190	0.322	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(S)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]S)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(S){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|N<3>,1|S<1>,3|C<3>}	125.8895	0.573	2	125.8895	0.329	2	126.1190	0.322	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]H)(N[6]C[6])(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H)	N[6](C[6]C[5,6]H)(C[6]C[6]H)	C[6](C[6]N[5,6]H)(N[6]C[6])(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H){2|C<3>,2|N<3>,2|S<2>}	N[6](C[6]C[5,6]H)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.9880	0.000	1	122.9880	0.000	1	122.9880	0.000	1	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ag<5>,2|C<3>}	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	121.0310	0.000	1	121.0310	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ag<5>,2|C<3>}	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.5180	0.000	1	122.5180	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.1021	0.258	8	122.0265	0.082	10	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.7240	0.201	2	122.0265	0.082	10	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Au)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Au<2>,2|C<3>}	C[6](N[6]C[6]Au)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.8540	0.000	1	122.8540	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	123.0600	0.103	2	123.0600	0.011	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.1160	0.091	2	122.2763	0.081	3	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5970	0.000	1	122.2763	0.081	3	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[5a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[5a]C[6])(C[6]C[6]H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	122.3440	0.000	1	122.3440	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|N<3>,2|H<1>}	122.4900	0.000	1	122.4900	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.2370	0.000	1	121.9017	0.061	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.7900	0.131	3	121.9017	0.061	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	122.8800	0.000	1	122.8800	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]I)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]I){1|N<3>,2|H<1>}	122.7770	0.000	1	122.7770	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.3370	0.369	5	123.2487	0.156	6	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	122.8070	0.000	1	123.2487	0.156	6	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>}	122.9430	0.000	1	122.9430	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	123.4030	0.000	1	123.4030	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	121.4767	0.653	4	122.4734	0.781	32	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.8410	0.246	2	122.4734	0.781	32	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5985	0.854	26	122.4734	0.781	32	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	121.8330	0.488	2	121.8330	0.238	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	123.1220	0.202	2	122.6915	0.203	11	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.7730	0.459	4	122.6915	0.203	11	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.8160	0.492	2	122.6915	0.203	11	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.2100	0.000	2	122.6915	0.203	11	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.2190	0.000	1	122.6915	0.203	11	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.4690	0.000	1	123.4225	0.004	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.3760	0.000	1	123.4225	0.004	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0060	0.000	1	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.7245	0.517	2	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3003	0.122	3	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.1600	0.000	1	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.8026	0.502	11	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	121.8370	0.000	1	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.9424	0.593	5	122.6623	0.287	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.3130	0.000	1	122.3130	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	N[6](C[6]N[5a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]N[5a]C[6])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	122.9810	0.000	1	122.9810	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.2440	0.000	1	122.2440	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	122.4150	0.000	1	122.4150	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	121.8550	0.000	1	121.8550	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.7785	0.540	2	123.0433	0.383	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.9096	0.550	11	123.0433	0.383	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.7510	1.097	2	123.7510	1.204	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.2150	0.625	4	122.2150	0.391	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	122.5960	0.000	1	122.5705	0.001	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5450	0.000	1	122.5705	0.001	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	121.8850	0.000	1	121.8850	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[5]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[5]C[6])(C[6]C[6]H){1|N<2>,2|H<1>,2|N<3>}	122.6040	0.000	1	122.6040	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.6010	0.000	1	122.6010	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	122.4810	0.000	1	123.0694	0.165	5	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.1520	0.092	2	123.0694	0.165	5	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	123.2810	0.451	2	123.0694	0.165	5	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>}	123.0230	0.000	1	123.0230	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4470	0.000	1	121.2324	1.358	16	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.1514	1.159	15	121.2324	1.358	16	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.1700	0.000	1	122.1700	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|N<3>,2|H<1>}	122.6460	0.000	1	122.6460	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.2130	0.000	1	122.2130	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|N<3>,2|H<1>}	123.1040	0.000	1	123.1040	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]I)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]I){1|N<3>,2|H<1>}	122.4070	0.000	1	122.4070	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	123.2742	0.382	4	123.2742	0.146	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3190	1.179	2	122.5780	0.338	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6178	0.516	13	122.5780	0.338	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	123.0090	0.000	1	123.0090	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	123.7390	1.284	3	123.2063	1.073	9	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.7550	1.003	4	123.2063	1.073	9	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	123.3100	0.765	2	123.2063	1.073	9	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.4740	0.000	1	122.4740	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<5>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.9850	0.000	1	122.9850	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.2717	0.555	10	123.1874	0.343	12	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.7660	0.755	2	123.1874	0.343	12	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.1737	0.194	3	122.1462	0.028	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.0640	0.000	1	122.1462	0.028	4	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	124.2960	0.506	2	122.9620	0.581	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.7852	0.541	14	122.9620	0.581	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.9377	0.871	8	122.9620	0.581	24	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.6460	0.105	2	122.6460	0.011	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0415	0.535	2	122.8817	0.270	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	122.7800	0.000	1	122.8817	0.270	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	123.0345	0.081	2	122.8817	0.270	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	123.0662	0.414	8	122.8817	0.270	13	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,2|C<3>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.6800	0.000	1	122.6800	0.000	1	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	123.0600	0.444	3	123.0600	0.197	3	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3508	0.419	4	122.5389	0.149	7	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7897	0.140	3	122.5389	0.149	7	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	123.0335	2.959	6	122.7329	6.577	8	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.8310	0.279	2	122.7329	6.577	8	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	123.1530	0.000	1	122.8725	0.157	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	122.5920	0.000	1	122.8725	0.157	2	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.6625	0.052	2	122.2021	0.153	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|N<3>,2|H<1>}	122.3215	0.132	2	122.2021	0.153	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7690	0.000	1	122.2021	0.153	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0294	0.342	10	122.2021	0.153	15	122.6055	0.777	283	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(I)	C[6](N[6]C[6]Co)(C[6]N[6]I)(H)	N[6](C[6]C[6]H)(C[6]C[6]I)	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]I){1|N<3>,2|H<1>}	122.6170	0.000	1	122.6170	0.000	1	123.0525	0.379	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(I)	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H)	N[6](C[6]C[6]H)(C[6]C[6]I)	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]I){1|N<3>,2|H<1>}	123.4880	0.000	1	123.4880	0.000	1	123.0525	0.379	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6])(O)	C[6](C[6]N[6]H)(C[6]N[6]O)(Br)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]Br)(N[6]C[6])(O){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(Br){1|C<3>,1|C<4>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|Br<1>,1|C<3>,1|C<4>}	112.1030	0.000	1	112.1030	0.000	1	112.1030	0.000	1	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(O)	C[6](C[6]C[6]H)(C[6]N[6]O)(Cl)	N[6](C[6]C[6]Cl)(C[6]C[6]O)	C[6](C[6]C[6]Cl)(N[6]C[6])(O){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(Cl){1|Cl<1>,1|C<3>}	N[6](C[6]C[6]Cl)(C[6]C[6]O){2|Cl<1>,1|C<3>}	117.5760	0.611	2	117.5760	0.373	2	117.5760	0.373	2	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6])(O)	C[6](C[6]N[6]H)(C[6]N[6]O)(F)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]F)(N[6]C[6])(O){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(F){1|C<3>,1|C<4>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|C<4>,1|F<1>}	115.3837	2.279	3	115.3837	5.194	3	115.3837	5.194	3	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(O)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	N[6](C[6]C[6]C)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]O){1|C<3>,2|H<1>}	120.1240	0.000	1	120.1240	0.000	1	116.9870	10.476	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(O)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|C<4>,1|H<1>}	118.6990	0.000	1	118.6990	0.000	1	116.9870	10.476	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(O)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,2|H<1>}	113.1810	0.000	1	113.1810	0.000	1	116.9870	10.476	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(O)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(O){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]N){1|C<3>,1|H<1>}	120.6940	0.000	1	120.6940	0.000	1	116.9870	10.476	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(O)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(O){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|C<4>,1|H<1>}	114.6120	0.313	2	114.6120	0.098	2	116.9870	10.476	6	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]O)(N[6]C[6])(O)	C[6](C[6]N[6]O)(N[6]C[6]C)(O)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]N[6]O)(N[6]C[6])(O){1|H<1>,2|C<4>}	C[6](C[6]N[6]O)(N[6]C[6]C)(O){1|C<3>,2|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|N<3>,1|O<1>,2|H<1>}	117.6280	0.000	1	117.6280	0.000	1	117.6280	0.000	1	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-1:	N[5,6]-3:C[6]-3:O-1:	N[6]-3:C[6]-3:	C[6](C[6]N[5,6]O)(N[6]N[6])(O)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O)	N[6](N[6]C[5,6]H)(C[6]C[6]O)	C[6](C[6]N[5,6]O)(N[6]N[6])(O){1|H<1>,2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]O)(O){1|C<3>,1|C<4>,1|N<3>,1|S<4>,2|H<1>}	N[6](N[6]C[5,6]H)(C[6]C[6]O){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	117.0620	0.000	1	117.0620	0.000	1	117.0620	0.000	1	122.8764	2.309	883	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	N[6](C[6]C[6]RhC)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>}	N[6](C[6]C[6]RhC)(C[6]C[6]H){1|C<3>,2|H<1>}	124.7870	0.000	1	124.7870	0.000	1	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	N[6](C[6]C[6]2Ru)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<10>,1|O<2>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>}	N[6](C[6]C[6]2Ru)(C[6]C[6]H){1|Ru<8>,1|H<1>,1|N<4>,2|C<3>}	125.1220	0.000	1	125.1220	0.000	1	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[6]CaN)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<11>,1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<11>,1|C<4>}	N[6](C[6]N[6]CaN)(C[6]C[6]H){1|C<3>,1|H<1>}	123.8350	0.000	1	123.5995	0.111	2	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[6]CaN)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<8>,1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<8>,1|C<4>}	N[6](C[6]N[6]CaN)(C[6]C[6]H){1|C<3>,1|H<1>}	123.3640	0.000	1	123.5995	0.111	2	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[6]CeH)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ce<17>,1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Ce<17>,1|C<4>}	N[6](C[6]N[6]CeH)(C[6]C[6]H){1|C<3>,1|H<1>}	123.1100	0.000	1	123.1100	0.000	1	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[6]MnS)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Mn<7>,1|C<4>}	N[6](C[6]N[6]MnS)(C[6]C[6]H){1|C<3>,1|H<1>}	123.5630	0.000	1	123.5630	0.000	1	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	N[6](C[6]N[6]RuS)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<8>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ru<8>,1|C<4>}	N[6](C[6]N[6]RuS)(C[6]C[6]H){1|C<3>,1|H<1>}	123.6786	1.225	7	123.6786	1.502	7	123.8101	1.047	13	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:1:	4:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]S[6])(O)	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	N[6](S[6]O[6]OO)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]S[6])(O){1|C<4>,1|O<2>,2|O<1>}	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	N[6](S[6]O[6]OO)(C[6]C[6]O){1|C<3>,1|H<1>}	119.7929	0.686	9	119.7929	0.471	9	119.7929	0.471	9	122.1667	4.864	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:2:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:S[6]-2:	C[6](C[6]C[6]N)(N[6]S[6])(Cl)	C[6](C[6]N[6]Cl)2(NC[6a])	N[6](C[6]C[6]Cl)(S[6]N[6])	C[6](C[6]C[6]N)(N[6]S[6])(Cl){1|Cl<1>,1|N<2>}	C[6](C[6]N[6]Cl)2(NC[6a]){1|S<2>}	N[6](C[6]C[6]Cl)(S[6]N[6]){1|C<3>,1|N<2>}	127.0930	1.075	2	127.0930	1.155	2	127.0930	1.155	2	127.0930	1.155	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6]O)(N[6]N[6])(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(OH)	N[6](C[6]C[6]H)(N[6]C[6]H)	C[6](C[6]C[6]O)(N[6]N[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(OH){1|H<1>,1|N<3>}	N[6](C[6]C[6]H)(N[6]C[6]H){1|C<3>,1|H<1>,1|O<2>}	124.1230	0.000	1	124.1230	0.000	1	124.1230	0.000	1	120.0106	23.031	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6])	N[6](N[6]C[6]Pt)(C[6]C[6]H)	C[6](C[6]C[6a]N[6])(N[6]N[6])(H){1|Pt<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	N[6](N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|C<3>}	125.7060	0.000	1	125.7060	0.000	1	125.7060	0.000	1	120.0106	23.031	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	N[6](C[6]C[6]O)(C[6]N[6]2)	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<2>,2|N<3>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]2){1|C<3>,1|N<2>,2|C<4>}	119.3960	0.000	1	119.3960	0.000	1	116.7413	5.355	3	120.0106	23.031	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(O)	C[6](C[6]N[6]O)2(NN)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<3>,2|O<1>}	C[6](C[6]N[6]O)2(NN){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<2>}	115.6780	0.000	1	115.6780	0.000	1	116.7413	5.355	3	120.0106	23.031	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:2:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(O)	C[6](C[6]N[6]O)2(NO)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<3>,2|O<1>}	C[6](C[6]N[6]O)2(NO){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<2>}	115.1500	0.000	1	115.1500	0.000	1	116.7413	5.355	3	120.0106	23.031	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(N[6]C[6]H)(CCC)	N[6](C[6]C[6]Cl)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(Cl){1|C<3>,2|H<1>}	C[6](C[6]N[6]Cl)(N[6]C[6]H)(CCC){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	124.8490	0.000	1	124.8490	0.000	1	124.8490	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]O)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]O){1|C<3>,1|H<1>,2|C<4>,2|O<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	124.2110	0.000	1	124.2110	0.000	1	124.2110	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.8550	0.000	1	122.8550	0.000	1	122.7135	0.014	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6800	0.123	2	122.6663	0.008	3	122.7135	0.014	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6390	0.000	1	122.6663	0.008	3	122.7135	0.014	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6840	0.000	1	122.6840	0.000	1	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4930	0.000	1	122.4483	0.031	3	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4260	0.243	2	122.4483	0.031	3	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5540	0.000	1	121.9392	0.288	5	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.7855	0.476	4	121.9392	0.288	5	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4350	0.000	1	122.4350	0.000	1	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.8960	0.000	1	122.8960	0.000	1	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2955	0.080	2	122.2955	0.006	2	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2050	0.000	1	122.2050	0.000	1	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	124.3010	0.000	1	123.3095	1.966	2	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3180	0.000	1	123.3095	1.966	2	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4575	0.046	2	122.4575	0.002	2	122.4103	0.371	18	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH){2|C<3>}	N[6](C[6]C[6]H)2{3|C<3>}	123.1510	0.000	1	123.1510	0.000	1	122.7616	0.180	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(COO)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|H<1>,2|C<3>}	122.9420	0.000	1	122.9420	0.000	1	122.7616	0.180	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(COO)	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(COO){1|Pt<4>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,2|C<3>}	122.5717	0.463	3	122.5717	0.214	3	122.7616	0.180	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:N[6]-3:	C[6](C[6]C[6]C)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)(N[6]C[6]H)	C[6](C[6]C[6]C)(N[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,1|N<3>}	N[6](C[6]C[6]H)(N[6]C[6]H){1|H<1>,2|C<3>}	123.5920	0.000	1	123.5920	0.000	1	123.5920	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	N[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	N[6](N[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6]C)(N[6]N[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|H<1>,1|N<3>}	N[6](N[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,4|C<3>}	126.6890	0.000	1	126.6890	0.000	1	126.6890	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(NOO)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(NOO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<3>}	125.5593	0.684	3	125.5593	0.467	3	125.5593	0.467	3	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a])(H)	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H)	N[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6a]C[6])(N[6]C[6,6a])(H){1|N<3>,4|C<3>}	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H){2|H<1>,6|C<3>}	N[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H){1|H<1>,4|C<3>}	125.9330	0.000	1	125.9330	0.000	1	125.9330	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]N[6]H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ag<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.1435	0.411	2	122.1435	0.169	2	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5510	0.402	6	122.5510	0.161	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3260	0.000	1	122.3017	0.076	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7130	0.000	1	122.3017	0.076	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.1928	0.234	4	122.3017	0.076	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2545	0.527	4	122.2545	0.278	4	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]N[6]H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	123.0550	0.000	1	123.0550	0.000	1	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3985	0.313	2	122.3985	0.098	2	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	123.3850	0.038	2	123.3850	0.001	2	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4660	0.615	6	122.4660	0.379	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7360	0.027	2	122.7275	0.066	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7233	0.332	4	122.7275	0.066	6	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0987	0.080	3	122.0987	0.006	3	122.4868	0.215	38	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]N)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	123.4247	0.849	6	123.4247	0.720	6	123.4247	0.720	6	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6a]N[6])(N[6]C[6])(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6]C[6]H)2{1|N<3>,2|C<3>}	122.4988	0.871	4	122.4988	0.758	4	122.4988	0.758	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]N[5]N[6])(N[6]C[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H)	N[6](C[6]C[6]Br)(C[6]C[6]H)	C[6](C[6]N[5]N[6])(N[6]C[6])(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H){2|H<1>,3|C<3>}	N[6](C[6]C[6]Br)(C[6]C[6]H){1|H<1>,2|N<3>}	120.8535	0.469	2	120.8535	0.220	2	120.8535	0.220	2	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]O)(C[5]N[5]2)(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[5]N[6])(N[6]C[6,6a])(H){1|O<1>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]O)(C[5]N[5]2)(C[6]N[6]H){2|C<3>,2|C<4>,2|O<1>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	125.1870	0.141	2	125.1870	0.020	2	125.1870	0.020	2	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.7740	0.000	1	121.7740	0.000	1	122.1343	0.207	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.8440	0.000	1	121.8440	0.000	1	122.1343	0.207	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]N[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.1470	0.000	1	122.1470	0.000	1	122.1343	0.207	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]N[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7720	0.000	1	122.7720	0.000	1	122.1343	0.207	4	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Bi)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.2550	1.564	2	121.2550	2.446	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6830	0.000	1	122.6830	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.4750	0.205	2	122.4750	0.042	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.8660	0.000	1	121.8660	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2031	1.457	15	122.1697	1.662	20	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO){2|C<3>}	N[6](C[6]C[6]H)2{1|N<3>,2|C<3>}	122.0696	0.674	5	122.1697	1.662	20	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.4713	0.189	3	122.4713	0.036	3	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CNN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.8225	0.411	2	121.8225	0.169	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.8950	0.049	2	121.8950	0.002	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	123.1688	0.736	5	123.1688	0.541	5	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	123.6300	0.000	1	123.6300	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.6905	0.245	2	122.6905	0.060	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	123.8790	0.000	1	123.8790	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5770	0.000	1	122.6898	0.157	4	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.7273	0.476	3	122.6898	0.157	4	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CNN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.7362	1.092	5	121.7362	1.192	5	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2420	0.000	1	122.2420	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	123.0744	0.539	5	123.0744	0.290	5	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2915	0.573	2	122.2915	0.329	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0875	0.340	2	122.0875	0.116	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.2820	0.000	1	122.2820	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	118.3795	5.216	2	118.3795	27.210	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(CNO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.0770	0.560	2	122.0770	0.314	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	124.0610	1.380	2	124.0610	1.905	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.8820	1.252	2	121.8820	1.566	2	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.9165	0.312	4	122.0864	0.108	7	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.3130	0.206	3	122.0864	0.108	7	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.5000	0.000	1	122.8456	0.077	5	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.9320	0.230	4	122.8456	0.077	5	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.3690	0.000	1	122.3690	0.000	1	122.3022	1.609	83	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Co<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.5210	0.000	1	123.5210	0.000	1	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.4540	0.526	2	123.0717	0.349	4	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	122.6895	0.432	2	123.0717	0.349	4	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	124.4410	0.000	1	124.4410	0.000	1	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Ni<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.0520	0.000	1	123.0520	0.000	1	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	123.4765	0.641	2	123.4765	0.411	2	123.3616	0.389	9	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	121.4850	0.649	2	121.4850	0.421	2	121.9904	0.333	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.2425	0.125	2	122.2425	0.016	2	121.9904	0.333	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>}	122.4970	0.000	1	122.4970	0.000	1	121.9904	0.333	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(NCH)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]N)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(NCH){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	121.4110	0.000	1	121.4110	0.000	1	121.4110	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H){1|Re<6>,4|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2){1|H<1>,1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	121.2846	0.347	5	121.2846	0.120	5	121.2846	0.120	5	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]2)(N[6]C[6])(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ir)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]2)(N[6]C[6])(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ir)(C[6]N[6]H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	N[6](C[6]C[6]H)2{1|H<1>,2|N<3>}	121.8190	0.000	1	121.8190	0.000	1	121.7540	0.007	3	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]2)(N[6]C[6])(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]2)(N[6]C[6])(H){1|Re<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]N[6]H){1|C<3>,1|C<4>,2|H<1>,3|N<3>}	N[6](C[6]C[6]H)2{3|N<3>}	121.7215	0.083	2	121.7215	0.007	2	121.7540	0.007	3	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:O-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6])(O)	C[6](C[5a]C[5a]O[5a])(C[6]N[6]H)(C[6]N[6]O)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[5a]C[6])(N[6]C[6])(O){1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>}	C[6](C[5a]C[5a]O[5a])(C[6]N[6]H)(C[6]N[6]O){1|C<4>,1|H<1>,3|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<4>,2|C<3>}	114.8800	0.000	1	114.8800	0.000	1	114.8800	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(O)	C[6](C[6]N[6]O)2(CNN)	N[6](C[6]C[6]O)(C[6]N[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(O){1|O<1>,2|N<3>}	C[6](C[6]N[6]O)2(CNN){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]N){1|H<1>,2|C<3>}	121.4040	0.000	1	121.4040	0.000	1	121.4040	0.000	1	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(O)	C[6](C[6]N[6]O)2(NOO)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<2>,2|O<1>}	C[6](C[6]N[6]O)2(NOO){1|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|N<3>}	114.1105	0.387	2	114.3735	0.396	6	114.3735	0.396	6	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(O)	C[6](C[6]N[6]O)2(NOO)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<3>,2|O<1>}	C[6](C[6]N[6]O)2(NOO){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<3>}	114.5050	0.735	4	114.3735	0.396	6	114.3735	0.396	6	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:S-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(S)	C[6](C[6]N[6]C)(C[6]N[6]S)(CCO)	N[6](C[6]C[6a]N[6])(C[6]C[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(S){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]S)(CCO){1|C<3>,1|C<4>}	N[6](C[6]C[6a]N[6])(C[6]C[6]S){1|C<4>,4|C<3>}	117.9070	0.000	1	117.9070	0.000	1	117.6570	0.125	2	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	3:3:	C[6]-3:N[6]-2:S-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(S)	C[6](C[6]N[6]C)(C[6]N[6]S)(COO)	N[6](C[6]C[6a]N[6])(C[6]C[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(S){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]S)(COO){1|C<3>,1|C<4>}	N[6](C[6]C[6a]N[6])(C[6]C[6]S){1|C<4>,4|C<3>}	117.4070	0.000	1	117.4070	0.000	1	117.6570	0.125	2	122.2120	3.697	207	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:3:	4:3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	N[6](C[6]N[6]CC)(C[6]C[6]H)	C[6](C[6]C[6a]C[6])(N[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|C<4>,2|H<1>,3|C<3>}	N[6](C[6]N[6]CC)(C[6]C[6]H){3|C<3>}	125.8750	0.000	1	125.8750	0.000	1	125.8750	0.000	1	125.8750	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	2:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	O[6]-2:C[6]-3:	C[6](C[6]C[6]C)(N[6]O[6])(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3)	N[6](O[6]C[6,6])(C[6]C[6]H)	C[6](C[6]C[6]C)(N[6]O[6])(H){1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3){1|O<2>,2|C<4>}	N[6](O[6]C[6,6])(C[6]C[6]H){1|C<3>,3|C<4>}	125.3520	0.000	1	125.3520	0.000	1	125.3520	0.000	1	125.3520	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(CCCH)	N[6](C[6]C[6]Cl)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(Cl){1|N<3>,2|O<1>}	C[6](C[6]N[6]Cl)(C[6]N[6]O)(CCCH){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]N[6]O){1|C<3>,1|C<4>,1|H<1>}	129.0200	0.287	2	129.0200	0.082	2	128.9223	0.203	4	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(Cl)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(CCHH)	N[6](C[6]C[6]Cl)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(Cl){1|N<3>,2|O<1>}	C[6](C[6]N[6]Cl)(C[6]N[6]O)(CCHH){1|C<3>,1|H<1>}	N[6](C[6]C[6]Cl)(C[6]N[6]O){1|C<3>,1|C<4>,1|H<1>}	128.8245	0.698	2	128.8245	0.487	2	128.9223	0.203	4	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO){1|C<3>,1|O<2>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<2>}	119.6590	0.000	1	119.6590	0.000	1	122.9094	3.892	5	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|C<4>,1|H<1>}	123.7660	0.000	1	123.7660	0.000	1	122.9094	3.892	5	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|Zn<5>,1|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|Zn<5>,1|C<3>,1|C<4>}	123.1250	0.570	2	123.1250	0.325	2	122.9094	3.892	5	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CN[5]HH)	N[6](C[6]C[6]H)(C[6]N[6]C)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CN[5]HH){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|C<4>,1|H<1>}	124.8720	0.000	1	124.8720	0.000	1	122.9094	3.892	5	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|N<3>,2|C<4>}	122.0060	0.273	2	122.8425	0.587	6	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	123.2608	0.503	4	122.8425	0.587	6	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|N<3>,2|C<4>}	122.5485	0.441	2	122.9040	0.235	4	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP){1|C<3>,1|C<4>}	N[6](C[6]C[6]H)2{1|N<3>,2|C<4>}	123.2595	0.073	2	122.9040	0.235	4	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	123.8960	0.000	1	123.8960	0.000	1	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(CRuCH)	N[6](C[6]C[6]H)2	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(CRuCH){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	123.0650	0.000	1	123.0650	0.000	1	122.9693	0.420	12	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	3:3:4:	3:3:	C[6]-3:N[6]-2:O-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(O)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(O){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|C<3>,1|C<4>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|C<3>,2|C<4>}	115.6868	0.463	6	115.6868	0.215	6	115.6868	0.215	6	122.2218	17.952	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[3,6]H)(N[6]C[6])(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H)	N[6](C[6]C[3,6]C[6a])(C[6]C[6]H)	C[6](C[6]C[3,6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H){1|C<4>,3|C<3>}	N[6](C[6]C[3,6]C[6a])(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	124.1730	0.000	1	124.1730	0.000	1	124.1730	0.000	1	123.7755	0.316	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:1:	3:3:	C[6]-3:N[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H)	N[6](C[6]C[6,6]H)(C[6]C[6]H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	N[6](C[6]C[6,6]H)(C[6]C[6]H){1|Mo<9>,1|H<1>,2|C<4>}	123.3780	0.000	1	123.3780	0.000	1	123.3780	0.000	1	123.7755	0.316	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:2:	C[6]-3:N[6]-2:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:C[6]-2:	C[6](C[6]C[5,6]C[6])(N[6]C[6])(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H)	N[6](C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[5,6]C[6])(N[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]){1|C<3>,1|C<4>,1|H<1>}	124.4460	0.000	1	124.4460	0.000	1	124.4460	0.000	1	124.4460	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Cu<6>,1|C<3>,2|C<4>,2|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Cu<6>,1|C<3>,1|C<4>}	123.8890	0.000	1	123.2158	0.165	5	123.2158	0.165	5	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Ni<6>,1|C<3>,2|C<4>,2|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|C<3>,1|C<4>}	122.9627	0.056	3	123.2158	0.165	5	123.2158	0.165	5	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	N[6](C[6]C[6]H)(C[6]N[6]H)	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Zn<6>,1|C<3>,2|C<4>,2|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,1|C<3>,1|C<4>}	123.3020	0.000	1	123.2158	0.165	5	123.2158	0.165	5	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]N[6]H){1|C<3>,2|C<4>,2|H<1>}	N[6](C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>}	123.4950	1.247	3	123.4950	1.555	3	123.4950	1.555	3	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O)	N[6](C[6]C[6]H)(C[6]N[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>,1|S<1>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O){3|C<3>}	N[6](C[6]C[6]H)(C[6]N[6]S){1|C<3>,1|C<4>}	122.3620	0.000	1	122.3620	0.000	1	122.7305	0.272	2	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]HH)(C[6]N[6]H)(COO)	N[6](C[6]C[6]H)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]N[6]O){1|C<3>,1|C<4>,1|H<1>}	123.0990	0.000	1	123.0990	0.000	1	122.7305	0.272	2	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:1:	4:3:3:	3:3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H)	N[6](C[6]C[6]H)2	C[6](C[6]C[6a]C[6])(N[6]C[6])(H){1|Ni<5>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H){1|H<1>,1|P<4>,4|C<3>}	N[6](C[6]C[6]H)2{1|Ni<5>,1|C<4>,2|C<3>}	124.3400	0.000	1	124.3400	0.000	1	124.3400	0.000	1	123.3059	0.592	11	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:2:2:	3:2:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-2:S-2:	C[6]-3:C[6]-2:	C[6](C[6]N[6]S)(N[6]C[6])(SNi)	C[6](C[6]N[6]S)(N[6]C[6])(SNi)	N[6](C[6]C[6]S)(C[6]C[6])	C[6](C[6]N[6]S)(N[6]C[6])(SNi){1|C<2>}	C[6](C[6]N[6]S)(N[6]C[6])(SNi){1|C<2>}	N[6](C[6]C[6]S)(C[6]C[6]){1|N<2>,1|S<2>}	121.4938	1.145	10	121.4938	1.311	10	121.4938	1.311	10	121.4938	1.311	10	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:2:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:C[6]-2:S-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6])(SNi)	C[6](C[6]N[6]S)(C[6]C[6])(SNi)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]C[6]S)(N[6]C[6])(SNi){1|C<3>,1|H<1>}	C[6](C[6]N[6]S)(C[6]C[6])(SNi){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|C<2>,1|H<1>,1|S<2>}	121.7580	0.000	1	121.7580	0.000	1	121.7580	0.000	1	121.7580	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:2:	C[6]-3:N[6]-2:C-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CC)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CC){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,2|H<1>}	122.8210	0.000	1	122.8210	0.000	1	122.8210	0.000	1	122.8210	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CN)	C[6](N[6]C[6]Ag)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CN){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.6885	0.258	2	122.6885	0.067	2	122.6885	0.067	2	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	121.7570	0.000	1	121.7570	0.000	1	121.5653	0.031	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	121.5250	0.000	1	121.5250	0.000	1	121.5653	0.031	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	121.4140	0.000	1	121.4140	0.000	1	121.5653	0.031	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(OC)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]O)	C[6](C[6]C[6,6]H)(N[6]C[6])(OC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]O){1|B<4>,1|C<3>,1|H<1>}	123.4770	0.468	3	123.4520	0.149	4	123.4520	0.149	4	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(OC)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]O)	C[6](C[6]C[6,6]H)(N[6]C[6])(OC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,3|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]O){1|B<4>,1|C<3>,1|H<1>}	123.3770	0.000	1	123.4520	0.149	4	123.4520	0.149	4	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OC)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]N){1|C<3>,2|H<1>}	124.2708	0.511	6	124.2151	0.239	7	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OC)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|Mn<9>,1|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]N){1|Mn<9>,1|C<3>,1|H<1>}	123.8810	0.000	1	124.2151	0.239	7	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OC)	C[6](C[6]N[6]O)2(H)	N[6](C[6]C[6]O)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|O<2>,2|N<3>}	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]N){1|C<3>,2|H<1>}	125.1872	0.328	21	125.1872	0.108	21	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OC)	C[6](C[6]N[6]O)2(H)	N[6](C[6]C[6]O)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|N<3>,1|O<2>,1|S<2>}	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]S){1|C<3>,2|H<1>}	124.5160	0.000	1	124.5160	0.000	1	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OH)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)(C[6]N[6]S){1|C<3>,2|H<1>}	122.3690	0.000	1	122.3690	0.000	1	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OH)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]N[5a]N[6])(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]N[5a]N[6])(C[6]C[6]O){1|N<3>,2|C<3>,2|H<1>}	122.8710	0.074	2	122.8710	0.005	2	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(OH)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]S){1|Pd<4>,1|C<3>,1|H<1>}	113.3010	0.000	1	113.3010	0.000	1	124.3747	4.651	33	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(OC)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	N[6](N[6]C[6]Pd)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]N[6])(OC){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){2|N<3>}	N[6](N[6]C[6]Pd)(C[6]C[6]O){1|C<3>,1|H<1>,1|N<3>}	124.2890	0.000	1	124.2890	0.000	1	120.5767	15.104	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(OC)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	N[6](N[6]C[6]Re)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]N[6])(OC){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cl<1>,1|N<3>}	N[6](N[6]C[6]Re)(C[6]C[6]O){1|Cl<1>,1|C<3>,1|H<1>}	120.9040	0.000	1	120.9040	0.000	1	120.5767	15.104	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(OH)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	N[6](N[6]C[6]Ni)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]N[6])(OH){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Ni)(C[6]C[6]O){1|H<1>,2|C<3>}	116.5370	0.000	1	116.5370	0.000	1	120.5767	15.104	3	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(OC)	C[6](N[6]C[6]Co)(C[6]N[6]O)(H)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]N[6]H)(N[6]C[6])(OC){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>}	123.0630	0.000	1	123.0630	0.000	1	123.3425	0.375	8	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(OC)	C[6](N[6]C[6]Mn)(C[6]N[6]O)(H)	N[6](C[6]C[6]H)(C[6]C[6]O)	C[6](C[6]N[6]H)(N[6]C[6])(OC){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>}	122.8950	0.000	1	122.8950	0.000	1	123.3425	0.375	8	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:O-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(OC[6a])	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H)	N[6](C[6]C[6]O)2	C[6](C[6]N[6]H)(N[6]C[6])(OC[6a]){1|Cu<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]O)2{1|N<3>,2|H<1>}	123.4637	0.673	6	123.4637	0.452	6	123.3425	0.375	8	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:S-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(SC)	C[6](N[6]C[6]Co)(C[6]N[6]S)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(SC){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	121.6880	0.000	1	121.6880	0.000	1	121.8270	0.039	2	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:S-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a])	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a]){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	121.9660	0.000	1	121.9660	0.000	1	121.8270	0.039	2	123.6431	4.637	55	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	4:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]S[6])(OH)	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	N[6](S[6]O[6]OO)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]S[6])(OH){1|C<4>,1|O<2>,2|O<1>}	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	N[6](S[6]O[6]OO)(C[6]C[6]O){1|C<3>,1|H<1>}	123.9660	0.000	1	123.9660	0.000	1	121.9895	7.813	2	121.9895	7.813	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:1:	4:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]S[6])(ONi)	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	N[6](S[6]O[6]OO)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]S[6])(ONi){1|C<4>,1|O<2>,2|O<1>}	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	N[6](S[6]O[6]OO)(C[6]C[6]O){1|C<3>,1|H<1>}	120.0130	0.000	1	120.0130	0.000	1	121.9895	7.813	2	121.9895	7.813	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:C[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6])(SNi)	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]C[6]S)(N[6]C[6])(SNi){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi){1|C<3>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|C<3>,1|S<2>}	122.0790	0.000	1	122.0790	0.000	1	122.0790	0.000	1	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SNi)	C[6](C[6]N[6]S)(N[6]C[6]H)(SNi)	N[6](C[6]C[6]C)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SNi){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SNi){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]C[6]S){1|C<4>,1|N<3>,1|S<2>}	121.8160	0.000	1	121.8160	0.000	1	121.8824	0.544	8	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SNi)	C[6](C[6]N[6]S)(N[6]C[6]H)(SNi)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SNi){1|C<3>,2|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SNi){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<2>}	121.9695	0.709	4	121.9695	0.503	4	121.8824	0.544	8	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SPd)	C[6](C[6]N[6]S)(N[6]C[6]H)(SPd)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SPd){1|C<3>,2|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SPd){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<2>}	121.0260	0.000	1	121.0260	0.000	1	121.8824	0.544	8	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SPt)	C[6](C[6]N[6]S)(N[6]C[6]H)(SPt)	N[6](C[6]C[6]C)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SPt){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SPt){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]C[6]S){1|C<4>,1|N<3>,1|S<2>}	121.3420	0.000	1	121.3420	0.000	1	121.8824	0.544	8	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:2:	3:3:	C[6]-3:N[6]-2:S-2:	C[6]-3:N[6]-3:S-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SPt)	C[6](C[6]N[6]S)(N[6]C[6]H)(SPt)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SPt){1|C<3>,2|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SPt){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<2>}	122.9970	0.000	1	122.9970	0.000	1	121.8824	0.544	8	121.9042	0.481	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(CN)	C[6](C[6]N[6]C)(C[6]N[6]N)(NHH)	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]N)(N[6]C[6])(CN){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]N)(NHH){1|C<3>,1|O<2>}	N[6](C[6]C[6]C)(C[6]N[6]H){1|C<3>,1|N<3>,1|O<2>}	124.8080	0.000	1	124.8080	0.000	1	124.8080	0.000	1	124.0280	1.217	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:2:	3:3:3:	3:3:	C[6]-3:N[6]-2:O-2:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]2)(N[6]C[6])(OC)	C[6](C[6]C[6]N[6])(C[6]N[6]Ir)(C[6]N[6]O)	N[6](C[6]C[6]O)(C[6]N[6]O)	C[6](C[6]C[6]2)(N[6]C[6])(OC){1|Ir<6>,1|C<3>,1|O<2>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]Ir)(C[6]N[6]O){2|H<1>,3|C<3>}	N[6](C[6]C[6]O)(C[6]N[6]O){1|H<1>,2|C<3>}	123.2480	0.000	1	123.2480	0.000	1	123.2480	0.000	1	124.0280	1.217	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:2:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-2:O-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6])(CNO)	C[6](C[6]N[6]C)(C[6]N[6])(OH)	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]O)(N[6]C[6])(CNO){1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6])(OH){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]N[6]C){1|C<2>,1|C<4>,1|O<2>}	122.5340	0.000	1	122.5340	0.000	1	122.5340	0.000	1	123.1830	0.842	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:2:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:S[6]-2:N-2:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]S[6]N)	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(NC[6a])	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]S[6]N){2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(NC[6a]){4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<2>,1|S<2>,4|C<3>}	123.8320	0.000	1	123.8320	0.000	1	123.8320	0.000	1	123.1830	0.842	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	2:3:	C[6]-3:N[6]-2:C-3:	C[6a]-3:O[6]-2:C[6]-3:	N[6]-2:C[6]-3:	C[6](C[6]C[6a]O[6])(N[6]N[6])(COO)	C[6](C[6a]C[6a]2)(O[6]Si[5,6])(C[6]N[6]C)	N[6](N[6]Si[5,6])(C[6]C[6]C)	C[6](C[6]C[6a]O[6])(N[6]N[6])(COO){1|Si<4>,2|C<3>}	C[6](C[6a]C[6a]2)(O[6]Si[5,6])(C[6]N[6]C){1|N<2>,2|C<3>,2|C<4>,2|H<1>}	N[6](N[6]Si[5,6])(C[6]C[6]C){1|C<3>,1|O<2>,2|C<4>}	125.5730	0.000	1	125.5730	0.000	1	125.5730	0.000	1	125.5730	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	3:3:	C[5a]-3:N[6]-2:C[6]-3:	C[6]-3:S[6]-2:C-3:	N[5a,6]-3:C[6]-3:	C[6](C[5a]C[5a]S[5a])(N[6]N[5a,6])(C[6]S[6]C)	C[6](C[6]C[5a]N[6])(S[6]C[5a,6])(CC[6a]H)	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[5a]C[6])	C[6](C[5a]C[5a]S[5a])(N[6]N[5a,6])(C[6]S[6]C){1|H<1>,4|C<3>}	C[6](C[6]C[5a]N[6])(S[6]C[5a,6])(CC[6a]H){1|C<3>,1|N<2>,1|N<3>,1|S<2>}	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[5a]C[6]){1|C<4>,2|C<3>,2|N<2>,2|S<2>}	125.5310	0.000	1	125.5310	0.000	1	125.5310	0.000	1	120.9944	14.571	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CHH){1|C<3>,1|C<4>}	C[6](C[6]N[6]C)(N[6]C[6])(CHH){2|C<3>}	N[6](C[6]C[6]C)2{1|N<2>,2|C<3>}	120.6730	0.000	1	120.4775	0.076	2	120.4775	0.076	2	120.9944	14.571	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CHH){2|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CHH){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|C<3>,1|C<4>,1|N<2>}	120.2820	0.000	1	120.4775	0.076	2	120.4775	0.076	2	120.9944	14.571	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	3:3:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-2:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){1|N<2>,1|N<3>,2|H<1>,3|C<3>}	118.3155	0.160	4	118.3155	0.026	4	118.3155	0.026	4	120.9944	14.571	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:3:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:S[6]-2:C-3:	N[5a,6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]N[5a,6])(C[6]S[6]C)	C[6](C[6]C[6a]N[6])(S[6]C[5a,6])(CCH)	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]N[5a,6])(C[6]S[6]C){2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(S[6]C[5a,6])(CCH){1|N<2>,1|N<3>,2|C<3>}	N[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6a]C[6]){1|S<2>,2|N<2>,4|C<3>}	128.2070	0.000	1	128.2070	0.000	1	128.2070	0.000	1	120.9944	14.571	8	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CHH){2|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|C<3>}	N[6](C[6]C[6]C)2{1|C<3>,1|C<4>,1|N<2>}	120.1650	0.000	1	120.1650	0.000	1	120.1650	0.000	1	121.0175	1.454	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:2:4:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(C[6]N[6])(CHHO)	N[6](C[6]C[6]N)(C[6]N[6]O)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|N<3>,1|O<1>}	C[6](C[6]N[6]N)(C[6]N[6])(CHHO){1|C<3>,1|C<4>}	N[6](C[6]C[6]N)(C[6]N[6]O){1|C<2>,2|C<4>}	121.8700	0.000	1	121.8700	0.000	1	121.8700	0.000	1	121.0175	1.454	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CCH)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CCH){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ti<10>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	121.0445	0.893	2	121.0445	0.798	2	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CHH)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]C[6]H)(N[6]C[6])(CHH){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|C<3>,2|H<1>}	120.4555	0.169	2	120.4555	0.029	2	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CHH)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CHH){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	121.0780	0.000	1	121.0780	0.000	1	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CHO)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]C[6]H)(N[6]C[6])(CHO){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|C<3>,2|H<1>}	122.1160	0.180	2	122.1160	0.032	2	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(COO)	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|O<1>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|C<3>,2|H<1>}	120.1195	0.037	2	120.1195	0.001	2	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	122.5140	0.537	2	122.5140	0.289	2	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	N[6](C[6]C[6]C)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|N<3>,2|O<1>}	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]O){1|C<3>,2|H<1>}	121.9350	0.000	1	121.9350	0.000	1	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(COO)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|Mg<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]H){1|Mg<6>,1|C<3>,1|H<1>}	121.7000	0.000	1	121.7000	0.000	1	121.3240	0.865	13	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CN[6]O)	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(CN[6]O){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]C)(H){2|N<3>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.9870	0.000	1	122.9870	0.000	1	122.9870	0.000	1	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CNN)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](N[6]C[6]Ni)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]N[6])(CNN){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Ni)(C[6]C[6]C){1|H<1>,2|C<3>}	122.7337	0.401	3	122.7337	0.161	3	122.9132	0.189	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(COO)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](N[6]C[6]Ni)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]N[6])(COO){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	N[6](N[6]C[6]Ni)(C[6]C[6]C){1|H<1>,2|C<3>}	123.1825	0.439	2	123.1825	0.193	2	122.9132	0.189	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CCH)	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CCH){1|C<3>,2|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	119.8170	0.000	1	119.8170	0.000	1	121.2853	1.928	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.5770	0.000	1	122.5770	0.000	1	121.2853	1.928	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|C<3>,2|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	121.4620	0.000	1	121.4620	0.000	1	121.2853	1.928	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]O)(N[6]C[6])(CC[6a]H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O)	N[6](C[6]C[5,6]O)(C[6]C[6]C)	C[6](C[6]N[5,6]O)(N[6]C[6])(CC[6a]H){1|C<3>,1|C<4>,1|O<1>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[6]C)(O){1|C<4>,1|S<2>,3|C<3>}	N[6](C[6]C[5,6]O)(C[6]C[6]C){1|C<4>,1|N<3>,1|O<1>,1|S<2>}	116.8950	0.000	1	116.8950	0.000	1	116.8950	0.000	1	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CCH)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CCH){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	119.9645	0.077	2	119.9645	0.006	2	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CCN)	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CCN){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	121.4370	0.000	1	121.4370	0.000	1	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	C[6](N[6]C[6]Au)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Au<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.4080	0.000	1	122.4080	0.000	1	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.5310	0.000	1	122.5310	0.000	1	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	122.2037	1.450	6	122.2037	2.104	6	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(COO)	C[6](N[6]C[6]Hg)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	121.9110	0.352	4	121.9110	0.124	4	121.8114	1.407	15	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|N<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){1|N<2>,1|N<3>,2|H<1>,3|C<3>}	122.6220	0.021	4	122.4772	0.105	5	122.4772	0.105	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|N<3>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){2|H<1>,2|N<3>,3|C<3>}	121.8980	0.000	1	122.4772	0.105	5	122.4772	0.105	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]N)	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]N){1|B<4>,1|C<3>,1|H<1>}	120.8620	0.000	1	120.4375	0.360	2	120.4217	0.181	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]N)	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,3|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]N){1|B<4>,1|C<3>,1|H<1>}	120.0130	0.000	1	120.4375	0.360	2	120.4217	0.181	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(NC[6a]H)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	N[6](C[6]N[6,6]H)(C[6]C[6]N)	C[6](C[6]C[6,6]H)(N[6]C[6])(NC[6a]H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	N[6](C[6]N[6,6]H)(C[6]C[6]N){1|B<4>,1|C<3>,1|H<1>}	120.3900	0.000	1	120.3900	0.000	1	120.4217	0.181	3	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(NHH)	C[6](C[6]N[6]C)(C[6]N[6]N)(Cl)	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](C[6]C[6]Cl)(N[6]C[6])(NHH){1|N<3>,2|C<4>}	C[6](C[6]N[6]C)(C[6]N[6]N)(Cl){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]C){1|Cl<1>,1|C<3>,1|H<1>}	119.9675	0.139	2	119.9675	0.019	2	119.9675	0.019	2	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NCN)	C[6](C[6]N[6]N)2(H)	N[6](C[6]C[6]N)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(NCN){1|H<1>,2|N<3>}	C[6](C[6]N[6]N)2(H){1|Mn<5>,1|C<3>}	N[6](C[6]C[6]N)(C[6]N[6]H){1|Mn<5>,1|C<3>,1|H<1>}	122.4170	0.000	1	122.4170	0.000	1	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]C)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]N)2	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]C){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N[6](C[6]C[6]N)2{1|C<3>,3|H<1>}	122.5120	0.000	1	122.5120	0.000	1	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]H)	C[6](C[6]N[6]N)2(H)	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]H){1|C<4>,2|N<3>}	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,2|H<1>}	122.7020	0.000	1	122.7020	0.000	1	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,1|C<4>,1|H<1>}	121.0335	0.016	2	121.3990	0.216	9	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,2|H<1>}	121.5034	0.481	7	121.3990	0.216	9	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N[6](C[6]C[6]N)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]O){1|C<3>,2|H<1>}	121.5617	0.464	3	121.5617	0.215	3	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)2(H)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|N<2>,2|N<3>}	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,2|H<1>}	122.4900	0.000	2	122.6253	0.131	6	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)2(H)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){3|N<3>}	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,2|H<1>}	122.6930	0.447	4	122.6253	0.131	6	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)2(H)	N[6](C[6]C[6]N)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|S<1>,2|N<3>}	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]S){1|C<3>,2|H<1>}	122.8880	0.276	4	122.8880	0.076	4	122.0884	0.546	25	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(N[6]C[6]C)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]N)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	121.2223	0.564	3	121.2223	0.318	3	120.8328	0.530	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(N[6]C[6]H)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|C<3>,2|H<1>}	C[6](C[6]N[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	120.2485	0.586	2	120.2485	0.344	2	120.8328	0.530	5	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:S-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(NC[6]H)	C[6](C[6]N[6]N)(N[6]C[6]H)(S)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]S)(N[6]C[6])(NC[6]H){1|C<3>,2|H<1>}	C[6](C[6]N[6]N)(N[6]C[6]H)(S){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|H<1>,1|N<3>,1|S<1>}	124.4330	0.000	1	124.4330	0.000	1	124.4330	0.000	1	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NCC)	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NCC){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	120.4270	0.000	1	120.4270	0.000	1	120.5260	0.120	9	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	C[6](N[6]C[6]Co)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	120.5302	0.424	5	120.5302	0.180	5	120.5260	0.120	9	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	120.4525	0.412	2	120.4525	0.170	2	120.5260	0.120	9	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|N<3>,2|H<1>}	120.7510	0.000	1	120.7510	0.000	1	120.5260	0.120	9	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]H)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H)	N[6](C[5a,6]N[5a,6]2)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H){1|N<2>,5|C<3>}	N[6](C[5a,6]N[5a,6]2)(C[6]C[6a]C[6]){1|H<1>,1|N<2>,5|C<3>}	122.0675	1.220	2	122.0675	1.488	2	122.0675	1.488	2	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:C[6]-3:O-1:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]C[6]O)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]O)(O)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]C[6]O){1|O<1>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]O)(O){4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|O<1>,5|C<3>}	121.7840	0.000	1	121.7840	0.000	1	121.7840	0.000	1	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a])(C[6]N[6]H)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Pt)(H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a])(C[6]N[6]H){1|Pt<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Pt)(H){1|N<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|N<2>,1|N<3>,2|H<1>,3|C<3>}	121.6560	0.000	1	121.6560	0.000	1	121.6560	0.000	1	121.6238	1.416	92	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6])(COO)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]N[6]C)(H)	N[6](C[6]N[5a,6]C[6a]H)(C[6]C[6]C)	C[6](C[6]C[5a,6]H)(N[6]C[6])(COO){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]N[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	N[6](C[6]N[5a,6]C[6a]H)(C[6]C[6]C){1|H<1>,4|C<3>}	121.7595	0.323	2	121.7595	0.104	2	121.7595	0.104	2	122.9288	0.789	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	4:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)2(H)	N[6](C[6]N[6]RuS)(C[6]C[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|Ru<7>,1|S<2>,2|N<3>}	C[6](C[6]N[6]N)2(H){1|Ru<7>,1|C<4>}	N[6](C[6]N[6]RuS)(C[6]C[6]N){1|C<3>,1|H<1>}	122.5850	0.000	1	122.5850	0.000	1	122.5850	0.000	1	122.9288	0.789	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	4:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,2|C<3>,2|C<4>}	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6a]C[6]){1|H<1>,1|N<2>,2|C<4>,3|C<3>}	123.5925	0.679	4	123.3758	0.431	6	123.3758	0.431	6	122.9288	0.789	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:1:	4:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,2|C<3>,2|C<4>}	N[6](C[5,6]C[5,6]2Ru)(C[6]C[6a]C[6]){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	122.9425	0.455	2	123.3758	0.431	6	123.3758	0.431	6	122.9288	0.789	9	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:C-3:	C[6,6a]-3:C[6]-3:O-2:	N[6]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(N[6]N[6])(COO)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(ORu)	N[6](N[6]C[6,6a]C)(C[6]C[6]C)	C[6](C[6]C[6,6a]O)(N[6]N[6])(COO){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(ORu){1|H<1>,1|N<3>,2|C<3>}	N[6](N[6]C[6,6a]C)(C[6]C[6]C){1|O<2>,2|C<3>}	122.3620	0.048	2	122.3620	0.002	2	122.3620	0.002	2	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:O-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6])(CHH)	C[6](C[6]C[6]C)(C[6]N[6]C)(OFe)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]O)(N[6]C[6])(CHH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]C)(OFe){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<2>}	117.0660	0.000	1	117.0660	0.000	1	117.0660	0.000	1	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(C[6]N[6]O)(NN)	N[6](C[6]C[6]N)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<3>,2|O<1>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NN){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<2>}	123.1940	0.000	1	123.1940	0.000	1	122.4083	0.836	3	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	N[6](C[6]C[6]N)(C[6]N[6]2)	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>}	N[6](C[6]C[6]N)(C[6]N[6]2){1|C<3>,1|N<2>,2|C<4>}	121.4050	0.000	1	121.4050	0.000	1	122.4083	0.836	3	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	N[6](C[6]C[6]N)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<3>,2|O<1>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>,1|C<4>}	N[6](C[6]C[6]N)(C[6]N[6]O){1|C<3>,1|C<4>,1|N<2>}	122.6260	0.000	1	122.6260	0.000	1	122.4083	0.836	3	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6])(NHH)	C[6](C[6a]C[6a]2)(C[6]N[6]N)(N[6]N[6])	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6a]N[6])(N[6]C[6])(NHH){2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]N)(N[6]N[6]){1|Cl<1>,2|H<1>,3|C<3>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,1|H<1>,1|N<2>}	120.4574	0.571	21	120.4574	0.326	21	120.4574	0.326	21	120.6896	1.420	27	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:2:	4:3:	C[6]-3:N[6]-2:C-3:	C[6,6a]-3:C[6]-3:O-2:	S[6]-4:C[6]-3:	C[6](C[6]C[6,6a]O)(N[6]S[6])(COO)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(OH)	N[6](S[6]C[6,6a]OO)(C[6]C[6]C)	C[6](C[6]C[6,6a]O)(N[6]S[6])(COO){2|C<3>,2|O<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(OH){1|H<1>,1|S<4>,2|C<3>}	N[6](S[6]C[6,6a]OO)(C[6]C[6]C){1|O<2>,2|C<3>}	124.2590	0.000	1	124.2590	0.000	1	124.2590	0.000	1	124.2590	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(C[6]O[6]N)(NC[6a]H)	N[6](C[6]C[6a]O[6])(C[6]C[6]C)	C[6](C[6]C[6]N)(N[6]C[6])(COO){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]N[6]C)(C[6]O[6]N)(NC[6a]H){1|C<3>}	N[6](C[6]C[6a]O[6])(C[6]C[6]C){1|N<3>,3|C<3>}	122.6220	0.000	1	122.6220	0.000	1	122.6220	0.000	1	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(COO)	C[6](C[6]N[6]C)(N[6]C[6]H)(NHH)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]N)(N[6]C[6])(COO){1|C<3>,2|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|H<1>,2|N<3>}	121.8869	0.390	8	121.8869	0.152	8	121.8869	0.152	8	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CNO)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(CNO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CNO){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(CNO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	122.2840	0.000	2	122.2840	0.000	2	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Co)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]C)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.3843	0.480	3	121.3843	0.230	3	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.6120	0.000	1	121.6120	0.000	1	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Fe)(C[6]N[6]C)(COO)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Fe<6>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]N[6]C)(COO){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|N<2>,1|N<3>,3|C<3>}	120.3910	0.000	1	120.3910	0.000	1	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Mn)(C[6]N[6]C)(COO)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]C)(COO){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|N<2>,1|N<3>,3|C<3>}	120.2230	0.000	1	120.2230	0.000	1	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Ni)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]C)(COO){2|C<3>}	N[6](C[6]C[6]C)2{1|N<3>,2|C<3>}	119.9875	0.175	2	119.9875	0.031	2	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Pd)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]C)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.5800	0.000	1	120.5800	0.000	1	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(COO)	C[6](N[6]C[6]Pt)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(COO){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]C)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.4050	0.000	1	121.4050	0.000	1	121.0756	0.718	12	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	C[6](C[6]N[6]N)(C[6]N[6]O)(NOO)	N[6](C[6]C[6]N)(C[6]N[6]O)	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<3>,2|O<1>}	C[6](C[6]N[6]N)(C[6]N[6]O)(NOO){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]O){1|C<3>,1|H<1>,1|N<3>}	121.0455	0.305	2	121.0455	0.093	2	121.0455	0.093	2	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(NCN)	C[6](C[6]N[6]N)(N[6]C[6]O)(NOO)	N[6](C[6]C[6]N)2	C[6](C[6]N[6]N)(N[6]C[6])(NCN){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]N)(N[6]C[6]O)(NOO){1|C<3>,1|N<3>}	N[6](C[6]C[6]N)2{3|N<3>}	122.3585	0.203	2	122.3585	0.041	2	123.0517	0.671	4	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(NOO)	C[6](C[6]N[6]N)(N[6]C[6]O)(NHH)	N[6](C[6]C[6]N)2	C[6](C[6]N[6]N)(N[6]C[6])(NOO){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]N)(N[6]C[6]O)(NHH){1|C<3>,1|N<3>}	N[6](C[6]C[6]N)2{3|N<3>}	123.7450	0.222	2	123.7450	0.049	2	123.0517	0.671	4	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(NHH)	C[6](C[6a]C[6a]2)(C[6]N[6]C)(C[6]N[6]N)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6a]C[6])(N[6]C[6])(NHH){1|C<4>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]C)(C[6]N[6]N){1|Cl<1>,2|H<1>,3|C<3>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|H<1>,2|C<3>}	122.3650	0.698	4	122.7073	0.158	32	122.7073	0.158	32	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(NHH)	C[6](C[6a]C[6a]2)(C[6]N[6]C)(C[6]N[6]N)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6a]C[6])(N[6]C[6])(NHH){1|C<4>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]C)(C[6]N[6]N){3|C<3>,3|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|H<1>,2|C<3>}	122.7563	0.327	28	122.7073	0.158	32	122.7073	0.158	32	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(NHH)	C[6](N[6]C[6]Co)(C[6]N[6]N)(COO)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(NHH){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]N)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	119.7310	0.000	1	119.7310	0.000	1	119.8456	0.136	10	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(NHH)	C[6](N[6]C[6]Mn)(C[6]N[6]N)(COO)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(NHH){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]N)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	120.1570	0.249	2	120.1570	0.062	2	119.8456	0.136	10	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(NHH)	C[6](N[6]C[6]Ni)(C[6]N[6]N)(COO)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(NHH){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]N)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	119.7575	0.354	4	119.7575	0.126	4	119.8456	0.136	10	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:N-3:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(NHH)	C[6](N[6]C[6]Sn)(C[6]N[6]N)(COO)	N[6](C[6]C[6]H)(C[6]C[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(NHH){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]N)(COO){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]N){1|C<3>,1|H<1>,1|N<3>}	119.7937	0.520	3	119.7937	0.271	3	119.8456	0.136	10	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6]-3:N[6]-2:S-3:	C[6]-3:N[6]-3:S-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(SFe2)	C[6](C[6]N[6]S)(N[6]C[6]H)(SFe2)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]S)(N[6]C[6])(SFe2){1|C<3>,2|H<1>}	C[6](C[6]N[6]S)(N[6]C[6]H)(SFe2){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|H<1>,1|N<3>,1|S<3>}	123.9880	0.263	2	123.9880	0.069	2	123.9880	0.069	2	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:N[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]N[6]C)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]H)(CCH)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]N[6]C){3|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]H)(CCH){4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<3>,5|C<3>}	122.5873	0.373	3	122.5873	0.139	3	122.5873	0.139	3	121.9696	1.450	74	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:3:	4:3:	C[6]-3:N[6]-2:N-3:	C[6a]-3:C[6]-3:C[6]-3:	C[6,6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6])(NCS)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N)	N[6](C[6,6]C[6]2N[6])(C[6]C[6]N)	C[6](C[6]C[6a]C[6])(N[6]C[6,6])(NCS){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N){2|C<3>,2|C<4>,2|H<1>}	N[6](C[6,6]C[6]2N[6])(C[6]C[6]N){2|C<3>,3|C<4>,4|H<1>}	125.3130	0.000	1	125.3130	0.000	1	125.3130	0.000	1	125.3130	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-3:N[6]-3:C-4:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CCO)	C[6](C[6]N[6]C)(N[6]B[6]H)(CH3)	N[6](N[6]C[6a]B[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CCO){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]N[6]C)(N[6]B[6]H)(CH3){1|N<3>,2|C<3>}	N[6](N[6]C[6a]B[6])(C[6]C[6]C){1|C<4>,1|N<3>,4|C<3>}	121.3325	0.209	2	121.3325	0.044	2	121.3325	0.044	2	121.8260	0.696	44	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|C<3>,1|C<4>,1|H<1>}	122.2494	0.714	27	122.1733	0.555	29	121.8495	0.716	42	121.8260	0.696	44	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH)	N[6](C[6]C[6]N)(C[6]N[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH){1|Ru<9>,1|C<3>}	N[6](C[6]C[6]N)(C[6]N[6]N){1|Ru<9>,1|C<3>,1|C<4>}	121.1455	0.159	2	122.1733	0.555	29	121.8495	0.716	42	121.8260	0.696	44	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[5]HH)	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[5]HH){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,1|C<4>,1|H<1>}	120.8809	0.303	9	120.8809	0.092	9	121.8495	0.716	42	121.8260	0.696	44	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	3:3:4:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[6]HH)	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[6]HH){1|C<3>,1|C<4>}	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<3>,2|C<4>}	121.6813	0.702	4	121.6813	0.492	4	121.8495	0.716	42	121.8260	0.696	44	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:1:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]N[6])(H)	N[6](C[5,6]C[5,6]O[5])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]N[6])(H){1|N<2>,6|C<3>}	N[6](C[5,6]C[5,6]O[5])(C[6]C[6a]C[6]){1|C<4>,1|H<1>,1|N<2>,4|C<3>}	120.2950	0.000	1	120.2950	0.000	1	120.2950	0.000	1	120.2950	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6,6]-4:C[6]-3:C-2:	C[6,6]-3:C[6]-3:	C[6](C[6]C[6,6]C)(N[6]C[6,6])(NHH)	C[6](C[6,6]C[3x6]C[6]H)(C[6]N[6]N)(CN)	N[6](C[6,6]C[3x6]N[6])(C[6]C[6]N)	C[6](C[6]C[6,6]C)(N[6]C[6,6])(NHH){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]N[6]N)(CN){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	N[6](C[6,6]C[3x6]N[6])(C[6]C[6]N){2|C<2>,2|C<3>,2|C<4>}	121.8690	0.000	1	121.8690	0.000	1	121.9915	0.030	2	121.7360	0.867	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6,6]-4:C[6]-3:C-2:	C[6,6]-3:C[6]-3:	C[6](C[6]C[6,6]C)(N[6]C[6,6])(NHH)	C[6](C[6,6]C[3x6]C[6]H)(C[6]N[6]N)(CN)	N[6](C[6,6]C[3x6]O[6])(C[6]C[6]N)	C[6](C[6]C[6,6]C)(N[6]C[6,6])(NHH){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]N[6]N)(CN){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	N[6](C[6,6]C[3x6]O[6])(C[6]C[6]N){1|C<3>,2|C<2>,2|C<4>}	122.1140	0.000	1	122.1140	0.000	1	121.9915	0.030	2	121.7360	0.867	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:2:	3:3:	C[6]-3:N[6]-2:N-3:	C[6]-4:C[6]-3:C-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(NHH)	C[6](C[6]N[6]CH)(C[6]N[6]N)(CN)	N[6](C[6]C[6]N)(C[6]N[6]C)	C[6](C[6]C[6]C)(N[6]C[6])(NHH){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]N[6]CH)(C[6]N[6]N)(CN){1|C<3>,1|H<1>}	N[6](C[6]C[6]N)(C[6]N[6]C){1|C<2>,1|C<4>,1|H<1>}	122.5550	0.000	1	122.5550	0.000	1	122.5550	0.000	1	121.7360	0.867	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:2:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-4:C[6]-3:C-2:	C[5a,6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]C)	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6a]N[6])(CN)	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]C){1|N<2>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6a]N[6])(CN){1|N<2>,5|C<3>}	N[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6a]C[6]){1|C<2>,1|C<4>,1|N<2>,3|C<3>}	120.4060	0.000	1	120.4060	0.000	1	120.4060	0.000	1	121.7360	0.867	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:3:	3:2:	C[6]-3:N[6]-2:C-3:	C[6]-4:C[6]-3:C-3:	C[6]-3:N[6]-2:	C[6](C[6]C[6]C)(N[6]N[6])(CC[6a]O)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CC[6a]O)	N[6](C[6]C[6]C)(N[6]N[6])	C[6](C[6]C[6]C)(N[6]N[6])(CC[6a]O){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CC[6a]O){1|C<4>,1|N<2>,2|C<3>}	N[6](C[6]C[6]C)(N[6]N[6]){1|C<3>,2|C<4>}	123.6450	0.000	1	123.6450	0.000	1	123.6450	0.000	1	123.6450	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:3:	3:3:	C[6]-3:N[6]-2:C-3:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(COO)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(COO)	N[6](C[6]C[6a]N[6])(C[6]C[6]C)	C[6](C[6]C[6]C)(N[6]C[6])(COO){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(COO){1|H<1>,3|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]C){1|C<4>,1|H<1>,3|C<3>}	125.0643	0.134	3	125.0643	0.018	3	125.0643	0.018	3	124.2020	2.986	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:3:	4:3:3:	3:3:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-4:C[6]-3:C-3:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]C[6]C)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]N[6])(CSS)	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]C[6]C){1|N<3>,3|H<1>,4|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]N[6])(CSS){6|C<3>}	N[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]C[6]){2|C<4>,5|C<3>}	121.6150	0.000	1	121.6150	0.000	1	121.6150	0.000	1	124.2020	2.986	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]C[6])(H)	N[6](C[6]C[6]C)2	C[6](C[6]C[6]H)(N[6]C[6])(CH3){2|C<2>}	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>}	N[6](C[6]C[6]C)2{1|C<2>,1|H<1>}	117.1380	0.000	1	117.1380	0.000	1	116.8587	0.078	3	116.8587	0.078	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	C[6](C[6]N[6]C)(C[6]C[6])(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>}	116.7190	0.199	2	116.7190	0.040	2	116.8587	0.078	3	116.8587	0.078	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:3:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6])(CHH)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CHH){2|C<3>}	N[6](C[6]C[6]C)2{1|N<2>,2|C<3>}	120.7700	0.000	1	120.7700	0.000	1	120.7700	0.000	1	120.7700	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CCCH)	C[6](C[6]N[6]C)(N[6]N[6])(CCCH)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CCCH){1|C<3>,1|N<3>}	C[6](C[6]N[6]C)(N[6]N[6])(CCCH){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pd<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	119.6142	1.324	4	119.6142	1.752	4	120.1502	1.125	10	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<4>,1|H<1>,1|N<2>}	121.3970	0.044	2	121.1637	0.164	3	120.1502	1.125	10	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|Cu<4>,1|C<4>,1|N<2>}	120.6970	0.000	1	121.1637	0.164	3	120.1502	1.125	10	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Eu<13>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Eu<13>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	119.8330	0.205	2	119.8513	0.022	3	120.1502	1.125	10	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Pt<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Pt<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	119.8880	0.000	1	119.8513	0.022	3	120.1502	1.125	10	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|C<3>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<4>,1|N<2>,1|N<3>}	120.3715	0.142	2	120.3715	0.020	2	120.3715	0.020	2	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CCCH)	C[6](C[6]N[6]C)(N[6]C[6])(CCCH)	N[6](N[6]C[6]Pd)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CCCH){1|Pd<4>,1|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CCCH){1|C<3>,1|N<3>}	N[6](N[6]C[6]Pd)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	121.0900	1.511	4	121.0900	2.284	4	121.0379	1.168	8	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	N[6](N[6]C[6]Cu)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Cu<4>,1|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CH3){2|N<3>}	N[6](N[6]C[6]Cu)(C[6]C[6]C){1|C<4>,1|N<2>,1|N<3>}	120.0600	0.000	1	120.0600	0.000	1	121.0379	1.168	8	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	N[6](N[6]C[6]Eu)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Eu<13>,1|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	N[6](N[6]C[6]Eu)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	121.1480	0.177	2	121.1480	0.031	2	121.0379	1.168	8	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]N[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	N[6](N[6]C[6]Pt)(C[6]C[6]C)	C[6](C[6]N[6]C)(N[6]N[6])(CH3){1|Pt<4>,1|C<3>}	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|N<3>}	N[6](N[6]C[6]Pt)(C[6]C[6]C){1|C<3>,1|C<4>,1|N<2>}	121.5870	0.000	1	121.5870	0.000	1	121.0379	1.168	8	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:2:4:	3:3:	C[6]-3:N[6]-2:C[6]-4:	C[6]-3:N[6]-2:C[6]-4:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]HO)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]HO)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]HO){1|C<4>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]HO){1|C<4>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){1|C<4>,1|N<2>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	119.1350	0.460	4	119.1350	0.211	4	119.1350	0.211	4	120.2953	1.260	24	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CCHN)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CCHN){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|O<2>}	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,1|H<1>,1|O<2>}	122.1400	0.000	1	122.1400	0.000	1	122.3187	0.142	3	122.3187	0.142	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6])	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]){1|C<3>,2|H<1>}	122.4080	0.486	2	122.4080	0.237	2	122.3187	0.142	3	122.3187	0.142	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3)	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H)	N[6](C[6]C[6,6]O)(C[6]C[6]C)	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H){1|C<3>,2|C<4>}	N[6](C[6]C[6,6]O)(C[6]C[6]C){1|C<3>,1|C<4>,1|H<1>}	120.6880	0.000	1	120.6880	0.000	1	120.6880	0.000	1	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]N)(Cl)	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]Cl)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]N)(Cl){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]C){1|Cl<1>,1|C<3>,1|H<1>}	121.0400	0.054	2	121.0400	0.003	2	121.0400	0.003	2	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CC3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CC3){1|N<3>,2|C<3>}	C[6](C[6]N[6]C)2(H){1|Fe<5>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]C){1|Fe<5>,1|C<3>,1|H<1>}	120.7490	0.000	1	120.7490	0.000	1	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CF3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CF3){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|Fe<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	124.0180	0.000	1	124.0180	0.000	1	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]O){1|C<3>,2|H<1>}	121.9550	0.000	1	121.9550	0.000	1	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	N[6](C[6]N[6]Se)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Se<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){4|C<3>}	N[6](C[6]N[6]Se)(C[6]C[6]C){1|H<1>,2|C<3>}	122.1917	0.401	3	122.1917	0.161	3	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]H){1|Cu<4>,1|C<3>,1|H<1>}	120.5610	0.000	1	120.2835	0.154	2	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]H){1|Ru<6>,1|C<3>,1|H<1>}	120.0060	0.000	1	120.2835	0.154	2	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	122.2126	0.229	5	122.1047	0.112	6	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|Cu<5>,1|C<3>,1|H<1>}	121.5650	0.000	1	122.1047	0.112	6	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	121.9605	0.398	2	121.2590	0.810	4	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	N[6](C[6]C[6]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]C){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	120.5575	0.551	2	121.2590	0.810	4	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[5]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|C<4>}	C[6](C[6]N[6]C)2(H){1|Pd<4>,1|C<3>}	N[6](C[6]C[5]N[6])(C[6]C[6]C){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	120.9368	0.213	5	120.9368	0.045	5	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|Cu<4>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]H){1|Cu<4>,1|C<3>,1|H<1>}	120.7350	0.000	1	120.7350	0.000	1	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,1|H<1>}	121.4140	0.000	1	122.4565	0.409	51	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	122.8059	0.519	15	122.4565	0.409	51	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,2|H<1>}	122.4220	0.531	33	122.4565	0.409	51	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)2(H){1|Co<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|Co<6>,1|C<3>,1|H<1>}	120.9250	0.092	2	122.4565	0.409	51	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]O)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]C)2(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]O){1|H<1>,2|C<3>}	122.9915	0.289	2	122.9915	0.084	2	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|H<1>}	122.0390	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6]N[6]C)2(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|H<1>,2|C<3>}	122.2860	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|H<1>}	122.9094	0.497	5	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Cd<6>,1|C<3>,1|H<1>}	121.2220	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Mn<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Mn<6>,1|C<3>,1|H<1>}	121.5530	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Ni<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Ni<6>,1|C<3>,1|H<1>}	122.0285	0.230	4	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Sn<5>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Sn<5>,1|C<3>,1|H<1>}	121.2850	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	C[6](C[6]N[6]C)2(H){1|Ag<5>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Ag<5>,1|C<3>,1|H<1>}	121.8500	0.000	1	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|Cd<6>,1|C<3>,1|H<1>}	121.0513	0.385	3	122.0028	0.571	18	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]C[6a]N[6])(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)2(H){1|Ir<6>,1|C<3>}	N[6](C[6]C[6a]N[6])(C[6]C[6]C){1|Ir<6>,1|H<1>,3|C<3>}	121.3620	0.284	2	121.3620	0.081	2	122.1339	0.696	97	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<1>}	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<1>}	122.0255	0.135	2	121.8296	0.397	15	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	121.7995	0.674	13	121.8296	0.397	15	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<3>,1|H<1>,1|S<2>}	121.3165	0.330	4	121.3165	0.109	4	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	121.2522	0.296	6	121.2522	0.088	6	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|C<3>,1|H<1>,1|S<2>}	120.9910	0.257	2	120.9910	0.066	2	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]S)	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|S<4>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,2|H<1>}	N[6](C[6]C[6]C)(N[6]C[6]S){1|C<3>,3|H<1>}	122.3510	0.000	1	122.3510	0.000	1	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(N[6]C[6]B)	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	N[6](C[6]C[6]C)(N[6]C[6]B){1|C<3>,1|H<1>,1|S<2>}	122.1590	0.256	3	122.1590	0.065	3	121.6462	0.351	31	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](N[6]C[6]Re)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|N<3>}	N[6](N[6]C[6]Re)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	121.8420	0.000	1	121.8420	0.000	1	121.8420	0.000	1	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]N)(I)	N[6](C[6]C[6]C)(C[6]N[6]C)	C[6](C[6]C[6]I)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]N)(I){1|Pd<4>,1|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]C){1|Pd<4>,1|C<3>,1|I<1>}	120.4140	0.000	1	120.4140	0.000	1	120.4140	0.000	1	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.9627	0.609	4	120.9627	0.371	4	120.8610	0.818	14	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|C<4>,1|H<1>,1|N<3>}	120.1465	0.473	6	120.1465	0.224	6	120.8610	0.818	14	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]W)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|W<6>}	C[6](C[6]N[6]C)(N[6]C[6]W)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	121.8310	0.713	4	121.8310	0.509	4	120.8610	0.818	14	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:O-1:	C[6]-3:N[6]-3:	C[6](C[6]N[6]O)(N[6]N[6])(CC3)	C[6](C[6]N[6]C)(N[6]C[6]N)(O)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]O)(N[6]N[6])(CC3){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(N[6]C[6]N)(O){1|N<3>,1|S<1>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>}	121.3470	0.000	1	121.3470	0.000	1	121.3470	0.000	1	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3)	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H)	N[6](C[6]C[6,6]H)(C[6]C[6]C)	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H){1|O<2>,2|C<3>,2|F<1>}	N[6](C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	120.1210	0.153	2	120.1432	0.026	4	120.1432	0.026	4	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3)	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H)	N[6](C[6]C[6,6]H)(C[6]C[6]C)	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H){1|O<2>,4|C<3>}	N[6](C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|H<1>,1|N<3>}	120.1655	0.227	2	120.1432	0.026	4	120.1432	0.026	4	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CCHH)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CCHH){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.7477	0.378	4	120.7477	0.143	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Cd)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.4940	0.595	2	120.4940	0.354	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.2900	0.000	1	120.7542	0.323	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.9090	0.584	3	120.7542	0.323	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	120.5067	0.354	4	120.5067	0.125	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.6675	0.590	2	120.6675	0.349	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	121.0430	0.126	2	121.0430	0.016	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.1300	0.000	1	120.5570	0.365	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.9840	0.000	1	120.5570	0.365	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.2880	0.000	1	121.2880	0.000	1	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	120.5695	0.127	2	120.5695	0.016	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	120.5810	0.000	1	120.5810	0.000	1	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>}	120.2130	0.000	1	120.8375	0.780	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.4620	0.000	1	120.8375	0.780	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	121.2535	0.219	4	121.2535	0.048	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	120.5630	0.000	1	120.5630	0.000	1	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Re)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.7765	0.166	2	120.7765	0.028	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.2790	0.276	2	120.2790	0.076	2	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){2|C<3>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.0200	0.000	1	121.0200	0.000	1	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|N<3>,2|H<1>}	120.9215	1.139	4	120.9215	1.298	4	120.7659	0.269	40	121.6023	0.907	192	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	N[6](C[6]C[6]MoP)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Mo<7>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<4>,1|H<1>}	N[6](C[6]C[6]MoP)(C[6]C[6]C){1|C<3>,2|H<1>}	122.4310	0.000	1	122.4310	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]CuN)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Cu<6>,1|C<4>,2|N<3>}	C[6](C[6]N[6]C)2(H){1|Cu<6>,1|C<4>}	N[6](C[6]N[6]CuN)(C[6]C[6]C){1|C<3>,1|H<1>}	122.5770	0.000	1	122.5770	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]EuS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Eu<12>,1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Eu<12>,1|C<4>}	N[6](C[6]N[6]EuS)(C[6]C[6]C){1|C<3>,1|H<1>}	122.7640	0.000	1	122.7640	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]GdN)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Gd<15>,1|C<4>,1|N<3>,1|N<4>}	C[6](C[6]N[6]C)2(H){1|Gd<15>,1|C<4>}	N[6](C[6]N[6]GdN)(C[6]C[6]C){1|C<3>,1|H<1>}	121.8610	0.000	1	121.8610	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]PrS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Pr<12>,1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Pr<12>,1|C<4>}	N[6](C[6]N[6]PrS)(C[6]C[6]C){1|C<3>,1|H<1>}	122.5450	0.000	1	122.5450	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]RhS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Rh<5>,1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Rh<5>,1|C<4>}	N[6](C[6]N[6]RhS)(C[6]C[6]C){1|C<3>,1|H<1>}	121.8740	0.000	1	121.8740	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:1:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)2(H)	N[6](C[6]N[6]SmS)(C[6]C[6]C)	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Sm<12>,1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]N[6]C)2(H){1|Sm<12>,1|C<4>}	N[6](C[6]N[6]SmS)(C[6]C[6]C){1|C<3>,1|H<1>}	123.3770	0.000	1	123.3770	0.000	1	122.4899	0.275	7	122.4899	0.275	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:2:	3:3:	C[6]-3:N[6]-2:C-4:	N[5,6]-3:C[6]-3:O-2:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC)	N[6](C[6]C[5,6]O)(C[6]C[6]C)	C[6](C[6]N[5,6]O)(N[6]C[6])(CCCH){1|C<3>,1|C<4>,1|O<2>}	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]C)(OC){1|C<3>,1|O<1>,1|O<2>,2|C<4>}	N[6](C[6]C[5,6]O)(C[6]C[6]C){1|N<3>,1|O<2>,2|C<4>}	121.6135	0.508	2	121.6135	0.258	2	121.6135	0.258	2	121.6135	0.258	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:2:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:C-2:	Si[6]-4:C[6]-3:	C[6](C[6]C[6]C)(N[6]Si[6])(CC3)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(CC)	N[6](Si[6]C[6]CC)(C[6]C[6]C)	C[6](C[6]C[6]C)(N[6]Si[6])(CC3){1|C<3>,3|C<4>}	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(CC){1|Si<4>,1|O<2>,3|C<3>}	N[6](Si[6]C[6]CC)(C[6]C[6]C){1|C<2>,1|O<2>,2|C<3>}	121.3140	0.000	1	121.3140	0.000	1	121.3140	0.000	1	121.3140	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](N[6]C[6]Al)(C[6]N[6]C)(CCH)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]N[6]C)(CCH){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.7644	0.296	8	121.7952	0.086	10	121.4978	0.554	12	121.8230	1.223	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](N[6]C[6]Al)(C[6]N[6]C)(CCH)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]N[6]C)(CCH){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	121.9185	0.354	2	121.7952	0.086	10	121.4978	0.554	12	121.8230	1.223	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](N[6]C[6]Zn)(C[6]N[6]C)(CCN)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]C)(CCN){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	120.0110	0.093	2	120.0110	0.009	2	121.4978	0.554	12	121.8230	1.223	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CF3)	C[6](N[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]N[6]C)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CF3){1|O<1>,4|C<3>}	C[6](N[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]N[6]C){2|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	125.9530	0.000	1	125.9530	0.000	1	122.2131	1.866	10	121.8230	1.223	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6a]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CH3)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]N[6]C)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)	C[6](C[6]C[6a]N[6])(N[6]C[6,6a])(CH3){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]N[6]C){1|H<1>,4|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	121.7976	0.396	9	121.7976	0.157	9	122.2131	1.866	10	121.8230	1.223	22	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	4:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:C-3:	S[6]-4:C[6]-3:	C[6](C[6]C[6]C)(N[6]S[6])(CH3)	C[6](C[6]N[6]C)(C[6]N[6]H)(COO)	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6]C)(N[6]S[6])(CH3){1|H<1>,1|N<3>,2|O<1>}	C[6](C[6]N[6]C)(C[6]N[6]H)(COO){1|C<4>,1|S<4>}	N[6](S[6]N[6]OO)(C[6]C[6]C){1|C<4>,2|C<3>}	122.5570	0.000	1	122.5570	0.000	1	122.5570	0.000	1	124.0948	1.166	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	4:3:	C[6]-3:N[6]-2:C-4:	C[6a]-3:C[6]-3:C[6]-3:	S[6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3)	C[6](C[6a]C[6a]2)(C[6]N[6]C)2	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]C)2{1|C<4>,1|H<1>,1|S<4>,3|C<3>}	N[6](S[6]N[6]OO)(C[6]C[6]C){1|C<4>,2|C<3>}	124.5955	0.588	2	124.6073	0.173	3	124.6073	0.173	3	124.0948	1.166	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:3:	4:3:	C[6]-3:N[6]-2:C-4:	C[6a]-3:C[6]-3:C[6]-3:	S[6]-4:C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3)	C[6](C[6a]C[6a]2)(C[6]N[6]C)2	N[6](S[6]N[6]OO)(C[6]C[6]C)	C[6](C[6]C[6a]C[6])(N[6]S[6])(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]C)2{1|S<4>,2|H<1>,3|C<3>}	N[6](S[6]N[6]OO)(C[6]C[6]C){1|H<1>,2|C<3>}	124.6310	0.000	1	124.6073	0.173	3	124.6073	0.173	3	124.0948	1.166	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:2:	C[6]-3:N[6]-2:C-4:	C[6]-3:C[6]-3:C-4:	C[6]-3:N[6]-2:	C[6](C[6]C[6]C)(N[6]N[6])(CH3)	C[6](C[6]C[6]H)(C[6]N[6]C)(CC[6a]HH)	N[6](C[6]C[6]C)(N[6]C[6])	C[6](C[6]C[6]C)(N[6]N[6])(CH3){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CC[6a]HH){1|N<2>,1|O<1>}	N[6](C[6]C[6]C)(N[6]C[6]){1|C<3>,1|C<4>,1|O<1>}	122.9340	0.000	1	122.9340	0.000	1	122.9340	0.000	1	122.9340	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CCHH)	C[6](C[6]N[6]C)(N[6]C[6]H)(CCHH)	N[6](C[6]C[6]C)(C[6]C[6]S)	C[6](C[6]N[6]C)(N[6]C[6])(CCHH){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[6]C)(N[6]C[6]H)(CCHH){1|C<3>,1|S<2>}	N[6](C[6]C[6]C)(C[6]C[6]S){1|C<4>,1|N<3>,1|S<2>}	121.5190	0.191	2	121.5190	0.036	2	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,2|C<4>}	C[6](C[6]N[6]C)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	121.8510	0.305	2	121.8510	0.093	2	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,2|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>}	121.4260	0.119	2	121.4260	0.014	2	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	120.6997	0.477	8	121.1884	0.487	14	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]C)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)2{1|C<4>,1|H<1>,1|N<3>}	121.8398	0.238	6	121.1884	0.487	14	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-3:N[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CH3)	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]C)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	122.2250	0.362	4	122.2250	0.131	4	121.4637	0.459	24	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	3:3:4:	3:3:	C[6]-3:N[6]-2:C-4:	N[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(CHHN)	C[6](N[6]C[6]Cd)(C[6]N[6]C)(CHHN)	N[6](C[6]C[6]C)2	C[6](C[6]N[6]C)(N[6]C[6])(CHHN){1|Cd<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]N[6]C)(CHHN){1|C<3>,1|C<4>}	N[6](C[6]C[6]C)2{1|N<3>,2|C<4>}	120.8920	0.000	1	120.8920	0.000	1	120.8920	0.000	1	121.4408	0.453	25	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	4:3:3:	2:3:	C[6]-3:N[6]-2:C-4:	C[6,6]-4:C[6]-3:C-3:	O[6]-2:C[6]-3:	C[6](C[6]C[6,6]C)(N[6]O[6])(CCHH)	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]C)(CC[6a]2)	N[6](O[6]C[6,6])(C[6]C[6]C)	C[6](C[6]C[6,6]C)(N[6]O[6])(CCHH){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]C)(CC[6a]2){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	N[6](O[6]C[6,6])(C[6]C[6]C){1|C<4>,1|O<2>,2|C<3>}	123.4980	0.000	1	123.4980	0.000	1	123.4980	0.000	1	123.4980	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	4:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CF3)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]N[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(CF3){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(COO){1|H<1>,3|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]N){1|C<3>,1|C<4>,1|H<1>}	124.7880	0.000	1	124.7880	0.000	1	122.1034	4.618	5	122.1034	4.618	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	4:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CCO)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CCO){1|C<4>,3|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,2|C<4>}	121.7695	0.211	2	121.7695	0.045	2	122.1034	4.618	5	122.1034	4.618	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	4:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CNO)	N[6](C[6]C[6]C)(C[6]N[6]S)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]C)(CNO){1|H<1>,3|C<3>}	N[6](C[6]C[6]C)(C[6]N[6]S){1|C<3>,1|C<4>,1|H<1>}	118.9780	0.000	1	118.9780	0.000	1	122.1034	4.618	5	122.1034	4.618	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:2:4:	4:3:3:	3:3:	C[6]-3:N[6]-2:C-4:	C[6]-4:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(CH3)	C[6](C[6]C[6a]S[6]H)(C[6]N[6]C)(COO)	N[6](C[6]C[6]C)(C[6]S[6]N)	C[6](C[6]C[6]C)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6a]S[6]H)(C[6]N[6]C)(COO){3|C<3>}	N[6](C[6]C[6]C)(C[6]S[6]N){1|C<3>,1|C<4>}	123.2120	0.000	1	123.2120	0.000	1	122.1034	4.618	5	122.1034	4.618	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6])(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6])(H){1|H<1>,1|N<2>,2|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|C<2>,1|C<3>,1|N<2>,2|H<1>}	123.1050	0.000	1	123.1050	0.000	1	123.1050	0.000	1	119.6795	23.468	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(N[6]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(N[6]N[6])(H){1|Pt<4>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Pt<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	116.2540	0.000	1	116.2540	0.000	1	116.2540	0.000	1	119.6795	23.468	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:1:	3:4:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:O[6]-2:O-1:	C[6]-3:C[6]-4:	C[6](C[6a]C[6a]2)(C[6]O[6]O)(N[6]C[6])	C[6](C[6]C[6a]N[6])(O[6]C[6])(O)	N[6](C[6]C[6a]C[6])(C[6]C[6]HH)	C[6](C[6a]C[6a]2)(C[6]O[6]O)(N[6]C[6]){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6a]N[6])(O[6]C[6])(O){1|H<1>,2|C<3>,2|C<4>}	N[6](C[6]C[6a]C[6])(C[6]C[6]HH){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	121.9367	0.758	3	121.9367	0.575	3	121.9367	0.575	3	121.9367	0.575	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:1:	4:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:O[6]-2:O-1:	C[6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]O[6]O)(N[6]C[6])	C[6](C[6]C[6a]N[6])(O[6]C[6])(O)	N[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(C[6]O[6]O)(N[6]C[6]){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(O[6]C[6])(O){1|H<1>,2|C<3>,2|C<4>}	N[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6]){1|C<4>,1|H<1>,1|O<1>,1|O<2>,4|C<3>}	121.0690	0.000	1	121.0690	0.000	1	121.0690	0.000	1	121.0690	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:2:	3:2:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:P[6]-2:O-2:	C[6]-3:N[6]-2:	C[6](N[5a]C[5a]N[5a])(C[6]P[6]O)(N[6]N[6])	C[6](C[6]N[5a]N[6])(P[6]C[6])(OAl)	N[6](C[6]N[5a]C[6])(N[6]C[6])	C[6](N[5a]C[5a]N[5a])(C[6]P[6]O)(N[6]N[6]){1|C<4>,3|C<3>}	C[6](C[6]N[5a]N[6])(P[6]C[6])(OAl){1|C<3>,1|N<3>,2|N<2>}	N[6](C[6]N[5a]C[6])(N[6]C[6]){1|C<3>,1|N<2>,1|N<3>,1|O<2>,1|P<2>}	128.0930	0.000	1	128.0930	0.000	1	128.0930	0.000	1	128.0930	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:2:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-2:N-3:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]N)(N[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6])(NHH)	N[6](C[6]C[6a]C[6])(N[6]C[6]H)	C[6](C[6a]C[6a]2)(C[6]N[6]N)(N[6]N[6]){1|Cl<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6])(NHH){2|C<3>,2|N<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]H){1|N<2>,2|C<3>,2|N<3>}	120.4356	0.461	20	120.4356	0.212	20	120.4356	0.212	20	120.4356	0.212	20	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:2:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	N[6](C[6]C[5a]C[6])(C[6]C[6])	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|S<2>}	N[6](C[6]C[5a]C[6])(C[6]C[6]){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	123.2070	0.000	1	123.2070	0.000	1	123.2070	0.000	1	121.9587	1.285	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:2:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6])	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	N[6](C[6]C[6a]C[6])(C[6]C[6]){1|N<2>,2|C<3>,2|H<1>}	121.3345	0.482	2	121.3345	0.232	2	121.3345	0.232	2	121.9587	1.285	3	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[5]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]N[6])	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	N[6](C[6]C[5]C[6])(N[6]C[6]C)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]N[6]){1|C<2>,1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	N[6](C[6]C[5]C[6])(N[6]C[6]C){1|N<3>,2|C<3>,2|H<1>}	121.5920	0.000	1	121.5920	0.000	1	121.5920	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[5]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6])	C[6](C[6]C[5]N[6])(N[6]C[6]Mn)(H)	N[6](C[6]C[5]C[6])(C[6]C[6]H)	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]){1|Mn<6>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(N[6]C[6]Mn)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	N[6](C[6]C[5]C[6])(C[6]C[6]H){1|N<2>,2|H<1>,2|N<3>}	122.0550	0.000	1	122.0550	0.000	1	122.0550	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	N[6](C[6]C[5a]C[6])2	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>}	N[6](C[6]C[5a]C[6])2{1|H<1>,1|O<1>,2|N<3>,3|C<3>}	120.8270	0.000	1	120.8270	0.000	1	120.8270	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C[6]-3:	C[6](C[5a]C[5a]N[5a])(C[6]C[6]O)(N[6]C[6])	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(O)	N[6](C[6]C[5a]C[6])2	C[6](C[5a]C[5a]N[5a])(C[6]C[6]O)(N[6]C[6]){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<3>}	N[6](C[6]C[5a]C[6])2{1|H<1>,1|O<1>,2|N<3>,3|C<3>}	121.6620	0.000	1	121.6620	0.000	1	121.6620	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[5a]N[5a]O[5a])(C[6]N[6]H)(N[6]C[6])	C[6](C[6]C[5a]N[6])(N[6]C[6]Co)(H)	N[6](C[6]C[5a]C[6])(C[6]C[6]H)	C[6](C[5a]N[5a]O[5a])(C[6]N[6]H)(N[6]C[6]){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[5a]N[6])(N[6]C[6]Co)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>}	N[6](C[6]C[5a]C[6])(C[6]C[6]H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	122.5860	0.000	1	122.5860	0.000	1	122.5860	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:Br-1:	C[6]-3:C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6])	C[6](C[6]C[6]N[6])(C[6]N[6]H)(Br)	N[6](C[6]C[6]2)(C[6]N[6]H)	C[6](C[6]N[5,6]C[6])(C[6]C[6]Br)(N[6]C[6]){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(Br){1|Zn<4>,1|N<3>,2|C<3>}	N[6](C[6]C[6]2)(C[6]N[6]H){1|Br<1>,1|Zn<4>,1|N<3>,2|C<3>}	120.1460	0.000	1	120.1460	0.000	1	120.1460	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6])	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H)	N[6](C[6]C[6]N[6])(C[6]N[6]H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]){1|N<3>,3|C<4>,5|H<1>}	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H){1|Fe<10>,1|Pd<4>,1|C<3>,4|C<4>}	N[6](C[6]C[6]N[6])(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	120.2830	0.000	1	120.2830	0.000	1	120.6865	0.326	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6])	C[6](C[6]N[6]2)(C[6]N[6]N)(H)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]){2|C<4>,3|N<3>,4|H<1>}	C[6](C[6]N[6]2)(C[6]N[6]N)(H){1|C<3>,1|O<2>,2|C<4>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	121.0900	0.000	1	121.0900	0.000	1	120.6865	0.326	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<2>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|H<1>,3|C<3>}	116.7230	0.000	1	116.7230	0.000	1	120.3598	8.765	6	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H)	N[6](C[6]C[6a]C[6])(C[6]S[6]S)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|S<1>,1|S<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H){5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]S[6]S){1|H<1>,3|C<3>}	125.2810	0.000	1	125.2810	0.000	1	120.3598	8.765	6	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])2(H)	N[6](C[6]C[6a]C[6])(C[6]N[6]H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])2(H){1|Ir<6>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]H){1|Ir<6>,1|H<1>,3|C<3>}	119.8815	0.453	2	119.8815	0.205	2	120.3598	8.765	6	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])2(H)	N[6](C[6]C[6a]C[6])(C[6]N[6]N)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){2|H<1>,2|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])2(H){1|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]N){2|H<1>,3|C<3>}	121.8790	0.000	1	121.8790	0.000	1	120.3598	8.765	6	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]N[6]C)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]C){1|Zn<5>,1|H<1>,1|N<2>,2|C<3>}	118.5130	0.000	1	118.5130	0.000	1	120.3598	8.765	6	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	N[6](C[6]C[6a]C[6])(N[6]C[6]S)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6]){1|S<4>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	N[6](C[6]C[6a]C[6])(N[6]C[6]S){3|C<3>,3|H<1>}	122.3670	0.000	1	122.3670	0.000	1	121.9980	0.272	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	N[6](C[6]C[6a]C[6])(N[6]C[6]Re)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6]){1|Re<6>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|C<3>,2|N<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Re){1|H<1>,1|N<3>,3|C<3>}	121.6290	0.000	1	121.6290	0.000	1	121.9980	0.272	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6]){1|C<4>,1|S<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H){1|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|H<1>,5|C<3>}	120.3160	0.000	1	120.3160	0.000	1	120.6210	0.186	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]N[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]N[6]H)(N[6]C[6]){1|Ir<6>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(H){1|N<2>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	120.9260	0.000	1	120.9260	0.000	1	120.6210	0.186	2	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]O)(H)	N[6](C[6]C[6a]C[6])(N[6]C[6]H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]N[6]){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(N[6]C[6]O)(H){1|N<3>,2|C<3>,2|C<4>}	N[6](C[6]C[6a]C[6])(N[6]C[6]H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	121.3187	0.341	4	121.3187	0.116	4	121.3187	0.116	4	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]H)(O)	N[6](C[6]C[6a]C[6])(N[6]C[6]H)	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]N[6]){3|C<3>,4|H<1>}	C[6](C[6]C[6a]N[6])(N[6]C[6]H)(O){1|N<3>,1|S<1>,2|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>,2|C<3>}	120.9480	0.000	1	120.9480	0.000	1	120.8477	0.072	3	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]N)(O)	N[6](C[6]C[6a]C[6])(N[6]C[6]H)	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]N[6]){1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(N[6]C[6]N)(O){1|N<3>,1|S<1>,2|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>,2|C<3>}	120.7975	0.359	2	120.7975	0.129	2	120.8477	0.072	3	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	N[6](C[6]N[5a]C[6])(C[6]N[6]C)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	N[6](C[6]N[5a]C[6])(C[6]N[6]C){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	123.4615	0.132	2	123.4615	0.017	2	123.6539	0.465	7	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	N[6](C[6]N[5a]C[6])(C[6]N[6]H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){2|C<3>,2|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	N[6](C[6]N[5a]C[6])(C[6]N[6]H){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	124.0503	0.458	4	123.7308	0.668	5	123.6539	0.465	7	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	N[6](C[6]N[5a]C[6])(C[6]N[6]H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){2|C<3>,2|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Pd<4>,1|N<2>,1|N<3>,3|C<3>}	N[6](C[6]N[5a]C[6])(C[6]N[6]H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	122.4530	0.000	1	123.7308	0.668	5	123.6539	0.465	7	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:3:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[5a]C[5a,6a]2)(C[6]N[6]H)(N[6]C[6])	C[6](C[6]N[5a]N[6])(N[6]C[6]Cu)(H)	N[6](C[6]N[5a]C[6])(C[6]C[6]H)	C[6](N[5a]C[5a,6a]2)(C[6]N[6]H)(N[6]C[6]){1|Cu<5>,1|H<1>,5|C<3>}	C[6](C[6]N[5a]N[6])(N[6]C[6]Cu)(H){1|H<1>,3|C<3>}	N[6](C[6]N[5a]C[6])(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	121.0730	0.000	1	121.0730	0.000	1	121.0730	0.000	1	121.5790	3.023	33	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	3:4:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]C[6]HO)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|O<2>,2|C<4>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]HO){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	121.4010	0.000	1	121.4010	0.000	1	121.4010	0.000	1	121.4010	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6,6a]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]S[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	N[6](S[6]C[6,6a]CO)(C[6]C[6a]C[6])	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]S[6]){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,1|S<4>,4|C<3>}	N[6](S[6]C[6,6a]CO)(C[6]C[6a]C[6]){1|H<1>,4|C<3>}	122.7100	0.000	1	122.7100	0.000	1	122.7100	0.000	1	122.4967	0.095	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	4:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H)	N[6](C[6]C[6a]O[6]H)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,3|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H){1|C<4>,4|C<3>}	N[6](C[6]C[6a]O[6]H)(C[6]C[6a]C[6]){1|H<1>,5|C<3>}	122.3070	0.000	1	122.3070	0.000	1	122.4257	0.112	3	122.4967	0.095	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	4:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	N[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){1|C<4>,3|C<3>}	N[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6]){1|H<1>,6|C<3>}	122.8030	0.000	1	122.8030	0.000	1	122.4257	0.112	3	122.4967	0.095	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:1:	4:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H)	N[6](C[6]C[6a]O[6]C)(C[6]C[6a]C[6])	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H){1|C<4>,2|C<3>}	N[6](C[6]C[6a]O[6]C)(C[6]C[6a]C[6]){1|H<1>,5|C<3>}	122.1670	0.000	1	122.1670	0.000	1	122.4257	0.112	3	122.4967	0.095	4	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Cu<4>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Cu<4>,1|N<2>,1|N<3>,4|C<3>}	119.5097	0.619	3	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Cu<5>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Cu<5>,1|N<2>,1|N<3>,4|C<3>}	119.1020	0.000	1	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Mn<6>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Mn<6>,1|N<2>,1|N<3>,4|C<3>}	119.0655	0.224	2	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Mo<9>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Mo<9>,1|N<2>,1|N<3>,4|C<3>}	119.6530	0.000	1	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Ni<6>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Ni<6>,1|N<2>,1|N<3>,4|C<3>}	118.8717	0.538	4	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Pt<4>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Pt<4>,1|N<2>,1|N<3>,4|C<3>}	118.8460	0.000	1	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Ru<6>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]N[6]){1|Ru<6>,1|N<2>,1|N<3>,4|C<3>}	119.3350	0.000	1	119.1602	0.232	13	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	N[6](C[6]C[6a]C[6])(C[6]N[6]S)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,1|S<2>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Sn<5>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]S){1|Sn<5>,1|N<2>,3|C<3>}	119.2080	0.000	1	119.2080	0.000	1	119.1636	0.214	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Cu)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Cu<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Cu){1|N<2>,4|C<3>}	120.1573	0.429	3	120.3485	0.269	4	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Cu)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Cu<5>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Cu){1|N<2>,4|C<3>}	120.9220	0.000	1	120.3485	0.269	4	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Mn)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Mn<6>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Mn){1|N<2>,4|C<3>}	119.8915	0.317	2	119.8915	0.101	2	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Mo)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Mo<9>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Mo){1|N<2>,4|C<3>}	120.5520	0.000	1	120.5520	0.000	1	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Ni)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Ni<6>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Ni){1|N<2>,4|C<3>}	120.1343	0.190	4	120.1343	0.036	4	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Pt<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt){1|N<2>,4|C<3>}	120.5810	0.000	1	120.5810	0.000	1	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Ru<6>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru){1|N<2>,4|C<3>}	121.4800	0.000	1	121.4800	0.000	1	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(N[6]C[6]Sn)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Sn<5>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|N<3>,1|S<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Sn){1|N<2>,1|S<2>,3|C<3>}	119.6310	0.000	1	119.6310	0.000	1	120.2827	0.265	14	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](C[6]N[6]2)(N[6]C[6]H)(N[6]C[6])	C[6](C[6]N[6]2)(N[6]C[6]H)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](C[6]N[6]2)(N[6]C[6]H)(N[6]C[6]){3|C<3>,3|H<1>}	C[6](C[6]N[6]2)(N[6]C[6]H)(N[6]C[6]){3|C<3>,3|H<1>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	117.5930	1.363	2	117.5930	1.859	2	117.5930	1.859	2	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:O-2:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]C[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(OP)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]C[6]){1|Ir<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(OP){1|O<2>,3|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|O<2>,4|C<3>}	119.5805	0.073	2	119.5805	0.005	2	119.5265	0.101	6	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:O-2:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]C[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]Rh)(OP)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]2)(C[6]N[6]O)(N[6]C[6]){1|Rh<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6]Rh)(OP){1|O<2>,3|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|O<2>,4|C<3>}	119.4995	0.404	4	119.4995	0.163	4	119.5265	0.101	6	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cr)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Cr)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Cr)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Cr)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Cr<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.0870	0.000	1	119.0870	0.000	1	119.6134	0.139	5	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.9255	0.260	2	119.9255	0.067	2	119.6134	0.139	5	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.4850	0.000	1	119.4850	0.000	1	119.6134	0.139	5	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:3:	N[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6])	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6])	N[6](C[6]C[6]N[6])(C[6]C[6]H)	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]2)(N[6]C[6]){2|H<1>,3|C<3>}	N[6](C[6]C[6]N[6])(C[6]C[6]H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	119.6440	0.000	1	119.6440	0.000	1	119.6134	0.139	5	119.5771	0.660	41	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:4:	C[5a]-3:C[6]-3:N[6]-2:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-4:	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6])	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6])	N[6](C[6]C[5a]C[6])(C[6]C[6]HH)	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6]){1|C<4>,1|S<2>,3|C<3>,3|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6]){1|C<4>,1|S<2>,3|C<3>,3|H<1>}	N[6](C[6]C[5a]C[6])(C[6]C[6]HH){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	120.2225	0.037	2	120.2225	0.001	2	120.2225	0.001	2	120.5864	0.411	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:4:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-4:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]CH)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){2|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|C<4>,3|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]CH){1|H<1>,1|N<2>,4|C<3>}	119.9610	0.000	1	119.9610	0.000	1	119.9610	0.000	1	120.5864	0.411	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	3:4:	C[6a]-3:C[6]-3:N[6]-2:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-4:	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(N[6]C[6])	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(N[6]C[6])	N[6](C[6]C[6a]C[6])(C[6]C[6]HH)	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(N[6]C[6]){1|C<4>,1|N<2>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(N[6]C[6]){1|C<4>,1|N<2>,3|C<3>,3|H<1>}	N[6](C[6]C[6a]C[6])(C[6]C[6]HH){2|C<3>,2|H<1>,2|N<2>}	121.2630	0.267	2	121.2630	0.071	2	121.2630	0.071	2	120.5864	0.411	5	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	4:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6,6]-4:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6])	N[6](C[6,6]C[6,6]C[6]H)(C[6]C[6a]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6]){2|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6]){2|C<4>,3|H<1>,4|C<3>}	N[6](C[6,6]C[6,6]C[6]H)(C[6]C[6a]C[6]){1|N<2>,2|C<4>,3|C<3>,3|H<1>}	120.7332	0.416	6	120.7332	0.173	6	120.7332	0.173	6	120.7849	0.163	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:2:	4:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-4:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	N[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|C<4>,3|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){2|C<4>,3|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6]){1|C<4>,1|H<1>,1|N<2>,5|C<3>}	121.0950	0.000	1	121.0950	0.000	1	121.0950	0.000	1	120.7849	0.163	7	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:2:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:N[6]-2:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Cu)	N[6](C[6]C[6a]C[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]N[6]){1|Cu<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Cu){1|N<2>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]){1|N<3>,4|C<3>}	120.5470	0.000	1	120.5470	0.000	1	120.5470	0.000	1	120.5470	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[5a]-3:C[6]-3:N[6]-2:	C[5a]-3:C[6]-3:N[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6,6a])	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6,6a]H)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6,6a]){1|S<2>,2|H<1>,5|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[5a]N[6])(N[6]C[6,6a]H){1|H<1>,1|S<2>,5|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6]){1|H<1>,1|N<3>,1|S<2>,4|C<3>}	121.2295	0.490	2	121.2295	0.240	2	121.2295	0.240	2	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6])	C[6](C[6]C[6]N[6])2(N[6]C[6]Ag)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]N[6])2(N[6]C[6]){2|Ag<5>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6]N[6])2(N[6]C[6]Ag){1|N<3>,2|H<1>,4|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	121.9580	0.000	1	121.9580	0.000	1	121.9420	0.227	3	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6])	C[6](C[6]C[6]N[6])2(N[6]C[6]Cu)	N[6](C[6]C[6]2)(C[6]C[6]H)	C[6](C[6]C[6]N[6])2(N[6]C[6]){2|Cu<4>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6]N[6])2(N[6]C[6]Cu){1|N<3>,2|H<1>,4|C<3>}	N[6](C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>}	121.9340	0.673	2	121.9340	0.453	2	121.9420	0.227	3	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N[6]-2:	N[6]-3:C[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6]N[6])2(N[6]C[6,6a])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]N[6])2(N[6]C[6,6a]){2|Cu<4>,1|H<1>,1|N<3>,5|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])2{1|H<1>,1|N<3>,5|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2){1|H<1>,2|N<3>,4|C<3>}	121.6355	0.489	2	121.6355	0.239	2	121.6355	0.239	2	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]C)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|C<4>,3|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]C){1|S<1>,2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|N<3>,1|S<1>,3|C<3>}	121.3780	0.512	2	121.3780	0.262	2	121.7850	0.357	5	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Ir)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|Ir<6>,1|C<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Ir){2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|H<1>,1|N<3>,3|C<3>}	122.3680	0.171	2	122.3680	0.029	2	121.7850	0.357	5	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Ir)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]){1|Ir<6>,3|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6]Ir){2|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	121.4330	0.000	1	121.4330	0.000	1	121.7850	0.357	5	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:C[6a]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6a])	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]H)(C[6a]C[6a]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6a]){3|H<1>,6|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]H)(C[6a]C[6a]2){2|H<1>,6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<3>,5|C<3>}	121.6040	0.000	1	121.6040	0.000	1	121.7479	0.245	9	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:N[6]-3:C[6a]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6a])	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Ir)(C[6a]C[6a]2)	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(N[6]C[6,6a]){1|Ir<6>,2|H<1>,6|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Ir)(C[6a]C[6a]2){1|H<1>,6|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<3>,5|C<3>}	121.7659	0.526	8	121.7659	0.277	8	121.7479	0.245	9	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]2)(N[6]C[6])	C[6](C[6]N[6]2)2(NOO)	N[6](C[6]C[6]N[6])(C[6]N[6]N)	C[6](C[6]C[6]N)(N[6]C[6]2)(N[6]C[6]){2|C<4>,3|N<3>,4|H<1>}	C[6](C[6]N[6]2)2(NOO){1|C<3>,1|H<1>,4|C<4>}	N[6](C[6]C[6]N[6])(C[6]N[6]N){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	119.0250	0.000	1	119.0250	0.000	1	119.0250	0.000	1	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CC[6a]O)	N[6](C[6]C[6a]C[6])(C[6]N[6]S)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6]){1|N<3>,1|S<1>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CC[6a]O){1|C<4>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]S){1|C<4>,4|C<3>}	121.3200	0.035	2	121.3200	0.001	2	121.3200	0.001	2	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6])	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(C[6a]C[6a]2)	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru)	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6]){1|Ru<6>,1|H<1>,6|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(C[6a]C[6a]2){1|N<2>,1|N<3>,2|H<1>,6|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru){1|N<2>,4|C<3>}	122.3390	0.000	1	122.3390	0.000	1	122.3390	0.000	1	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Ag)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Ag<5>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Ag){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	122.2990	0.000	1	122.2990	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Co)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Co<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Co){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	119.0805	0.903	4	119.0805	0.815	4	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Cr)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Cr<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Cr){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	118.3527	0.376	3	118.3527	0.142	3	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Cu)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Cu<5>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Cu){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	120.5900	0.000	1	120.5900	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Fe)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Fe<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Fe){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|N<2>,1|N<3>,3|C<3>}	121.0190	0.000	1	121.0190	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Fe)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Fe<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Fe){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	120.2685	0.665	4	120.2685	0.442	4	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn)	N[6](C[6]C[6a]C[6])(C[6]C[6]C)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Mn<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]C){1|N<2>,1|N<3>,3|C<3>}	120.2990	0.000	1	120.2990	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Mn<6>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	121.2730	0.000	1	121.2730	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Mn<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Mn){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	119.7208	0.609	5	119.7208	0.371	5	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Ni)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Ni<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Ni){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	119.1195	0.022	2	119.1195	0.000	2	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pd)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Pd<4>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pd){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	121.3630	0.000	1	121.3630	0.000	1	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pt)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Pt<4>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pt){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	121.4570	0.622	3	121.1422	0.654	4	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pt)	N[6](C[6]C[6a]C[6])(C[6]C[6]H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Pt<6>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Pt){1|N<2>,2|H<1>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	120.1980	0.000	1	121.1422	0.654	4	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Zn)	N[6](C[6]C[6a]C[6])2	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6]){1|Zn<5>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(N[6]C[6]Zn){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6]C[6a]C[6])2{1|N<3>,2|N<2>,4|C<3>}	119.1747	0.369	4	119.1747	0.136	4	119.9190	1.278	32	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]H)	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru)	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6]){1|Ru<6>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>,3|N<2>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru){1|N<2>,4|C<3>}	122.4180	0.000	1	122.4180	0.000	1	122.4180	0.000	1	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6,6a])	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Re)(C[6]C[6]N[6])	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6,6a]){1|Re<6>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Re)(C[6]C[6]N[6]){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<2>,1|N<3>,4|C<3>}	120.2830	0.000	1	120.2830	0.000	1	121.1375	1.460	2	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:N[6]-3:C[6]-3:	C[6,6a]-3:C[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6,6a])	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Ru)(C[6]C[6]N[6])	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])	C[6](C[6a]C[6a]N[6a])(C[6]C[6]N[6])(N[6]C[6,6a]){1|Ru<9>,1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Ru)(C[6]C[6]N[6]){1|H<1>,1|N<2>,5|C<3>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]){1|H<1>,1|N<2>,1|N<3>,4|C<3>}	121.9920	0.000	1	121.9920	0.000	1	121.1375	1.460	2	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6])	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(C[6]C[6]H)	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru)	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]C[6])(N[6]N[6]){1|Ru<6>,1|N<2>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,4|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Ru){1|N<2>,4|C<3>}	122.6400	0.000	1	122.6400	0.000	1	122.6400	0.000	1	120.7370	1.682	61	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-4:	N[6]-3:C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(N[6]N[6])	C[6](C[6]C[6]N[6])(C[6]C[6]C)(CCHH)	N[6](N[6]C[6]Pt)(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(N[6]N[6]){2|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]C)(CCHH){2|C<3>,2|N<3>}	N[6](N[6]C[6]Pt)(C[6]C[6]2){1|C<4>,1|N<3>,3|C<3>}	123.7363	0.656	3	123.7363	0.431	3	123.7363	0.431	3	123.0907	1.224	12	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:4:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(CH3)	N[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6]){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(CH3){1|Os<7>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]C[6a]N[6]){1|Os<7>,1|C<4>,5|C<3>}	120.5870	0.000	1	120.5870	0.000	1	120.5870	0.000	1	123.0907	1.224	12	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:4:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]C)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH)	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]C)(N[6]N[6]){1|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH){1|N<2>,1|N<3>,2|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt){1|C<4>,1|N<2>,3|C<3>}	122.8900	0.000	1	123.1616	0.720	8	123.1616	0.720	8	123.0907	1.224	12	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:4:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N[6]-3:	C[6](C[6a]C[6a]N[6a])(C[6]C[6]C)(N[6]N[6])	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH)	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]C)(N[6]N[6]){1|Pt<6>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(CCHH){1|N<2>,1|N<3>,2|C<3>}	N[6](C[6]C[6a]C[6])(N[6]C[6]Pt){1|C<4>,1|N<2>,3|C<3>}	123.2004	0.909	7	123.1616	0.720	8	123.1616	0.720	8	123.0907	1.224	12	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-4:	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6])	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CCCH)	N[6](C[6]C[6a]C[6])(C[6]N[6]CC)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(N[6]C[6]){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CCCH){1|C<4>,3|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]CC){1|C<4>,4|C<3>}	123.3910	0.000	1	123.3910	0.000	1	123.3910	0.000	1	123.3910	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	3:4:3:	3:4:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:C[6]-4:C[4]-3:	C[6]-3:S[6]-4:	C[6](C[6]C[4]C[6])(C[6a]C[6a]2)(N[6]S[6])	C[6](C[6]C[6a]N[6])(C[6]O[6]HH)(C[4]C[4]2)	N[6](C[6]C[6a]C[6])(S[6]O[6]OO)	C[6](C[6]C[4]C[6])(C[6a]C[6a]2)(N[6]S[6]){1|O<2>,2|C<3>,2|C<4>,2|O<1>,4|H<1>}	C[6](C[6]C[6a]N[6])(C[6]O[6]HH)(C[4]C[4]2){1|C<4>,1|S<4>,2|C<3>,4|H<1>}	N[6](C[6]C[6a]C[6])(S[6]O[6]OO){1|C<4>,3|C<3>}	123.6160	0.000	1	123.6160	0.000	1	123.6160	0.000	1	123.6160	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	4:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]N[6]H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|Mn<8>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H){1|C<4>,4|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]H){1|Mn<8>,1|C<4>,1|H<1>,2|C<3>}	121.8370	0.000	1	121.8370	0.000	1	122.9890	2.654	2	122.9890	2.654	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:3:2:	4:3:1:	3:3:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H)	N[6](C[6]C[6a]C[6])(C[6]N[6]N)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|N<2>,2|C<3>,2|N<3>,3|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H){1|H<1>,5|C<3>}	N[6](C[6]C[6a]C[6])(C[6]N[6]N){1|C<4>,2|C<3>,2|H<1>}	124.1410	0.000	1	124.1410	0.000	1	122.9890	2.654	2	122.9890	2.654	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:4:2:	3:2:1:	3:3:	C[6]-3:C-4:N[6]-2:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6])	C[6](C[6]N[6]C)(C[6]C[6])(H)	N[6](C[6]C[6]C)(C[6]C[6]H)	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6]){1|C<3>,1|H<1>}	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|H<1>}	122.3030	0.000	1	122.3030	0.000	1	122.3030	0.000	1	122.3030	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:4:2:	3:3:1:	3:3:	C[6]-3:C-4:N[6]-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N[6]-3:	C[6](C[6]N[6]O)(CC[6a]HH)(N[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]N)(O)	N[6](C[6]C[6]C)(N[6]C[6]H)	C[6](C[6]N[6]O)(CC[6a]HH)(N[6]N[6]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(N[6]C[6]N)(O){1|N<3>,1|S<1>}	N[6](C[6]C[6]C)(N[6]C[6]H){1|N<3>,1|O<1>,1|S<1>}	122.3490	0.000	1	122.3490	0.000	1	122.3490	0.000	1	123.9970	5.432	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	3:4:2:	3:3:1:	3:3:	C[6]-3:S-4:N[6]-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]N[6]H)(SC[6a]OO)(N[6]C[6])	C[6](C[6]N[6]S)(N[6]C[6]O)(H)	N[6](C[6]C[6]H)(C[6]C[6]S)	C[6](C[6]N[6]H)(SC[6a]OO)(N[6]C[6]){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]S)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	N[6](C[6]C[6]H)(C[6]C[6]S){1|N<3>,2|H<1>}	125.6450	0.000	1	125.6450	0.000	1	125.6450	0.000	1	123.9970	5.432	2	122.3245	3.329	2168	122.3411	3.414	2232
762	762	914	6:SP2_SP2_SP2	C[6]	C[6]	N[6]	4:3:2:	3:3:1:	3:3:	C[3x6]-4:C[6]-3:N[6]-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(N[6]C[6])	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H)	N[6](C[6]C[3x6]C[6])(C[6]N[6]C)	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(N[6]C[6]){1|N<3>,2|C<3>,3|C<4>,6|H<1>}	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,3|C<4>}	N[6](C[6]C[3x6]C[6])(C[6]N[6]C){1|Fe<8>,1|C<3>,1|H<1>,3|C<4>}	120.0400	0.000	1	120.0400	0.000	1	120.0400	0.000	1	120.0400	0.000	1	122.3245	3.329	2168	122.3411	3.414	2232