2	2	474	0:SP2_SP2_SP3	B[5]	B[5]	C[5]	3:4:4:	3:3:3:	3:3:4:1:	B[5]-3:C[5]-4:C[5]-4:	C[5,5]-3:B[5]-3:C[5]-3:	N[5]-3:B[5]-3:C[5]-4:H-1:	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH)	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2)	C[5](N[5]C[6a]C[5])(B[5]B[5]C[5])(C[5]C[5]CC)(H)	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH){1|C<3>,3|N<3>,6|C<4>}	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2){1|N<3>,3|C<3>,3|H<1>,6|C<4>}	C[5](N[5]C[6a]C[5])(B[5]B[5]C[5])(C[5]C[5]CC)(H){3|C<4>,4|C<3>,4|H<1>}	129.9330	0.000	1	129.9330	0.000	1	129.9330	0.000	1	129.9330	0.000	1	129.9330	0.000	1	129.9330	0.000	1
2	2	474	5:SP2_SP2_SP3	B[5]	B[5]	C[5]	3:4:4:	3:3:3:	4:3:1:1:	B[5]-3:C[5]-4:C[5]-4:	C[5,5]-3:B[5]-3:C[5]-3:	C[5,5]-4:B[5]-3:H-1:H-1:	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH)	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2)	C[5](C[5,5]C[5,5]C[5]C)(B[5]B[5]C[5])(H)2	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH){1|C<3>,3|N<3>,6|C<4>}	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2){1|N<3>,3|C<3>,3|H<1>,6|C<4>}	C[5](C[5,5]C[5,5]C[5]C)(B[5]B[5]C[5])(H)2{1|C<3>,2|C<4>,2|N<3>,3|H<1>}	106.0440	0.000	1	106.0440	0.000	1	106.0440	0.000	1	106.0440	0.000	1	106.0440	0.000	1	106.0440	0.000	1
2	2	542	0:SP2_SP2_SP2	B[5]	B[5]	N[5]	3:3:3:	3:2:2:	3:4:4:	B[5]-3:N[5]-3:N[5]-3:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:C-4:	B[5](B[5]O[5]2)(N[5]C[5]C)2	B[5](B[5]N[5]2)(O[5]C[5])2	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH)	B[5](B[5]O[5]2)(N[5]C[5]C)2{2|C<4>,4|H<1>}	B[5](B[5]N[5]2)(O[5]C[5])2{8|C<4>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|H<1>,2|O<2>}	125.8720	0.195	2	125.8720	0.038	2	126.0350	0.058	4	126.0350	0.058	4	125.0991	1.326	8	125.0991	1.326	8
2	2	542	0:SP2_SP2_SP2	B[5]	B[5]	N[5]	3:3:3:	3:2:2:	3:4:4:	B[5]-3:N[5]-3:N[5]-3:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:C-4:	B[5](B[5]O[5]2)(N[5]C[5]C)2	B[5](B[5]N[5]2)(O[5]C[5])2	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3)	B[5](B[5]O[5]2)(N[5]C[5]C)2{2|C<4>,4|H<1>}	B[5](B[5]N[5]2)(O[5]C[5])2{8|C<4>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	126.1980	0.175	2	126.1980	0.031	2	126.0350	0.058	4	126.0350	0.058	4	125.0991	1.326	8	125.0991	1.326	8
2	2	542	0:SP2_SP2_SP2	B[5]	B[5]	N[5]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:N[5]-3:B[5]-3:	N[5]-3:N[5]-3:B[5]-3:	B[5]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]B[5])2(B[5]N[5]2)	B[5](N[5]C[6a]B[5])2(B[5]N[5]2)	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N)	B[5](N[5]C[6a]B[5])2(B[5]N[5]2){2|B<3>,2|N<3>,6|C<3>}	B[5](N[5]C[6a]B[5])2(B[5]N[5]2){2|B<3>,2|N<3>,6|C<3>}	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N){2|H<1>,3|C<3>,3|N<3>}	124.1633	0.836	4	124.1633	0.700	4	124.1633	0.700	4	124.1633	0.700	4	125.0991	1.326	8	125.0991	1.326	8
2	2	542	5:SP2_SP2_SP2	B[5]	B[5]	N[5]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:B[5]-3:N-3:	N[5]-3:B[5]-3:N-3:	B[5]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC)	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC)	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N)	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC){1|B<3>,3|C<3>}	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC){1|B<3>,3|C<3>}	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N){2|H<1>,3|C<3>,3|N<3>}	102.4120	1.815	4	102.4120	3.292	4	102.4120	3.292	4	102.4120	3.292	4	102.4120	3.292	4	102.4120	3.292	4
2	2	643	0:SP2_SP2_SP2	B[5]	B[5]	C[6a]	4:3:3:	4:3:3:	3:3:3:	P[5]-4:B[5]-3:C[6a]-3:	P[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2)	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2)	C[6a](B[5]B[5]P[5])(C[6a]C[6a]C)2	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|C<4>,2|H<1>}	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|C<4>,2|H<1>}	C[6a](B[5]B[5]P[5])(C[6a]C[6a]C)2{1|C<4>,1|P<4>,2|H<1>,4|C<3>}	129.1915	0.445	4	129.1915	0.198	4	129.1915	0.198	4	129.1915	0.198	4	129.1915	0.198	4	129.1915	0.198	4
2	2	818	0:SP2_SP2_SP2	B[5]	B[5]	C[5]	3:3:3:	3:4:4:	3:3:3:	C[5,5]-3:B[5]-3:C[5]-3:	B[5]-3:C[5]-4:C[5]-4:	B[5]-3:N[5]-3:N[5]-3:	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2)	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH)	C[5](B[5]C[5,5]B[5])(N[5]C[5]C)2	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2){1|N<3>,3|C<3>,3|H<1>,6|C<4>}	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH){1|C<3>,3|N<3>,6|C<4>}	C[5](B[5]C[5,5]B[5])(N[5]C[5]C)2{1|N<3>,5|C<4>}	126.0560	0.000	1	126.0560	0.000	1	126.0560	0.000	1	126.0560	0.000	1	126.0560	0.000	1	126.0560	0.000	1
2	2	818	5:SP2_SP2_SP2	B[5]	B[5]	C[5,5]	3:3:3:	3:4:4:	3:4:3:	C[5,5]-3:B[5]-3:C[5]-3:	B[5]-3:C[5]-4:C[5]-4:	N[5]-3:C[5,5]-4:B[5]-3:	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2)	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH)	C[5,5](N[5]C[6a]C[5])(C[5,5]C[5]2C)(B[5]B[5]C[5])	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2){1|N<3>,3|C<3>,3|H<1>,6|C<4>}	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH){1|C<3>,3|N<3>,6|C<4>}	C[5,5](N[5]C[6a]C[5])(C[5,5]C[5]2C)(B[5]B[5]C[5]){2|C<3>,2|N<3>,3|C<4>,4|H<1>}	103.6490	0.000	1	103.6490	0.000	1	103.6490	0.000	1	103.6490	0.000	1	103.6490	0.000	1	103.6490	0.000	1
2	2	955	5:SP2_SP2_SP3	B[5]	B[5]	P[5]	4:3:3:	4:3:3:	3:3:3:4:	P[5]-4:B[5]-3:C[6a]-3:	P[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2)	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2)	P[5](B[5]C[6a]B[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|C<4>,2|H<1>}	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|C<4>,2|H<1>}	P[5](B[5]C[6a]B[5])(C[6a]C[6a]2)2(C[5]P[5]HH){4|H<1>,9|C<3>}	110.4165	0.553	4	110.4165	0.306	4	110.4165	0.306	4	110.4165	0.306	4	110.4165	0.306	4	110.4165	0.306	4
2	2	956	0:SP2_SP2_SP2	B[5]	B[5]	N	3:3:3:	3:3:3:	3:4:4:	N[5]-3:B[5]-3:N-3:	N[5]-3:B[5]-3:N-3:	B[5]-3:C-4:C-4:	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC)	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC)	N(B[5]B[5]N[5])(CH3)2	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC){1|B<3>,3|C<3>}	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC){1|B<3>,3|C<3>}	N(B[5]B[5]N[5])(CH3)2	132.2460	1.419	4	132.2460	2.015	4	132.2460	2.015	4	132.2460	2.015	4	132.2460	2.015	4	132.2460	2.015	4
2	2	976	0:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CH)	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]CH){1|C<3>,1|H<1>,2|O<2>}	123.4677	1.367	8	123.4677	1.868	8	123.7193	1.480	12	123.7193	1.480	12	123.5202	1.079	24	123.5202	1.079	24
2	2	976	0:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]O[5]2)(O[5]C[5])2{1|C<3>,2|C<4>,3|H<1>}	B[5](B[5]O[5]2)(O[5]C[5])2{1|C<3>,2|C<4>,3|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){1|C<3>,1|H<1>,2|O<2>}	124.2223	0.749	4	124.2223	0.561	4	123.7193	1.480	12	123.7193	1.480	12	123.5202	1.079	24	123.5202	1.079	24
2	2	976	0:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	4:3:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5])	B[5](B[5]O[5]2)(O[5]C[5])2{1|C<3>,2|C<4>,3|H<1>}	B[5](B[5]O[5]2)(O[5]C[5])2{1|C<3>,2|C<4>,3|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5]){2|C<3>,2|H<1>,2|O<2>}	122.6088	0.855	4	122.9095	0.434	8	122.9095	0.434	8	122.9095	0.434	8	123.5202	1.079	24	123.5202	1.079	24
2	2	976	0:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	4:3:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5])	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5]){1|H<1>,2|O<2>,3|C<3>}	123.2103	0.200	4	122.9095	0.434	8	122.9095	0.434	8	122.9095	0.434	8	123.5202	1.079	24	123.5202	1.079	24
2	2	976	0:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:3:3:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:	B[5](B[5]N[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(N[5]C[5]C)2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]N[5]2)(O[5]C[5])2{8|C<4>}	B[5](B[5]O[5]2)(N[5]C[5]C)2{2|C<4>,4|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	124.1445	0.401	4	124.1445	0.161	4	124.1445	0.161	4	124.1445	0.161	4	123.5202	1.079	24	123.5202	1.079	24
2	2	976	5:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]O[5]2)(O[5]C[5])2{6|C<4>}	B[5](B[5]O[5]2)(O[5]C[5])2{6|C<4>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|O<2>}	123.3285	0.367	2	123.3285	0.135	2	123.2993	0.089	4	123.2993	0.089	4	123.2993	0.089	4	123.2993	0.089	4
2	2	976	5:SP2_SP2_SP2	B[5]	B[5]	O[5]	3:2:2:	3:2:2:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<4>,4|H<1>}	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<4>,4|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){2|H<1>,2|O<2>}	123.2700	0.361	2	123.2700	0.130	2	123.2993	0.089	4	123.2993	0.089	4	123.2993	0.089	4	123.2993	0.089	4
2	3	542	0:SP2_SP2_SP2	B[5]	B[5a]	N[5]	3:3:3:	2:2:3:	3:4:4:	B[5a]-3:N[5]-3:N[5]-3:	O[5a]-2:O[5a]-2:B[5]-3:	B[5]-3:C[5]-4:C-4:	B[5](B[5a]O[5a]2)(N[5]C[5]C)2	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2)	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3)	B[5](B[5a]O[5a]2)(N[5]C[5]C)2{2|C<3>,4|H<1>}	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2){2|C<3>,4|C<4>}	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	126.0760	0.000	1	126.0760	0.000	1	126.0760	0.000	1	126.0760	0.000	1	126.0760	0.000	1	126.0760	0.000	1
2	18	474	6:SP2_SP3_SPD6	B[5,6,6]	B[3x3,4x5,14x6]	C[5,3x6]	6:4:2:	6:6:5:5:3:1:	6:3:4:1:	B[3x3,4x5,14x6]-6:C[5,3x6]-4:O-2:	B[5x3,3x5,11x6]-6:B[5x3,3x5,12x6]-6:B[3x3,3x5,13x6]-5:B[3x3,4x5,12x6]-5:B[5,6,6]-3:H-1:	B[3x3,4x5,15x6]-6:B[5,6,6]-3:C[6]-4:H-1:	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC)	B[3x3,4x5,14x6](B[5x3,3x5,11x6]B[3x3,3x5,13x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[5x3,3x5,12x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,13x6]B[5x3,3x5,11x6]2C[3x3,3x5,14x6]H)(B[3x3,4x5,12x6]B[3x3,4x5,15x6]B[5x3,3x5,12x6]2H)(B[5,6,6]C[5,3x6]O)(H)	C[5,3x6](B[3x3,4x5,15x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]C[3x3,3x5,14x6]H)(B[5,6,6]B[3x3,4x5,14x6]O)(C[6]C[6]HH)(H)	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC){1|C<4>,1|C<5>,4|B<6>,7|H<1>}	B[3x3,4x5,14x6](B[5x3,3x5,11x6]B[3x3,3x5,13x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[5x3,3x5,12x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,13x6]B[5x3,3x5,11x6]2C[3x3,3x5,14x6]H)(B[3x3,4x5,12x6]B[3x3,4x5,15x6]B[5x3,3x5,12x6]2H)(B[5,6,6]C[5,3x6]O)(H){1|B<6>,2|C<4>,5|H<1>}	C[5,3x6](B[3x3,4x5,15x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]C[3x3,3x5,14x6]H)(B[5,6,6]B[3x3,4x5,14x6]O)(C[6]C[6]HH)(H){1|B<5>,1|C<4>,4|B<6>,6|H<1>}	121.6660	0.000	1	121.6660	0.000	1	121.6660	0.000	1	121.6660	0.000	1	121.6660	0.000	1	121.6660	0.000	1
2	18	893	0:SP2_SP2_SPD6	B[5,6,6]	B[3x3,4x5,14x6]	O	6:4:2:	6:6:5:5:3:1:	3:4:	B[3x3,4x5,14x6]-6:C[5,3x6]-4:O-2:	B[5x3,3x5,11x6]-6:B[5x3,3x5,12x6]-6:B[3x3,3x5,13x6]-5:B[3x3,4x5,12x6]-5:B[5,6,6]-3:H-1:	B[5,6,6]-3:C-4:	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC)	B[3x3,4x5,14x6](B[5x3,3x5,11x6]B[3x3,3x5,13x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[5x3,3x5,12x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,13x6]B[5x3,3x5,11x6]2C[3x3,3x5,14x6]H)(B[3x3,4x5,12x6]B[3x3,4x5,15x6]B[5x3,3x5,12x6]2H)(B[5,6,6]C[5,3x6]O)(H)	O(B[5,6,6]B[3x3,4x5,14x6]C[5,3x6])(CH3)	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC){1|C<4>,1|C<5>,4|B<6>,7|H<1>}	B[3x3,4x5,14x6](B[5x3,3x5,11x6]B[3x3,3x5,13x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[5x3,3x5,12x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,13x6]B[5x3,3x5,11x6]2C[3x3,3x5,14x6]H)(B[3x3,4x5,12x6]B[3x3,4x5,15x6]B[5x3,3x5,12x6]2H)(B[5,6,6]C[5,3x6]O)(H){1|B<6>,2|C<4>,5|H<1>}	O(B[5,6,6]B[3x3,4x5,14x6]C[5,3x6])(CH3)	118.9780	0.000	1	118.9780	0.000	1	118.9780	0.000	1	118.9780	0.000	1	118.9780	0.000	1	118.9780	0.000	1
2	18	976	0:SP2_SP2_SPD6	B[5]	B[5x3,5x5,20x6]	O[5]	6:2:2:	6:6:6:6:6:3:	3:4:	B[5x3,5x5,20x6]-6:O[5]-2:O[5]-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5]-3:C[5]-4:	B[5](B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(O[5]C[5])2	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)4(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)(B[5]O[5]2)	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC)	B[5](B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(O[5]C[5])2{2|C<6>,3|B<6>,4|C<4>,5|H<1>}	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)4(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)(B[5]O[5]2){1|B<6>,2|C<4>,5|H<1>}	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC){2|C<4>,5|B<6>}	123.6650	0.412	2	123.6650	0.169	2	123.6650	0.169	2	123.6650	0.169	2	123.6650	0.169	2	123.6650	0.169	2
2	217	976	0:SP2_SP2_SP2	B[5]	N[6a]	O[5]	3:2:2:	3:3:3:	3:4:	N[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](N[6a]C[6a]2)(O[5]C[5])2	N[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]N[6a]O[5])(C[5]C[5]CC)	B[5](N[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	N[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,2|C<3>,2|C<4>}	O[5](B[5]N[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.5950	0.535	2	122.5950	0.286	2	122.5950	0.286	2	122.5950	0.286	2	122.5950	0.286	2	122.5950	0.286	2
2	310	976	0:SP2_SP2_SP3	B[5]	Ge	O[5]	4:2:2:	3:3:3:3:	4:3:	Ge-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](GeC[6a]3)(O[5]C[5])2	Ge(C[6a]C[6a]2)3(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]Ge)	B[5](GeC[6a]3)(O[5]C[5])2{4|C<4>}	Ge(C[6a]C[6a]2)3(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]Ge){2|C<4>}	123.7080	2.245	4	123.7080	5.039	4	123.7080	5.039	4	123.7080	5.039	4	123.7080	5.039	4	123.7080	5.039	4
2	362	362	5:SP2_SPD6_SPD6	B[5]	C[5x3,6x5,20x6]	C[5x3,6x5,20x6]	6:6:3:	6:6:6:6:6:3:	6:6:6:6:6:3:	C[5x3,6x5,20x6]-6:C[5x3,6x5,20x6]-6:N-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(NCC)	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N)	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N)	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(NCC){10|B<6>,8|H<1>}	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N){5|H<1>,7|B<6>}	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N){5|H<1>,7|B<6>}	108.4590	0.000	1	108.4590	0.000	1	108.4590	0.000	1	108.4590	0.000	1	108.4590	0.000	1	108.4590	0.000	1
2	362	542	5:SP2_SP2_SPD6	B[5]	C[5x3,6x5,20x6]	N[5]	6:3:3:	6:6:6:6:6:3:	3:3:3:	C[5x3,6x5,20x6]-6:N[5]-3:C[5]-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2)	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5]N[5])	N[5](B[5]C[5x3,6x5,20x6]C[5])(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2)	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2){3|C<4>,4|C<3>,4|H<1>,5|B<6>}	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5]N[5]){1|B<6>,1|C<3>,1|C<4>,2|N<3>,5|H<1>}	N[5](B[5]C[5x3,6x5,20x6]C[5])(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2){2|C<3>,2|C<4>,2|N<3>,6|B<6>}	108.0150	0.143	2	108.0150	0.020	2	108.0150	0.020	2	108.0150	0.020	2	108.0150	0.020	2	108.0150	0.020	2
2	362	818	0:SP2_SP2_SPD6	B[5]	C[5x3,6x5,20x6]	C[5]	6:3:3:	6:6:6:6:6:3:	3:3:3:	C[5x3,6x5,20x6]-6:N[5]-3:C[5]-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5]-3:N[5]-3:N[5]-3:	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2)	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5]N[5])	C[5](B[5]C[5x3,6x5,20x6]N[5])(N[5]C[5]C)2	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2){3|C<4>,4|C<3>,4|H<1>,5|B<6>}	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5]N[5]){1|B<6>,1|C<3>,1|C<4>,2|N<3>,5|H<1>}	C[5](B[5]C[5x3,6x5,20x6]N[5])(N[5]C[5]C)2{1|C<6>,2|C<3>,2|C<4>,4|B<6>}	123.4915	0.094	2	123.4915	0.009	2	123.4915	0.009	2	123.4915	0.009	2	123.4915	0.009	2	123.4915	0.009	2
2	362	956	0:SP2_SP2_SPD6	B[5]	C[5x3,6x5,20x6]	N	6:6:3:	6:6:6:6:6:3:	3:4:4:	C[5x3,6x5,20x6]-6:C[5x3,6x5,20x6]-6:N-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5]-3:	B[5]-3:C-4:C-4:	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(NCC)	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N)	N(B[5]C[5x3,6x5,20x6]2)(CCCH)2	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])2(NCC){10|B<6>,8|H<1>}	C[5x3,6x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)2(C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5]C[5x3,6x5,20x6]N){5|H<1>,7|B<6>}	N(B[5]C[5x3,6x5,20x6]2)(CCCH)2	125.7700	0.349	2	125.7700	0.122	2	125.7700	0.122	2	125.7700	0.122	2	125.7700	0.122	2	125.7700	0.122	2
2	442	778	6:SP2_SPD5_SPD5	B[5,5,6x6]	B[3,3,3x5,10x6]	C[3,3,3x5,11x6]	5:5:1:	5:5:6:3:1:	5:6:5:3:4:	C[3,3,3x5,11x6]-5:B[3,3,3x5,10x6]-5:H-1:	B[3x3,3x5,8x6]-5:B[3x3,3x5,8x6]-5:B[5x3,5,5,8x6]-6:B[5,5,6x6]-3:H-1:	B[3x3,3x5,9x6]-5:B[5x3,5,5,8x6]-6:B[3x3,3x5,8x6]-5:B[5,5,6x6]-3:C[6]-4:	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H)	B[3,3,3x5,10x6](B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5x3,5,5,8x6]B[3x3,3x5,8x6]2B[5x3,3x5,5x6]2H)(B[5,5,6x6]C[3,3,3x5,11x6]H)(H)	C[3,3,3x5,11x6](B[3x3,3x5,9x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]C[6])(B[5x3,5,5,8x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]2H)(B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5,5,6x6]B[3,3,3x5,10x6]H)(C[6]C[6]HH)	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H){2|B<6>,2|C<4>,7|H<1>}	B[3,3,3x5,10x6](B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5x3,5,5,8x6]B[3x3,3x5,8x6]2B[5x3,3x5,5x6]2H)(B[5,5,6x6]C[3,3,3x5,11x6]H)(H){1|B<6>,2|C<4>,3|H<1>}	C[3,3,3x5,11x6](B[3x3,3x5,9x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]C[6])(B[5x3,5,5,8x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]2H)(B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5,5,6x6]B[3,3,3x5,10x6]H)(C[6]C[6]HH){1|B<4>,1|B<6>,1|C<4>,8|H<1>}	140.6290	0.000	1	140.6290	0.000	1	140.6290	0.000	1	140.6290	0.000	1	140.6290	0.000	1	140.6290	0.000	1
2	442	951	0:SP2_SP-NON_SPD5	B[5,5,6x6]	B[3,3,3x5,10x6]	H	5:5:1:	5:5:6:3:1:	3:	C[3,3,3x5,11x6]-5:B[3,3,3x5,10x6]-5:H-1:	B[3x3,3x5,8x6]-5:B[3x3,3x5,8x6]-5:B[5x3,5,5,8x6]-6:B[5,5,6x6]-3:H-1:	B[5,5,6x6]-3:	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H)	B[3,3,3x5,10x6](B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5x3,5,5,8x6]B[3x3,3x5,8x6]2B[5x3,3x5,5x6]2H)(B[5,5,6x6]C[3,3,3x5,11x6]H)(H)	H(B[5,5,6x6]B[3,3,3x5,10x6]C[3,3,3x5,11x6])	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H){2|B<6>,2|C<4>,7|H<1>}	B[3,3,3x5,10x6](B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5x3,5,5,8x6]B[3x3,3x5,8x6]2B[5x3,3x5,5x6]2H)(B[5,5,6x6]C[3,3,3x5,11x6]H)(H){1|B<6>,2|C<4>,3|H<1>}	H(B[5,5,6x6]B[3,3,3x5,10x6]C[3,3,3x5,11x6])	105.9320	0.000	1	105.9320	0.000	1	105.9320	0.000	1	105.9320	0.000	1	105.9320	0.000	1	105.9320	0.000	1
2	466	474	0:SP2_SP3_SP3	B[5]	C[6]	C[5]	4:3:4:	3:4:4:1:	3:4:3:3:	C[5]-4:N[5]-3:C[6]-4:	B[5]-3:C[6]-4:C[6]-4:H-1:	B[5]-3:C[6]-4:C[5]-3:C-3:	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H)	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H)	C[5](B[5]C[6]N[5])(C[6]C[6]2H)(C[5]P[5]C)(COO)	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H){4|C<4>,5|C<3>,5|H<1>}	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H){1|P<4>,2|C<4>,3|C<3>,4|H<1>}	C[5](B[5]C[6]N[5])(C[6]C[6]2H)(C[5]P[5]C)(COO){3|C<3>,4|C<4>,5|H<1>}	126.8990	0.000	1	126.8990	0.000	1	126.8990	0.000	1	126.8990	0.000	1	126.9760	0.012	2	126.9760	0.012	2
2	466	474	0:SP2_SP3_SP3	B[5]	C[6]	C[5]	4:4:2:	3:4:4:1:	3:3:4:1:	C[5]-4:C[6]-4:N[5]-2:	B[5]-3:C[6]-4:C[6]-4:H-1:	N[5]-3:B[5]-3:C[6]-4:H-1:	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5])	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H)	C[5](N[5]C[6a]C[5])(B[5]C[6]N[5])(C[6]C[6]2H)(H)	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5]){2|C<3>,4|C<4>,5|H<1>}	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	C[5](N[5]C[6a]C[5])(B[5]C[6]N[5])(C[6]C[6]2H)(H){3|C<3>,4|C<4>,5|H<1>}	127.0530	0.000	1	127.0530	0.000	1	127.0530	0.000	1	127.0530	0.000	1	126.9760	0.012	2	126.9760	0.012	2
2	466	542	0:SP2_SP2_SP3	B[5]	C[6]	N[5]	4:3:4:	3:4:4:1:	4:3:3:	C[5]-4:N[5]-3:C[6]-4:	B[5]-3:C[6]-4:C[6]-4:H-1:	P[5]-4:B[5]-3:C[6a]-3:	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H)	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H)	N[5](P[5]C[6a]2C[5])(B[5]C[5]C[6])(C[6a]C[6a]2)	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H){4|C<4>,5|C<3>,5|H<1>}	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H){1|P<4>,2|C<4>,3|C<3>,4|H<1>}	N[5](P[5]C[6a]2C[5])(B[5]C[5]C[6])(C[6a]C[6a]2){1|H<1>,5|C<4>,8|C<3>}	120.6540	0.000	1	120.6540	0.000	1	120.6540	0.000	1	120.6540	0.000	1	120.6540	0.000	1	120.6540	0.000	1
2	466	727	0:SP2_SP2_SP3	B[5]	C[6]	C[5,6a]	3:4:4:	3:4:4:1:	3:3:3:	C[5,6a]-3:P[5]-4:C[6]-4:	B[5]-3:C[6]-4:C[6]-4:H-1:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H)	C[6](B[5]C[5,6a]P[5])(C[6]C[6]HH)2(H)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6]P[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H){2|C<4>,3|C<3>,5|H<1>}	C[6](B[5]C[5,6a]P[5])(C[6]C[6]HH)2(H){3|C<3>,3|C<4>,4|H<1>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6]P[5])(C[6a]C[6a]H){2|H<1>,3|C<3>,4|C<4>}	130.5010	0.000	1	130.5010	0.000	1	130.5010	0.000	1	130.5010	0.000	1	130.5010	0.000	1	130.5010	0.000	1
2	466	955	0:SP2_SP3_SP3	B[5]	C[6]	P[5]	3:4:4:	3:4:4:1:	3:3:4:4:	C[5,6a]-3:P[5]-4:C[6]-4:	B[5]-3:C[6]-4:C[6]-4:H-1:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H)	C[6](B[5]C[5,6a]P[5])(C[6]C[6]HH)2(H)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H){2|C<4>,3|C<3>,5|H<1>}	C[6](B[5]C[5,6a]P[5])(C[6]C[6]HH)2(H){3|C<3>,3|C<4>,4|H<1>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6])(CCCH)2{2|C<4>,2|H<1>,3|C<3>}	128.7280	0.000	1	128.7280	0.000	1	128.7280	0.000	1	128.7280	0.000	1	128.7280	0.000	1	128.7280	0.000	1
2	466	960	0:SP2_SP2_SP3	B[5]	C[6]	N[5]	4:4:2:	3:4:4:1:	3:3:	C[5]-4:C[6]-4:N[5]-2:	B[5]-3:C[6]-4:C[6]-4:H-1:	C[5]-3:B[5]-3:	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5])	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H)	N[5](C[5]C[6a]N[5])(B[5]C[5]C[6])	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5]){2|C<3>,4|C<4>,5|H<1>}	C[6](B[5]C[5]N[5])(C[6]C[6]HH)2(H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	N[5](C[5]C[6a]N[5])(B[5]C[5]C[6]){2|H<1>,3|C<3>,3|C<4>}	125.5200	0.000	1	125.5200	0.000	1	125.5200	0.000	1	125.5200	0.000	1	125.5200	0.000	1	125.5200	0.000	1
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	3:3:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	N[6]-3:N[6]-3:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]N[6]2H)(O[5]C[5])2	C[6](N[6]C[6a]C[6])2(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]N[6]2H)(O[5]C[5])2{4|C<3>,4|C<4>}	C[6](N[6]C[6a]C[6])2(B[5]O[5]2)(H){2|O<1>,3|C<4>,4|C<3>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,2|C<4>,2|N<3>}	122.4850	2.892	2	122.4850	8.364	2	122.4850	8.364	2	122.4850	8.364	2	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	3:3:3:3:	3:4:	C[6]-4:O[5]-2:O[5]-2:	N[6]-3:N[6]-3:B[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6]B[5]N[6]2)(O[5]C[5])2	C[6](N[6]C[6a]C[6])2(B[5]O[5]2)2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]B[5]N[6]2)(O[5]C[5])2{2|O<2>,4|C<3>,4|C<4>}	C[6](N[6]C[6a]C[6])2(B[5]O[5]2)2{2|O<1>,4|C<3>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,2|C<4>,2|N<3>}	122.7428	2.756	4	122.7428	7.596	4	122.7428	7.596	4	122.7428	7.596	4	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	3:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6,6a]-3:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]C[6]H)(O[5]C[5])2	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]CH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]C[6]H)(O[5]C[5])2{1|H<1>,3|C<3>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]CH)(B[5]O[5]2)(H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	123.9045	4.581	2	123.9045	20.989	2	123.9045	20.989	2	123.9045	20.989	2	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	3:4:3:3:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6,6a]-3:C[6]-4:B[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]B[5]C[6])(O[5]C[5])2	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HH)(B[5]O[5]2)2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]B[5]C[6])(O[5]C[5])2{2|C<3>,2|H<1>,2|O<2>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HH)(B[5]O[5]2)2{2|C<3>,3|H<1>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,1|C<3>,3|C<4>}	123.5055	2.728	4	123.5055	7.443	4	123.5055	7.443	4	123.5055	7.443	4	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:3:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[5,6]-4:C[6]-3:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6]H)(O[5]C[5])2	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6]H)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(B[5]O[5]2)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	123.0645	3.505	2	123.0645	12.286	2	123.0645	12.286	2	123.0645	12.286	2	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:3:3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[5,6]-4:B[5]-3:C[6]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6]C)(O[5]C[5])2	C[6](C[5,6]C[5,6]C[5]H)(B[5]O[5]2)(C[6]C[6]H)(CH3)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6]C)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(B[5]O[5]2)(C[6]C[6]H)(CH3){1|C<3>,1|N<3>,1|O<1>,2|H<1>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	123.0235	1.855	4	123.0235	3.442	4	123.0235	3.442	4	123.0235	3.442	4	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:3:4:3:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6,6]-4:B[6a]-3:C[6]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6]B[6a]C[6])(O[5]C[5])2	C[6](C[6,6]C[6,6]C[6]H)(B[6a]N[6a]2)(C[6]C[6]HH)(B[5]O[5]2)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6]B[6a]C[6])(O[5]C[5])2{2|N<3>,3|H<1>,7|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(B[6a]N[6a]2)(C[6]C[6]HH)(B[5]O[5]2){2|C<3>,5|C<4>,7|H<1>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,4|C<4>}	124.1550	4.787	2	124.1550	22.916	2	124.1550	22.916	2	124.1550	22.916	2	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6,6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6]C[6]H)(O[5]C[5])2	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6]C[6]H)(O[5]C[5])2{3|H<1>,7|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H){2|H<1>,8|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.2970	1.045	2	123.2970	1.092	2	123.2970	1.092	2	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]B[5]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|B<3>,3|H<1>,6|C<4>}	C[6](C[6]B[5]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H){2|H<1>,2|O<2>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.3710	1.564	2	123.6620	1.643	4	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]B[5]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|B<3>,3|H<1>,6|C<4>}	C[6](C[6]B[5]C[6]H)(C[6]C[6]HH)(B[5]O[5]2)(H){3|C<4>,3|H<1>,3|O<2>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.9530	1.464	2	123.6620	1.643	4	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]C[5]C[6]O)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|C<3>,1|O<2>,2|H<1>,6|C<4>}	C[6](C[6]C[5]C[6]O)(C[6]C[6]HH)(B[5]O[5]2)(H){1|O<1>,1|O<2>,3|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.6250	0.414	2	123.6250	0.172	2	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]C[6]CH)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|C<3>,3|H<1>,6|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]HH)(B[5]O[5]2)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.1760	2.329	2	123.4030	7.247	12	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]C[6]CH)(C[6]C[6]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|C<3>,3|H<1>,6|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]HH)(B[5]O[5]2)(H){1|O<1>,2|H<1>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.4484	2.871	10	123.4030	7.247	12	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	466	976	0:SP2_SP2_SP3	B[5]	C[6]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[6]-4:O[5]-2:O[5]-2:	C[6]-4:C[6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]HH)(B[5]O[5]2)(H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|N<3>,2|C<3>,3|H<1>,4|C<4>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]HH)(B[5]O[5]2)(H){2|C<4>,5|C<3>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.0418	1.064	4	123.0418	1.132	4	123.4046	4.243	22	123.3956	3.923	24	123.3136	5.018	44	123.3136	5.018	44
2	474	474	0:SP2_SP3_SP3	B[5]	C[5]	C[5]	3:4:4:	4:3:1:1:	3:3:4:1:	B[5]-3:C[5]-4:C[5]-4:	C[5,5]-4:B[5]-3:H-1:H-1:	N[5]-3:B[5]-3:C[5]-4:H-1:	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH)	C[5](C[5,5]C[5,5]C[5]C)(B[5]B[5]C[5])(H)2	C[5](N[5]C[6a]C[5])(B[5]B[5]C[5])(C[5]C[5]CC)(H)	B[5](B[5]C[5,5]C[5])(C[5]C[5]N[5]H)(C[5]C[5,5]HH){1|C<3>,3|N<3>,6|C<4>}	C[5](C[5,5]C[5,5]C[5]C)(B[5]B[5]C[5])(H)2{1|C<3>,2|C<4>,2|N<3>,3|H<1>}	C[5](N[5]C[6a]C[5])(B[5]B[5]C[5])(C[5]C[5]CC)(H){3|C<4>,4|C<3>,4|H<1>}	123.9050	0.000	1	123.9050	0.000	1	123.9050	0.000	1	123.9050	0.000	1	123.9050	0.000	1	123.9050	0.000	1
2	474	474	5:SP2_SP3_SP3	B[5,5]	C[5,5,6]	C[5,5,6]	4:4:3:	3:3:4:4:	3:4:3:4:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	B[5,5]-3:C[5,6]-3:C[5,6]-4:Si-4:	B[5,5]-3:C[5,6]-4:C[5,6]-3:Si-4:	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2)	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C[6a])(C[5,6]C[5,6]HH)(SiC3)	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]HH)(C[5,6]C[5,6]B)(SiC3)	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2){1|B<3>,3|C<3>,6|H<1>}	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C[6a])(C[5,6]C[5,6]HH)(SiC3){1|Si<4>,1|B<3>,2|H<1>,4|C<3>}	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]HH)(C[5,6]C[5,6]B)(SiC3){1|Si<4>,2|H<1>,3|C<3>}	98.6794	0.000	1	98.6794	0.000	1	98.6794	0.000	1	98.6794	0.000	1	98.9243	0.141	3	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5,5]	C[5,5,6]	C[5,5,6]	4:4:3:	4:3:3:4:	4:3:3:4:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	C[3x5,6,6]-4:B[5,5]-3:C[5,6]-3:C-4:	C[3x5,6,6]-4:B[5,5]-3:C[5,6]-3:C-4:	B[5,5](C[5,5,6]C[3x5,6,6]C[5,6]C)2(C[6a]C[6a]2)	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3)	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3)	B[5,5](C[5,5,6]C[3x5,6,6]C[5,6]C)2(C[6a]C[6a]2){2|H<1>,4|C<3>,4|C<4>}	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3){1|H<1>,1|O<1>,1|O<2>,3|C<3>,5|C<4>}	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3){1|H<1>,1|O<1>,1|O<2>,3|C<3>,5|C<4>}	99.3560	0.000	1	99.3560	0.000	1	99.3560	0.000	1	99.0467	0.191	2	98.9243	0.141	3	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5,5]	C[5,5,6]	C[5,5,6]	4:4:3:	4:3:3:4:	4:3:3:4:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	C[5,5,6]-4:B[5,5]-3:C[5,6]-3:C-4:	C[5,5,6]-4:B[5,5]-3:C[5,6]-3:C-4:	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2)	C[5,5,6](C[5,5,6]C[5,5,6]C[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH)	C[5,5,6](C[5,5,6]C[5,5,6]B[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH)	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]C[5,5,6]C[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH){1|B<3>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]C[5,5,6]B[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH){3|C<4>,5|C<3>}	98.7374	0.000	1	98.7374	0.000	1	98.7374	0.000	1	99.0467	0.191	2	98.9243	0.141	3	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5,5]	C[5,5]	C[5]	4:3:4:	3:3:3:4:	3:3:4:1:	C[5,5]-4:N[5]-3:C[5]-4:	C[5,6a]-3:B[5,5]-3:C[5]-3:Si-4:	B[5,5]-3:C[5]-3:Si-4:H-1:	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH)	C[5,5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5]N[5])(C[5]C[5]B)(SiC3)	C[5](B[5,5]C[5,5]N[5])(C[5]C[6a]C[5])(SiC3)(H)	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH){1|B<3>,5|C<3>}	C[5,5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5]N[5])(C[5]C[5]B)(SiC3){1|Si<4>,2|H<1>,4|C<3>}	C[5](B[5,5]C[5,5]N[5])(C[5]C[6a]C[5])(SiC3)(H){1|Si<4>,1|B<3>,5|C<3>}	112.1260	0.000	1	112.1260	0.000	1	112.1260	0.000	1	112.1260	0.000	1	112.5875	0.426	2	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5,5]	C[5,5]	C[5]	4:4:2:	4:3:3:4:	3:3:3:4:	C[5]-4:C[5,5]-4:O[5]-2:	C[5]-4:B[5,5]-3:C[5]-3:C-4:	B[5,5]-3:C[6a]-3:C[5]-3:C-4:	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5])	C[5,5](C[5]C[6a]2C[5])(B[5,5]C[5]O[5])(C[5]C[5]C)(CH3)	C[5](B[5,5]C[5,5]O[5])(C[6a]C[6a]2)(C[5]C[5]C)(CH3)	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5]){2|C<4>,2|H<1>,4|C<3>}	C[5,5](C[5]C[6a]2C[5])(B[5,5]C[5]O[5])(C[5]C[5]C)(CH3){2|C<4>,2|H<1>,5|C<3>}	C[5](B[5,5]C[5,5]O[5])(C[6a]C[6a]2)(C[5]C[5]C)(CH3){2|C<3>,2|H<1>,4|C<4>}	113.0490	0.000	1	113.0490	0.000	1	113.0490	0.000	1	113.0490	0.000	1	112.5875	0.426	2	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5]	C[5]	C[5]	4:3:4:	3:3:4:1:	3:4:3:1:	C[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[5]-4:H-1:	B[5]-3:C[5]-4:B-3:H-1:	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH)	C[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]CH)(H)	C[5](B[5]C[6a]C[5])(C[5]C[5]HH)(BC[6a]2)(H)	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH){1|C<4>,2|F<1>,3|H<1>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]CH)(H){1|B<3>,2|F<1>,3|H<1>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]HH)(BC[6a]2)(H){1|C<4>,2|H<1>,3|C<3>}	107.8340	0.000	1	107.8340	0.000	1	107.8340	0.000	1	107.8340	0.000	1	108.1569	0.848	9	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5]	C[5]	C[5]	4:4:2:	3:3:3:1:	3:3:3:3:	C[5]-4:C[5]-4:S-2:	C[5]-3:C[6a]-3:B[5]-3:H-1:	C[5]-3:C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a])	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]S)(H)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)2(B[5]C[5]S)	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a]){8|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]S)(H){2|H<1>,7|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)2(B[5]C[5]S){5|H<1>,8|C<3>}	109.4310	0.000	1	109.4310	0.000	1	109.4310	0.000	1	109.4310	0.000	1	108.1569	0.848	9	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5]	C[5]	C[5]	4:4:3:	3:3:3:1:	3:3:3:1:	C[5]-4:C[5]-4:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	B[5]-3:C[5]-3:C[6a]-3:H-1:	B[5](C[5]C[6a]C[5]H)2(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H)	B[5](C[5]C[6a]C[5]H)2(C[6a]C[6a]2){2|F<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|H<1>,2|F<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|H<1>,2|F<1>,8|C<3>}	106.2150	0.000	1	106.2150	0.000	1	106.2150	0.000	1	106.2150	0.000	1	108.1569	0.848	9	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5]	C[5]	C[5]	4:4:3:	3:3:3:1:	3:3:3:4:	C[5]-4:C[5]-4:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	B[5]-3:C[5]-3:C[6a]-3:Si-4:	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(SiC3)	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|Si<4>,2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(SiC3){3|H<1>,8|C<3>}	108.4616	0.367	5	108.4616	0.135	5	108.4616	0.135	5	108.4616	0.135	5	108.1569	0.848	9	106.8114	21.318	14
2	474	474	5:SP2_SP3_SP3	B[5]	C[5]	C[5]	4:4:3:	4:4:3:1:	4:3:1:1:	C[5]-4:C[5]-4:N-3:	B-4:C[5]-4:B[5]-3:H-1:	C[5]-4:B[5]-3:H-1:H-1:	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC)	C[5](BC[6a]2N[6])(C[5]C[5]HH)(B[5]C[5]N)(H)	C[5](C[5]C[5]HH)(B[5]C[5]N)(H)2	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC){4|H<1>}	C[5](BC[6a]2N[6])(C[5]C[5]HH)(B[5]C[5]N)(H){4|H<1>}	C[5](C[5]C[5]HH)(B[5]C[5]N)(H)2{1|B<4>,3|H<1>}	107.6240	0.000	1	107.6240	0.000	1	107.6240	0.000	1	107.6240	0.000	1	108.1569	0.848	9	106.8114	21.318	14
2	474	490	0:SP2_SP3_SP3	B[5]	C[5]	C	4:2:4:	3:3:4:1:	3:4:4:1:	C[5]-4:O[5]-2:C-4:	N[5]-3:B[5]-3:C-4:H-1:	B[5]-3:C-4:C-4:H-1:	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH)	C[5](N[5]C[6a]C[5])(B[5]O[5]C)(CCCH)(H)	C(B[5]C[5]O[5])(CCHH)2(H)	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH){1|C<3>,1|O<1>}	C[5](N[5]C[6a]C[5])(B[5]O[5]C)(CCCH)(H){1|O<1>,2|C<3>}	C(B[5]C[5]O[5])(CCHH)2(H)	128.7950	0.000	1	128.7950	0.000	1	128.7950	0.000	1	128.7950	0.000	1	128.7950	0.000	1	128.7950	0.000	1
2	474	542	0:SP2_SP2_SP3	B[5,5]	C[5]	N[5]	4:3:4:	3:3:4:1:	3:3:3:	C[5,5]-4:N[5]-3:C[5]-4:	B[5,5]-3:C[5]-3:Si-4:H-1:	C[5,6a]-3:B[5,5]-3:C[6a]-3:	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH)	C[5](B[5,5]C[5,5]N[5])(C[5]C[6a]C[5])(SiC3)(H)	N[5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5,5]C[5])(C[6a]C[6a]2)	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH){1|B<3>,5|C<3>}	C[5](B[5,5]C[5,5]N[5])(C[5]C[6a]C[5])(SiC3)(H){1|Si<4>,1|B<3>,5|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5,5]C[5])(C[6a]C[6a]2){2|Si<4>,4|H<1>,6|C<3>}	135.8230	0.000	1	135.8230	0.000	1	135.8230	0.000	1	135.8230	0.000	1	135.8230	0.000	1	130.5825	54.926	2
2	474	542	0:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:3:	3:3:1:1:	3:4:4:	N[5]-3:C[5]-4:N[5]-3:	C[5,6a]-3:B[5]-3:H-1:H-1:	B[5]-3:C[5]-4:C[5]-4:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]2)(H)2	N[5](B[5]C[5]N[5])(C[5]C[5]HH)2	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2){2|C<4>,4|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]2)(H)2{1|H<1>,2|C<4>,3|C<3>}	N[5](B[5]C[5]N[5])(C[5]C[5]HH)2{3|C<3>,6|H<1>}	125.3420	0.000	1	125.3420	0.000	1	125.3420	0.000	1	125.3420	0.000	1	125.3420	0.000	1	130.5825	54.926	2
2	474	542	5:SP2_SP2_SP3	B[5,5]	C[5,5]	N[5]	4:3:4:	3:3:3:4:	3:3:3:	C[5,5]-4:N[5]-3:C[5]-4:	C[5,6a]-3:B[5,5]-3:C[5]-3:Si-4:	C[5,6a]-3:B[5,5]-3:C[6a]-3:	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH)	C[5,5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5]N[5])(C[5]C[5]B)(SiC3)	N[5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5,5]C[5])(C[6a]C[6a]2)	B[5,5](C[5,5]C[5,6a]C[5]Si)(N[5]C[5,6a]C[6a])(C[5]C[5]SiH){1|B<3>,5|C<3>}	C[5,5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5]N[5])(C[5]C[5]B)(SiC3){1|Si<4>,2|H<1>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(B[5,5]C[5,5]C[5])(C[6a]C[6a]2){2|Si<4>,4|H<1>,6|C<3>}	108.9750	0.000	1	108.9750	0.000	1	108.9750	0.000	1	108.9750	0.000	1	108.9750	0.000	1	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5,6]	N[5]	4:3:3:	4:3:3:1:	3:3:1:	C[5,6]-4:C[6a]-3:N[5]-3:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	N[5,6]-3:B[5]-3:H-1:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H)	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H)	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H){1|B<3>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H){1|B<3>,2|H<1>,4|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	105.5240	0.000	1	105.6945	0.058	2	105.6945	0.058	2	105.6945	0.058	2	105.6945	0.058	2	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5,6]	N[5]	4:3:3:	4:3:3:1:	3:3:1:	C[5,6]-4:C[6a]-3:N[5]-3:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	N[5,6]-3:B[5]-3:H-1:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H)	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H)	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H){1|B<3>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H){1|B<3>,2|H<1>,4|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H){1|C<4>,1|H<1>,6|C<3>}	105.8650	0.000	1	105.6945	0.058	2	105.6945	0.058	2	105.6945	0.058	2	105.6945	0.058	2	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:3:4:	3:3:1:1:	3:3:2:	N[5]-3:C[6a]-3:C[5]-4:	B[5]-3:C[5]-3:H-1:H-1:	B[5]-3:C[6a]-3:N[5]-2:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(H)2	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5])	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,5|C<3>}	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(H)2{5|C<3>}	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]){4|H<1>,5|C<3>}	103.1412	0.127	4	103.1412	0.016	4	103.1412	0.016	4	103.1412	0.016	4	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:2:	3:3:3:4:	3:3:3:	N[5]-3:C[5]-4:N-2:	B[5]-3:C[5]-3:C[5]-3:C-4:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a])	C[5](B[5]N[5]N)(C[5]C[5]H)(C[5]N[5]2)(CC3)	N[5](C[6a]C[6a]2)(B[5]C[5]N)(C[5]C[5]C)	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a]){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[5](B[5]N[5]N)(C[5]C[5]H)(C[5]N[5]2)(CC3){3|C<3>,3|C<4>}	N[5](C[6a]C[6a]2)(B[5]C[5]N)(C[5]C[5]C){1|H<1>,3|C<3>,3|C<4>}	104.3730	0.000	1	104.3730	0.000	1	104.3730	0.000	1	104.3730	0.000	1	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:2:	3:3:4:4:	3:3:3:	N[5]-3:C[5]-4:O-2:	B[5]-3:C[5]-3:Si-4:Si-4:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](B[5]N[5]O)(C[5]C[5]H)(SiC3)2	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,1|H<1>,2|C<3>}	C[5](B[5]N[5]O)(C[5]C[5]H)(SiC3)2{1|B<3>,1|C<3>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,1|H<1>,2|C<3>,2|C<4>}	107.7760	0.000	1	107.7760	0.000	1	107.7760	0.000	1	107.7760	0.000	1	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:2:	4:3:4:4:	3:3:3:	N[5]-3:C[5]-4:O-2:	C[5]-4:B[5]-3:Si-4:Si-4:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,2|C<3>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2{1|B<3>,1|C<3>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,2|C<3>,2|C<4>,2|H<1>}	109.5420	0.000	1	108.5537	0.825	3	108.5537	0.825	3	108.5537	0.825	3	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:2:	4:3:4:4:	3:3:3:	N[5]-3:C[5]-4:O-2:	C[5]-4:B[5]-3:Si-4:Si-4:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<4>,2|C<3>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2{1|B<4>,1|C<3>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,2|C<3>,2|C<4>,2|H<1>}	108.0595	0.431	2	108.5537	0.825	3	108.5537	0.825	3	108.5537	0.825	3	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:3:	3:3:1:1:	3:3:3:	N[5]-3:C[5]-4:N-3:	C[5,6a]-3:B[5]-3:H-1:H-1:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]N)(H)2	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]N)	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC){4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]N)(H)2{1|H<1>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]N){2|C<4>,3|H<1>,4|C<3>}	105.2960	0.000	1	105.2960	0.000	1	105.2960	0.000	1	106.2215	1.713	2	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	3:4:3:	3:3:1:1:	3:3:3:	N[5]-3:C[5]-4:N[5]-3:	C[5,6a]-3:B[5]-3:H-1:H-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]2)(H)2	N[5](C[5,6a]C[5,6a]C[6a])(B[5]C[5]N[5])(C[6a]C[6a]2)	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2){2|C<4>,4|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]2)(H)2{1|H<1>,2|C<4>,3|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(B[5]C[5]N[5])(C[6a]C[6a]2){3|H<1>,4|C<3>,4|C<4>}	107.1470	0.000	1	107.1470	0.000	1	107.1470	0.000	1	106.2215	1.713	2	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	4:3:3:	3:3:3:1:	3:3:2:	C[5]-4:N[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	B[5]-3:C[6a]-3:N[5]-2:	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2)	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)(H)	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5])	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2){2|H<1>,7|C<3>}	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)(H){2|H<1>,7|C<3>}	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]){1|H<1>,2|C<4>,6|C<3>}	104.1210	0.000	1	104.1210	0.000	1	104.1210	0.000	1	104.1210	0.000	1	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	4:3:4:	3:4:3:3:	4:3:3:	C[5]-4:N[5]-3:C[6]-4:	B[5]-3:C[6]-4:C[5]-3:C-3:	P[5]-4:B[5]-3:C[6a]-3:	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H)	C[5](B[5]C[6]N[5])(C[6]C[6]2H)(C[5]P[5]C)(COO)	N[5](P[5]C[6a]2C[5])(B[5]C[5]C[6])(C[6a]C[6a]2)	B[5](C[5]C[5]C[6]C)(N[5]C[6a]P[5])(C[6]C[6]2H){4|C<4>,5|C<3>,5|H<1>}	C[5](B[5]C[6]N[5])(C[6]C[6]2H)(C[5]P[5]C)(COO){3|C<3>,4|C<4>,5|H<1>}	N[5](P[5]C[6a]2C[5])(B[5]C[5]C[6])(C[6a]C[6a]2){1|H<1>,5|C<4>,8|C<3>}	112.2860	0.000	1	112.2860	0.000	1	112.2860	0.000	1	112.2860	0.000	1	106.0942	8.708	13	106.2243	7.527	16
2	474	542	5:SP2_SP3_SP3	B[5]	C[5]	N[5]	3:4:3:	3:3:4:1:	3:3:3:	N[5]-3:C[5]-4:N-3:	B[5]-3:B[5]-3:C-4:H-1:	N[5]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC)	C[5](B[5]N[5]N)2(CH3)(H)	N[5](N[5]C[6a]B[5])(C[6a]C[6a]2)(B[5]C[5]N)	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC){1|N<3>,3|C<3>}	C[5](B[5]N[5]N)2(CH3)(H){2|C<3>}	N[5](N[5]C[6a]B[5])(C[6a]C[6a]2)(B[5]C[5]N){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	109.2415	0.404	2	109.2415	0.163	2	109.2415	0.163	2	109.2415	0.163	2	109.2415	0.163	2	109.2415	0.163	2
2	474	562	5:SP2_SP3_SP3	B[5]	C[5]	Si[5]	4:4:2:	3:3:4:4:	3:3:3:1:	Si[5]-4:C[5]-4:O-2:	C[5,6a]-3:B[5]-3:Si-4:Si-4:	C[5,6a]-3:C[6a]-3:B[5]-3:H-1:	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]Si[5]O)(SiC3)2	Si[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]O)(H)	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC){4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]Si[5]O)(SiC3)2{2|H<1>,3|C<3>}	Si[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]O)(H){2|Si<4>,3|C<4>,4|C<3>}	106.6400	0.000	1	106.6400	0.000	1	106.6400	0.000	1	106.6400	0.000	1	106.6400	0.000	1	106.6400	0.000	1
2	474	643	0:SP2_SP2_SP3	B[5,5]	C[5,5,6]	C[6a]	4:4:3:	3:3:4:4:	3:3:3:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	B[5,5]-3:C[5,6]-3:C[5,6]-4:Si-4:	B[5,5]-3:C[6a]-3:C[6a]-3:	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2)	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C[6a])(C[5,6]C[5,6]HH)(SiC3)	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2){1|B<3>,3|C<3>,6|H<1>}	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C[6a])(C[5,6]C[5,6]HH)(SiC3){1|Si<4>,1|B<3>,2|H<1>,4|C<3>}	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2{2|Si<4>,2|C<4>,2|H<1>,3|C<3>}	129.1030	0.000	1	129.1030	0.000	1	129.1030	0.000	1	129.1030	0.000	1	130.4650	1.185	6	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5,5]	C[5,5,6]	C[6a]	4:4:3:	3:4:3:4:	3:3:3:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	B[5,5]-3:C[5,6]-4:C[5,6]-3:Si-4:	B[5,5]-3:C[6a]-3:C[6a]-3:	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2)	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]HH)(C[5,6]C[5,6]B)(SiC3)	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2	B[5,5](C[5,5,6]C[5,6]2Si)2(C[6a]C[6a]2){1|B<3>,3|C<3>,6|H<1>}	C[5,5,6](B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]HH)(C[5,6]C[5,6]B)(SiC3){1|Si<4>,2|H<1>,3|C<3>}	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2{2|Si<4>,2|C<4>,2|H<1>,3|C<3>}	131.8890	0.000	1	131.8890	0.000	1	131.8890	0.000	1	131.8890	0.000	1	130.4650	1.185	6	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5,5]	C[5,5,6]	C[6a]	4:4:3:	4:3:3:4:	3:3:3:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	C[3x5,6,6]-4:B[5,5]-3:C[5,6]-3:C-4:	B[5,5]-3:C[6a]-3:C[6a]-3:	B[5,5](C[5,5,6]C[3x5,6,6]C[5,6]C)2(C[6a]C[6a]2)	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3)	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2	B[5,5](C[5,5,6]C[3x5,6,6]C[5,6]C)2(C[6a]C[6a]2){2|H<1>,4|C<3>,4|C<4>}	C[5,5,6](C[3x5,6,6]C[3x5,6,6]C[5,5,6]C[5])(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CH3){1|H<1>,1|O<1>,1|O<2>,3|C<3>,5|C<4>}	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2{2|H<1>,3|C<3>,4|C<4>}	130.2895	1.001	2	130.2895	1.001	2	130.2895	1.001	2	130.4495	0.680	4	130.4650	1.185	6	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5,5]	C[5,5,6]	C[6a]	4:4:3:	4:3:3:4:	3:3:3:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	C[5,5,6]-4:B[5,5]-3:C[5,6]-3:C-4:	B[5,5]-3:C[6a]-3:C[6a]-3:	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2)	C[5,5,6](C[5,5,6]C[5,5,6]B[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH)	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]C[5,5,6]B[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH){3|C<4>,5|C<3>}	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2{2|H<1>,3|C<3>,4|C<4>}	129.9250	0.000	1	129.9250	0.000	1	130.6095	0.937	2	130.4495	0.680	4	130.4650	1.185	6	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5,5]	C[5,5,6]	C[6a]	4:4:3:	4:3:3:4:	3:3:3:	C[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	C[5,5,6]-4:B[5,5]-3:C[5,6]-3:C-4:	B[5,5]-3:C[6a]-3:C[6a]-3:	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2)	C[5,5,6](C[5,5,6]C[5,5,6]C[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH)	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2	B[5,5](C[5,5,6]C[5,5,6]C[5,6]C)2(C[6a]C[6a]2){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]C[5,5,6]C[5]C)(B[5,5]C[5,5,6]C[6a])(C[5,6]C[5,6]C)(CCHH){1|B<3>,3|C<3>,4|C<4>}	C[6a](B[5,5]C[5,5,6]2)(C[6a]C[6a]H)2{2|H<1>,3|C<3>,4|C<4>}	131.2940	0.000	1	131.2940	0.000	1	130.6095	0.937	2	130.4495	0.680	4	130.4650	1.185	6	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5,5,6]	C[6a]	4:3:3:	4:4:3:4:	3:3:3:	C[5,5,6]-4:C[6a]-3:C[5]-3:	C[5,5,6]-4:C[5,5,6]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C)	C[5,5,6](C[5,5,6]B[5,5]C[5,6]C)(C[5,5,6]C[5,5,6]C[5]C)(B[5]C[6a]C[5])(CCHH)	C[6a](B[5]C[5,5,6]C[5])(C[6a]C[6a]H)2	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]B[5,5]C[5,6]C)(C[5,5,6]C[5,5,6]C[5]C)(B[5]C[6a]C[5])(CCHH){4|C<3>,4|C<4>}	C[6a](B[5]C[5,5,6]C[5])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,4|C<4>}	127.8950	0.000	1	127.8950	0.000	1	127.8950	0.000	1	127.8950	0.000	1	127.8950	0.000	1	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5,6]	C[6a]	3:4:3:	4:3:3:1:	3:3:3:	N[5,5a]-3:C[5,6]-4:C[6a]-3:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)	C[5,6](C[5,6,6]N[5,5a,6]C[6,6]C)(B[5]N[5,5a]C[6a])(C[6]C[6]C)(H)	C[6a](B[5]N[5,5a]C[5,6])(C[6a]C[6a]2)2	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2){1|B<3>,1|O<1>,1|O<2>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]N[5,5a,6]C[6,6]C)(B[5]N[5,5a]C[6a])(C[6]C[6]C)(H){1|B<3>,1|H<1>,5|C<3>}	C[6a](B[5]N[5,5a]C[5,6])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,3|H<1>,7|C<3>}	137.6900	0.000	1	137.6900	0.000	1	137.6900	0.000	1	137.6900	0.000	1	130.4055	26.603	4	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5,6]	C[6a]	4:3:2:	4:3:3:1:	3:3:3:	C[5,6]-4:C[6a]-3:N[5]-2:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6])	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H)	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]){1|B<3>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H){1|B<3>,1|H<1>,4|C<3>}	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,3|H<1>,6|C<3>}	126.2570	0.000	1	126.2570	0.000	1	126.2570	0.000	1	126.2570	0.000	1	130.4055	26.603	4	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5,6]	C[6a]	4:3:3:	4:3:3:1:	3:3:3:	C[5,6]-4:C[6a]-3:N[5]-3:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H)	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H)	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H){1|B<3>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H){1|B<3>,2|H<1>,4|C<3>}	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,4|H<1>,6|C<3>}	128.8375	2.149	2	128.8375	4.618	2	128.8375	4.618	2	128.8375	4.618	2	130.4055	26.603	4	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:3:4:	3:3:1:1:	3:3:3:	C[5]-3:C[6a]-3:C[5]-4:	B[5]-3:N[5]-3:H-1:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH)	C[5](B[5]C[6a]C[5])(N[5]C[5]C)(H)2	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH){3|C<4>,5|C<3>}	C[5](B[5]C[6a]C[5])(N[5]C[5]C)(H)2{4|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,3|C<3>,4|H<1>}	122.2890	0.000	1	122.2890	0.000	1	122.2890	0.000	1	125.9718	5.382	5	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:3:4:	3:3:1:1:	3:3:3:	N[5]-3:C[6a]-3:C[5]-4:	B[5]-3:C[5]-3:H-1:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(H)2	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,5|C<3>}	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(H)2{5|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|N<2>,3|C<3>,4|H<1>}	126.8925	1.235	4	126.8925	1.524	4	126.8925	1.524	4	125.9718	5.382	5	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:3:4:	3:4:3:1:	3:3:3:	C[5,6a]-3:C[6a]-3:C[5]-4:	B[5]-3:C[5]-4:C-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH)	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(CC[5]H)(H)	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]C)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH){2|H<1>,3|C<4>,4|C<3>}	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(CC[5]H)(H){4|C<3>}	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]C)2{1|C<4>,3|H<1>,4|C<3>}	127.8050	0.000	1	127.8050	0.000	1	127.8050	0.000	1	127.8050	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:4:2:	3:4:1:1:	3:3:3:	C[6a]-3:C[5]-4:O[5]-2:	B[5]-3:C[5]-4:H-1:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5])	C[5](B[5]C[6a]O[5])(C[5]C[5]HP)(H)2	C[6a](B[5]C[5]O[5])(C[6a]C[6a]F)2	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5]){1|B<4>,1|P<4>,2|C<3>,2|F<1>,2|H<1>}	C[5](B[5]C[6a]O[5])(C[5]C[5]HP)(H)2{1|B<4>,1|H<1>,2|C<3>}	C[6a](B[5]C[5]O[5])(C[6a]C[6a]F)2{1|C<3>,2|C<4>,2|F<1>,2|H<1>}	127.6870	0.000	1	127.6870	0.000	1	127.6870	0.000	1	127.6870	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:4:3:	3:3:1:1:	3:3:3:	C[6a]-3:C[5]-4:C[5]-3:	B[5]-3:N[5]-3:H-1:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P)	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(H)2	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P){3|C<3>,3|C<4>}	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(H)2{1|C<4>,1|P<3>,4|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,1|P<3>,2|C<3>,4|H<1>}	119.2870	0.000	1	119.2870	0.000	1	119.2870	0.000	1	119.2870	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	3:4:3:	3:3:3:1:	3:3:3:	C[6a]-3:C[5]-4:C[5]-3:	B[5]-3:N[5]-3:C-3:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H)	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(CCH)(H)	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H){2|C<4>,4|C<3>}	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(CCH)(H){1|H<1>,5|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,3|C<3>,4|H<1>}	122.4690	0.000	1	122.4690	0.000	1	122.4690	0.000	1	122.4690	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:3:3:	3:3:3:1:	3:3:3:	C[5]-4:N[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2)	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)(H)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2){2|H<1>,7|C<3>}	C[5](B[5]C[6a]N[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)(H){2|H<1>,7|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|N<2>,3|H<1>,4|C<3>}	128.5690	0.000	1	128.5690	0.000	1	128.5690	0.000	1	128.5690	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:3:3:	3:3:4:4:	3:3:3:	C[5]-4:C[6a]-3:C[5]-3:	B[5]-3:C[5]-3:Si-4:Si-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)2	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)2{1|B<3>,1|C<2>,4|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){2|Si<4>,1|C<2>,2|H<1>,3|C<3>}	134.8330	0.000	1	134.8330	0.000	1	134.8330	0.000	1	134.8330	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:3:4:	3:3:4:1:	3:3:3:	C[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[5]-4:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH)	C[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]CH)(H)	C[6a](C[6a]C[6a]F)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH){1|C<4>,2|F<1>,3|H<1>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]C[5]CH)(H){1|B<3>,2|F<1>,3|H<1>,4|C<3>}	C[6a](C[6a]C[6a]F)2(B[5]C[5]2){1|B<3>,2|C<3>,2|C<4>,2|F<1>,2|H<1>}	124.3310	0.000	1	124.3310	0.000	1	124.3310	0.000	1	124.3310	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:3:4:	3:4:1:1:	3:3:3:	B[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[5]-4:H-1:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH)	C[5](B[5]C[6a]B[5])(C[5]N[5]HH)(H)2	C[6a](B[5]B[5]C[5])(C[6a]C[6a]C)2	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,4|C<3>,4|C<4>}	C[5](B[5]C[6a]B[5])(C[5]N[5]HH)(H)2{1|I<1>,2|C<4>,3|C<3>}	C[6a](B[5]B[5]C[5])(C[6a]C[6a]C)2{1|C<4>,1|I<1>,1|N<4>,2|C<3>,4|H<1>}	122.6870	0.000	1	122.6870	0.000	1	122.6870	0.000	1	122.6870	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:3:4:	3:4:3:1:	3:3:3:	C[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[5]-4:B-3:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH)	C[5](B[5]C[6a]C[5])(C[5]C[5]HH)(BC[6a]2)(H)	C[6a](C[6a]C[6a]F)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(C[5]C[5]BH){1|C<4>,2|F<1>,3|H<1>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]HH)(BC[6a]2)(H){1|C<4>,2|H<1>,3|C<3>}	C[6a](C[6a]C[6a]F)2(B[5]C[5]2){1|B<3>,2|C<3>,2|C<4>,2|F<1>,2|H<1>}	127.8150	0.000	1	127.8150	0.000	1	127.8150	0.000	1	127.8150	0.000	1	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:4:3:	3:3:3:1:	3:3:3:	C[5]-4:C[5]-4:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5]H)2(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H)	C[6a](C[6a]C[6a]F)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5]H)2(C[6a]C[6a]2){2|F<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|H<1>,2|F<1>,8|C<3>}	C[6a](C[6a]C[6a]F)2(B[5]C[5]2){2|F<1>,2|H<1>,5|C<3>}	126.5035	2.966	2	126.5035	8.799	2	125.4053	3.473	7	125.4053	3.473	7	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:4:3:	3:3:3:1:	3:3:3:	C[5]-4:C[5]-4:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:H-1:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H)	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(H){1|Si<4>,2|H<1>,8|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){1|Si<4>,3|H<1>,5|C<3>}	124.9660	1.471	5	124.9660	2.165	5	125.4053	3.473	7	125.4053	3.473	7	125.9874	8.871	26	127.2427	12.534	37
2	474	643	0:SP2_SP2_SP3	B[5]	C[5]	C[6a]	4:4:3:	3:3:3:4:	3:3:3:	C[5]-4:C[5]-4:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:Si-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(SiC3)	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	B[5](C[5]C[6a]C[5]Si)(C[5]C[6a]C[5]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)(SiC3){3|H<1>,8|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){1|Si<4>,3|H<1>,5|C<3>}	126.4986	1.610	5	126.4986	2.592	5	126.4986	2.592	5	126.4986	2.592	5	125.9874	8.871	26	127.2427	12.534	37
2	474	727	5:SP2_SP2_SP3	B[5]	C[5,5]	C[5,6a]	3:4:3:	3:3:4:4:	3:3:3:	C[5,6a]-3:C[5,5]-4:N-3:	N[5,5]-3:B[5]-3:C[5]-4:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC)	C[5,5](N[5,5]C[5,6a]C[5])(B[5]C[5,6a]N)(C[5]C[5]CC)(CCCH)	C[5,6a](C[5,6a]N[5,5]C[6a])(B[5]C[5,5]N)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC){1|H<1>,2|C<3>,4|C<4>}	C[5,5](N[5,5]C[5,6a]C[5])(B[5]C[5,6a]N)(C[5]C[5]CC)(CCCH){2|C<3>,2|C<4>,2|H<1>}	C[5,6a](C[5,6a]N[5,5]C[6a])(B[5]C[5,5]N)(C[6a]C[6a]H){1|C<3>,1|H<1>,4|C<4>}	105.0370	0.000	1	105.0370	0.000	1	105.0370	0.000	1	105.0370	0.000	1	105.0370	0.000	1	105.9015	1.495	2
2	474	727	5:SP2_SP2_SP3	B[5]	C[5]	C[5,6a]	3:3:4:	3:4:3:1:	3:3:3:	C[5,6a]-3:C[6a]-3:C[5]-4:	B[5]-3:C[5]-4:C-3:H-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH)	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(CC[5]H)(H)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]C)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH){2|H<1>,3|C<4>,4|C<3>}	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(CC[5]H)(H){4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]C){4|C<3>,5|H<1>}	106.7660	0.000	1	106.7660	0.000	1	106.7660	0.000	1	106.7660	0.000	1	106.7660	0.000	1	105.9015	1.495	2
2	474	786	0:SP2_SP3_SP3	B[5]	C[5]	B[5]	4:4:2:	3:3:4:1:	3:3:3:1:	C[5]-4:B[5]-4:O[5]-2:	N[5]-3:B[5]-3:C[5]-4:H-1:	B[5]-3:C[5]-3:C[5]-3:H-1:	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5])	C[5](N[5]C[6a]C[5])(B[5]B[5]O[5])(C[5]C[5]CC)(H)	B[5](B[5]C[5]O[5])(C[5]C[5]N[5])(C[5]C[5]H)(H)	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5]){1|C<3>,1|H<1>,1|N<3>,6|C<4>}	C[5](N[5]C[6a]C[5])(B[5]B[5]O[5])(C[5]C[5]CC)(H){2|C<4>,3|H<1>,5|C<3>}	B[5](B[5]C[5]O[5])(C[5]C[5]N[5])(C[5]C[5]H)(H){1|C<3>,1|H<1>,1|N<3>,6|C<4>}	142.0660	0.000	1	142.0660	0.000	1	142.0660	0.000	1	142.0660	0.000	1	142.0660	0.000	1	142.0660	0.000	1
2	474	786	5:SP2_SP3_SP3	B[5]	C[5]	B[5]	4:3:4:	3:4:1:1:	3:3:4:1:	B[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[5]-4:H-1:H-1:	B[5]-3:C[6a]-3:N[5]-4:I-1:	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH)	C[5](B[5]C[6a]B[5])(C[5]N[5]HH)(H)2	B[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]CC)(I)	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,4|C<3>,4|C<4>}	C[5](B[5]C[6a]B[5])(C[5]N[5]HH)(H)2{1|I<1>,2|C<4>,3|C<3>}	B[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]CC)(I){2|C<4>,4|C<3>,4|H<1>}	102.8190	0.000	1	102.8190	0.000	1	102.8190	0.000	1	102.8190	0.000	1	102.8190	0.000	1	102.8190	0.000	1
2	474	813	5:SP2_SP3_SP3	B[5]	C[5,6]	N[5,5a]	3:4:3:	4:3:3:1:	3:3:3:	N[5,5a]-3:C[5,6]-4:C[6a]-3:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	N[5,5a,6]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)	C[5,6](C[5,6,6]N[5,5a,6]C[6,6]C)(B[5]N[5,5a]C[6a])(C[6]C[6]C)(H)	N[5,5a](N[5,5a,6]C[5,6,6]B[5a,6])(B[5]C[5,6]C[6a])(C[5a]O[5a]O)	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2){1|B<3>,1|O<1>,1|O<2>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]N[5,5a,6]C[6,6]C)(B[5]N[5,5a]C[6a])(C[6]C[6]C)(H){1|B<3>,1|H<1>,5|C<3>}	N[5,5a](N[5,5a,6]C[5,6,6]B[5a,6])(B[5]C[5,6]C[6a])(C[5a]O[5a]O){1|C<4>,1|H<1>,5|C<3>}	105.2540	0.000	1	105.2540	0.000	1	105.2540	0.000	1	105.2540	0.000	1	105.2540	0.000	1	105.2540	0.000	1
2	474	818	5:SP2_SP2_SP3	B[5]	C[5,5,6]	C[5]	4:3:3:	4:4:3:4:	3:3:4:	C[5,5,6]-4:C[6a]-3:C[5]-3:	C[5,5,6]-4:C[5,5,6]-4:B[5]-3:C-4:	B[5]-3:C[5]-3:C-4:	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C)	C[5,5,6](C[5,5,6]B[5,5]C[5,6]C)(C[5,5,6]C[5,5,6]C[5]C)(B[5]C[6a]C[5])(CCHH)	C[5](B[5]C[5,5,6]C[6a])(C[5]C[5,5,6]C)(CCHH)	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[5,5,6](C[5,5,6]B[5,5]C[5,6]C)(C[5,5,6]C[5,5,6]C[5]C)(B[5]C[6a]C[5])(CCHH){4|C<3>,4|C<4>}	C[5](B[5]C[5,5,6]C[6a])(C[5]C[5,5,6]C)(CCHH){2|C<3>,4|C<4>}	107.2700	0.000	1	107.2700	0.000	1	107.2700	0.000	1	107.2700	0.000	1	107.2700	0.000	1	105.5426	1.162	5
2	474	818	5:SP2_SP2_SP3	B[5]	C[5]	C[5]	3:3:4:	3:3:1:1:	3:3:3:	C[5]-3:C[6a]-3:C[5]-4:	B[5]-3:N[5]-3:H-1:H-1:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH)	C[5](B[5]C[6a]C[5])(N[5]C[5]C)(H)2	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH){3|C<4>,5|C<3>}	C[5](B[5]C[6a]C[5])(N[5]C[5]C)(H)2{4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	105.5290	0.000	1	105.5290	0.000	1	105.5290	0.000	1	105.5290	0.000	1	105.1107	0.306	4	105.5426	1.162	5
2	474	818	5:SP2_SP2_SP3	B[5]	C[5]	C[5]	3:4:3:	3:3:1:1:	3:3:3:	C[6a]-3:C[5]-4:C[5]-3:	B[5]-3:N[5]-3:H-1:H-1:	B[5]-3:C[5]-3:P-3:	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P)	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(H)2	C[5](B[5]C[6a]C[5])(C[5]N[5]C)(PC[6a]2)	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P){3|C<3>,3|C<4>}	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(H)2{1|C<4>,1|P<3>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]N[5]C)(PC[6a]2){2|H<1>,3|C<3>}	105.3960	0.000	1	105.3960	0.000	1	105.3960	0.000	1	105.3960	0.000	1	105.1107	0.306	4	105.5426	1.162	5
2	474	818	5:SP2_SP2_SP3	B[5]	C[5]	C[5]	3:4:3:	3:3:3:1:	3:3:1:	C[6a]-3:C[5]-4:C[5]-3:	B[5]-3:N[5]-3:C-3:H-1:	B[5]-3:C[5]-3:H-1:	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H)	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(CCH)(H)	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(H)	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H){2|C<4>,4|C<3>}	C[5](B[5]C[6a]C[5])(N[5]C[6a]C[5])(CCH)(H){1|H<1>,5|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(H){1|H<1>,6|C<3>}	105.2140	0.000	1	105.2140	0.000	1	105.2140	0.000	1	105.2140	0.000	1	105.1107	0.306	4	105.5426	1.162	5
2	474	818	5:SP2_SP2_SP3	B[5]	C[5]	C[5]	4:3:3:	3:3:4:4:	3:3:2:	C[5]-4:C[6a]-3:C[5]-3:	B[5]-3:C[5]-3:Si-4:Si-4:	B[5]-3:C[5]-3:C-2:	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)2	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(CO)	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)2{1|B<3>,1|C<2>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(CO){2|Si<4>,3|C<3>}	104.3040	0.000	1	104.3040	0.000	1	104.3040	0.000	1	104.3040	0.000	1	105.1107	0.306	4	105.5426	1.162	5
2	474	863	0:SP2_SP2_SP3	B[5]	C[5]	O	4:2:1:	4:3:1:1:	3:	C[5]-4:O[5]-2:O-1:	C[5,6]-4:B[5]-3:H-1:H-1:	B[5]-3:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O)	C[5](C[5,6]C[5,6]C[6]H)(B[5]O[5]O)(H)2	O(B[5]C[5]O[5])	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6]C[6]H)(B[5]O[5]O)(H)2{5|C<4>}	O(B[5]C[5]O[5])	127.8730	0.000	1	127.8730	0.000	1	127.8730	0.000	1	127.8730	0.000	1	127.8730	0.000	1	127.8730	0.000	1
2	474	893	0:SP2_SP2_SP3	B[5,6,6]	C[5,3x6]	O	6:4:2:	6:3:4:1:	3:4:	B[3x3,4x5,14x6]-6:C[5,3x6]-4:O-2:	B[3x3,4x5,15x6]-6:B[5,6,6]-3:C[6]-4:H-1:	B[5,6,6]-3:C-4:	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC)	C[5,3x6](B[3x3,4x5,15x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]C[3x3,3x5,14x6]H)(B[5,6,6]B[3x3,4x5,14x6]O)(C[6]C[6]HH)(H)	O(B[5,6,6]B[3x3,4x5,14x6]C[5,3x6])(CH3)	B[5,6,6](B[3x3,4x5,14x6]B[3x3,3x5,13x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]H)(C[5,3x6]B[3x3,4x5,15x6]C[6]H)(OC){1|C<4>,1|C<5>,4|B<6>,7|H<1>}	C[5,3x6](B[3x3,4x5,15x6]B[3x3,4x5,12x6]B[5x3,3x5,11x6]B[5x3,3x5,12x6]C[3x3,3x5,14x6]H)(B[5,6,6]B[3x3,4x5,14x6]O)(C[6]C[6]HH)(H){1|B<5>,1|C<4>,4|B<6>,6|H<1>}	O(B[5,6,6]B[3x3,4x5,14x6]C[5,3x6])(CH3)	117.1410	0.000	1	117.1410	0.000	1	117.1410	0.000	1	117.1410	0.000	1	117.1410	0.000	1	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	3:4:2:	3:3:4:4:	3:4:	N[5]-3:C[5]-4:O-2:	B[5]-3:C[5]-3:Si-4:Si-4:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](B[5]N[5]O)(C[5]C[5]H)(SiC3)2	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,1|H<1>,2|C<3>}	C[5](B[5]N[5]O)(C[5]C[5]H)(SiC3)2{1|B<3>,1|C<3>}	O(B[5]C[5]N[5])(CH3)	122.5750	0.000	1	122.5750	0.000	1	122.5750	0.000	1	122.5750	0.000	1	129.5765	64.684	8	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	3:4:2:	4:3:4:4:	3:4:	N[5]-3:C[5]-4:O-2:	C[5]-4:B[5]-3:Si-4:Si-4:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,2|C<3>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2{1|B<3>,1|C<3>}	O(B[5]C[5]N[5])(CH3)	121.0160	0.000	1	133.3593	114.327	3	133.3593	114.327	3	133.3593	114.327	3	129.5765	64.684	8	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	3:4:2:	4:3:4:4:	3:4:	N[5]-3:C[5]-4:O-2:	C[5]-4:B[5]-3:Si-4:Si-4:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<4>,2|C<3>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]N[5]O)(SiC3)2{1|B<4>,1|C<3>}	O(B[5]C[5]N[5])(CH3)	139.5310	0.344	2	133.3593	114.327	3	133.3593	114.327	3	133.3593	114.327	3	129.5765	64.684	8	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	4:2:2:	4:3:1:1:	3:1:	C[5]-4:O[5]-2:O-2:	C[4,5]-4:B[5]-3:H-1:H-1:	B[5]-3:H-1:	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH)	C[5](C[4,5]C[4,5]C[6a]C[4])(B[5]O[5]O)(H)2	O(B[5]C[5]O[5])(H)	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH){1|C<3>,1|H<1>,2|C<4>}	C[5](C[4,5]C[4,5]C[6a]C[4])(B[5]O[5]O)(H)2{1|C<4>,2|C<3>,3|H<1>}	O(B[5]C[5]O[5])(H)	128.0570	0.000	1	128.0570	0.000	1	128.0570	0.000	1	131.5093	9.022	3	129.5765	64.684	8	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	4:2:2:	4:3:1:1:	3:1:	C[5]-4:O[5]-2:O-2:	C[5,6]-4:B[5]-3:H-1:H-1:	B[5]-3:H-1:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH)	C[5](C[5,6]C[5,6]C[6,6]H)(B[5]O[5]O)(H)2	O(B[5]C[5]O[5])(H)	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6]C[6,6]H)(B[5]O[5]O)(H)2{5|C<4>}	O(B[5]C[5]O[5])(H)	133.2355	0.408	2	133.2355	0.166	2	133.2355	0.166	2	131.5093	9.022	3	129.5765	64.684	8	128.1948	73.781	9
2	474	893	0:SP2_SP2_SP3	B[5]	C[5]	O	4:4:2:	3:3:4:4:	3:4:	Si[5]-4:C[5]-4:O-2:	C[5,6a]-3:B[5]-3:Si-4:Si-4:	B[5]-3:C-4:	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]Si[5]O)(SiC3)2	O(B[5]Si[5]C[5])(CC3)	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC){4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]Si[5]O)(SiC3)2{2|H<1>,3|C<3>}	O(B[5]Si[5]C[5])(CC3)	119.4310	0.000	1	119.4310	0.000	1	119.4310	0.000	1	119.4310	0.000	1	129.5765	64.684	8	128.1948	73.781	9
2	474	909	0:SP2_SP2_SP3	B[5]	C[5]	S	4:4:2:	3:3:3:1:	3:3:	C[5]-4:C[5]-4:S-2:	C[5]-3:C[6a]-3:B[5]-3:H-1:	C[6a]-3:B[5]-3:	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a])	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]S)(H)	S(C[6a]C[6a,6a]C[6a])(B[5]C[5]2)	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a]){8|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]S)(H){2|H<1>,7|C<3>}	S(C[6a]C[6a,6a]C[6a])(B[5]C[5]2)	129.3340	0.000	1	129.3340	0.000	1	129.3340	0.000	1	129.3340	0.000	1	125.2505	33.350	2	125.2505	33.350	2
2	474	909	0:SP2_SP2_SP3	B[5]	C[5]	S	4:4:2:	3:3:3:3:	3:3:	C[5]-4:C[5]-4:S-2:	C[5]-3:C[6a]-3:C[6a]-3:B[5]-3:	C[6a]-3:B[5]-3:	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a])	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)2(B[5]C[5]S)	S(C[6a]C[6a,6a]C[6a])(B[5]C[5]2)	B[5](C[5]C[6a]2C[5])(C[5]C[6a]C[5]H)(SC[6a]){8|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)2(B[5]C[5]S){5|H<1>,8|C<3>}	S(C[6a]C[6a,6a]C[6a])(B[5]C[5]2)	121.1670	0.000	1	121.1670	0.000	1	121.1670	0.000	1	121.1670	0.000	1	125.2505	33.350	2	125.2505	33.350	2
2	474	941	0:SP2_SP2_SP3	B[5]	C[5]	N	3:4:2:	3:3:3:4:	3:3:	N[5]-3:C[5]-4:N-2:	B[5]-3:C[5]-3:C[5]-3:C-4:	B[5]-3:C[6a]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a])	C[5](B[5]N[5]N)(C[5]C[5]H)(C[5]N[5]2)(CC3)	N(B[5]C[5]N[5])(C[6a]C[6a]2)	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a]){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[5](B[5]N[5]N)(C[5]C[5]H)(C[5]N[5]2)(CC3){3|C<3>,3|C<4>}	N(B[5]C[5]N[5])(C[6a]C[6a]2)	126.0460	0.000	1	126.0460	0.000	1	126.0460	0.000	1	126.0460	0.000	1	126.0460	0.000	1	126.0460	0.000	1
2	474	956	0:SP2_SP2_SP3	B[5]	C[5,5]	N	3:4:3:	3:3:4:4:	3:4:4:	C[5,6a]-3:C[5,5]-4:N-3:	N[5,5]-3:B[5]-3:C[5]-4:C-4:	B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC)	C[5,5](N[5,5]C[5,6a]C[5])(B[5]C[5,6a]N)(C[5]C[5]CC)(CCCH)	N(B[5]C[5,6a]C[5,5])(CCHH)2	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC){1|H<1>,2|C<3>,4|C<4>}	C[5,5](N[5,5]C[5,6a]C[5])(B[5]C[5,6a]N)(C[5]C[5]CC)(CCCH){2|C<3>,2|C<4>,2|H<1>}	N(B[5]C[5,6a]C[5,5])(CCHH)2	127.5200	0.000	1	127.5200	0.000	1	127.5200	0.000	1	127.5200	0.000	1	127.5200	0.000	1	127.2243	2.195	6
2	474	956	0:SP2_SP2_SP3	B[5]	C[5]	N	3:4:3:	3:3:1:1:	3:4:4:	N[5]-3:C[5]-4:N-3:	C[5,6a]-3:B[5]-3:H-1:H-1:	B[5]-3:C-4:C-4:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC)	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]N)(H)2	N(B[5]C[5]N[5])(CCCH)2	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC){4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(B[5]N[5]N)(H)2{1|H<1>,3|C<3>}	N(B[5]C[5]N[5])(CCCH)2	128.1510	0.000	1	128.1510	0.000	1	128.1510	0.000	1	128.1510	0.000	1	127.1652	2.718	5	127.2243	2.195	6
2	474	956	0:SP2_SP2_SP3	B[5]	C[5]	N	3:4:3:	3:3:4:1:	3:4:4:	N[5]-3:C[5]-4:N-3:	B[5]-3:B[5]-3:C-4:H-1:	B[5]-3:C-4:C-4:	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC)	C[5](B[5]N[5]N)2(CH3)(H)	N(B[5]C[5]N[5])(CH3)2	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC){1|N<3>,3|C<3>}	C[5](B[5]N[5]N)2(CH3)(H){2|C<3>}	N(B[5]C[5]N[5])(CH3)2	127.8340	1.541	2	127.8340	2.376	2	127.8340	2.376	2	127.8340	2.376	2	127.1652	2.718	5	127.2243	2.195	6
2	474	956	0:SP2_SP2_SP3	B[5]	C[5]	N	4:4:3:	4:3:1:1:	3:4:4:	C[5]-4:C[5]-4:N-3:	C[5]-4:B[5]-3:H-1:H-1:	B[5]-3:C-4:C-4:	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC)	C[5](C[5]C[5]HH)(B[5]C[5]N)(H)2	N(B[5]C[5]2)(CCCH)2	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC){4|H<1>}	C[5](C[5]C[5]HH)(B[5]C[5]N)(H)2{1|B<4>,3|H<1>}	N(B[5]C[5]2)(CCCH)2	124.6020	0.000	1	124.6020	0.000	1	124.6020	0.000	1	124.6020	0.000	1	127.1652	2.718	5	127.2243	2.195	6
2	474	956	0:SP2_SP2_SP3	B[5]	C[5]	N	4:4:3:	4:4:3:1:	3:4:4:	C[5]-4:C[5]-4:N-3:	B-4:C[5]-4:B[5]-3:H-1:	B[5]-3:C-4:C-4:	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC)	C[5](BC[6a]2N[6])(C[5]C[5]HH)(B[5]C[5]N)(H)	N(B[5]C[5]2)(CCCH)2	B[5](C[5]C[5]BH)(C[5]C[5]HH)(NCC){4|H<1>}	C[5](BC[6a]2N[6])(C[5]C[5]HH)(B[5]C[5]N)(H){4|H<1>}	N(B[5]C[5]2)(CCCH)2	127.4050	0.000	1	127.4050	0.000	1	127.4050	0.000	1	127.4050	0.000	1	127.1652	2.718	5	127.2243	2.195	6
2	474	960	5:SP2_SP2_SP3	B[5]	C[5,6]	N[5]	4:3:2:	4:3:3:1:	3:3:	C[5,6]-4:C[6a]-3:N[5]-2:	C[5,6,6]-4:B[5]-3:C[6]-3:H-1:	N[5,6]-3:B[5]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6])	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H)	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]){1|B<3>,2|C<4>,6|C<3>}	C[5,6](C[5,6,6]C[6,6]N[5,6]C)(B[5]C[6a]N[5])(C[6]C[6]C)(H){1|B<3>,1|H<1>,4|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a]){1|C<4>,1|H<1>,6|C<3>}	110.5220	0.000	1	110.5220	0.000	1	110.5220	0.000	1	110.5220	0.000	1	110.5220	0.000	1	108.9745	4.790	2
2	474	960	5:SP2_SP2_SP3	B[5]	C[5]	N[5]	4:4:2:	3:3:4:1:	3:3:	C[5]-4:C[6]-4:N[5]-2:	N[5]-3:B[5]-3:C[6]-4:H-1:	C[5]-3:B[5]-3:	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5])	C[5](N[5]C[6a]C[5])(B[5]C[6]N[5])(C[6]C[6]2H)(H)	N[5](C[5]C[6a]N[5])(B[5]C[5]C[6])	B[5](C[5]C[6]N[5]H)(C[6]C[6]2H)(N[5]C[5]){2|C<3>,4|C<4>,5|H<1>}	C[5](N[5]C[6a]C[5])(B[5]C[6]N[5])(C[6]C[6]2H)(H){3|C<3>,4|C<4>,5|H<1>}	N[5](C[5]C[6a]N[5])(B[5]C[5]C[6]){2|H<1>,3|C<3>,3|C<4>}	107.4270	0.000	1	107.4270	0.000	1	107.4270	0.000	1	107.4270	0.000	1	107.4270	0.000	1	108.9745	4.790	2
2	474	976	0:SP2_SP2_SP3	B[5,5]	C[5]	O[5]	4:4:2:	3:3:3:4:	3:4:	C[5]-4:C[5,5]-4:O[5]-2:	B[5,5]-3:C[6a]-3:C[5]-3:C-4:	B[5,5]-3:C[5]-4:	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5])	C[5](B[5,5]C[5,5]O[5])(C[6a]C[6a]2)(C[5]C[5]C)(CH3)	O[5](B[5,5]C[5,5]C[5])(C[5]C[5]HH)	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5]){2|C<4>,2|H<1>,4|C<3>}	C[5](B[5,5]C[5,5]O[5])(C[6a]C[6a]2)(C[5]C[5]C)(CH3){2|C<3>,2|H<1>,4|C<4>}	O[5](B[5,5]C[5,5]C[5])(C[5]C[5]HH){2|C<4>,5|C<3>}	131.0500	0.000	1	131.0500	0.000	1	131.0500	0.000	1	131.0500	0.000	1	131.0500	0.000	1	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5,6]	O[5]	4:2:2:	4:4:4:3:	3:4:	C[5,6]-4:O[5]-2:O[5]-2:	C[5,6]-4:C[5]-4:C[6]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5,6]C[5,6]C[5]C[6])(O[5]C[5])2	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]HH)(B[5]O[5]2)	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC)	B[5](C[5,6]C[5,6]C[5]C[6])(O[5]C[5])2{2|C<3>,4|H<1>,7|C<4>}	C[5,6](C[5,6]C[5]C[6]C)(C[5]C[5]HH)(C[6]C[6]HH)(B[5]O[5]2){2|O<1>,3|C<4>,4|H<1>}	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC){5|C<4>}	123.0080	1.242	2	123.0080	1.542	2	123.0080	1.542	2	123.0080	1.542	2	123.0080	1.542	2	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	3:4:3:1:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5,6a]-3:C[5]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(B[5]O[5]2)(H)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(B[5]O[5]2)(H){2|C<4>,2|H<1>,3|C<3>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	123.1623	0.955	4	123.1623	0.913	4	122.9252	0.733	6	122.9252	0.733	6	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	3:4:3:1:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5,6a]-3:C[5]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]CH)(B[5]O[5]2)(H)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,5|C<4>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]CH)(B[5]O[5]2)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	122.4510	0.501	2	122.4510	0.251	2	122.9252	0.733	6	122.9252	0.733	6	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	3:4:3:3:	3:4:	C[5]-4:O[5]-2:O[5]-2:	N[5]-3:C[5]-4:B[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(B[5]O[5]2)2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2{1|C<3>,2|O<2>,8|C<4>}	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(B[5]O[5]2)2{2|C<3>,2|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|N<3>,3|C<4>}	123.6172	3.257	4	123.6172	10.609	4	123.5037	6.455	12	123.5037	6.455	12	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	3:4:3:3:	3:4:	C[5]-4:O[5]-2:O[5]-2:	N[5]-3:C[5]-4:B[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(B[5]O[5]2)2	O[5](B[5]C[5]O[5])(C[5]C[5]HH)	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2{1|C<3>,2|O<2>,4|C<4>,4|H<1>}	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(B[5]O[5]2)2{2|C<3>,2|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]HH){1|B<3>,1|C<4>,1|N<3>,2|H<1>}	123.4469	2.364	8	123.4469	5.586	8	123.5037	6.455	12	123.5037	6.455	12	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:3:1:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:N[5]-3:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[5]C[5]N[5]H)(O[5]C[5])2	C[5](C[5]C[5,6a]CH)(N[5]C[5,6a]C)(B[5]O[5]2)(H)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]N[5]H)(O[5]C[5])2{1|H<1>,4|C<3>,4|C<4>}	C[5](C[5]C[5,6a]CH)(N[5]C[5,6a]C)(B[5]O[5]2)(H){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,1|N<3>,3|C<4>}	122.7680	2.727	2	122.7680	7.434	2	122.7680	7.434	2	122.7680	7.434	2	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:3:1:	4:3:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:N[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5]C[5]N[5]H)(O[5]C[5])2	C[5](C[5]C[5]HH)(B[5]O[5]2)(N[5]C[5]C)(H)	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5])	B[5](C[5]C[5]N[5]H)(O[5]C[5])2{2|C<4>,3|C<3>,4|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]2)(N[5]C[5]C)(H){2|C<4>,4|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5]){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	122.5350	1.520	2	122.5350	2.311	2	122.5350	2.311	2	122.5350	2.311	2	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:3:3:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:N[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2	C[5](C[5]C[5,6a]CC)(N[5]C[5,6a]C)(C[6a]C[6a]2)(B[5]O[5]2)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2{4|C<3>,7|C<4>}	C[5](C[5]C[5,6a]CC)(N[5]C[5,6a]C)(C[6a]C[6a]2)(B[5]O[5]2){2|C<4>,2|H<1>,4|C<3>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	123.1580	0.048	2	123.1580	0.002	2	123.1135	0.844	4	123.1135	0.844	4	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:3:3:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:N[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2	C[5](C[5]C[5,6a]C[6]H)(N[5]C[5,6a]C)(C[6a]C[6a]2)(B[5]O[5]2)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2{1|H<1>,4|C<3>,6|C<4>}	C[5](C[5]C[5,6a]C[6]H)(N[5]C[5,6a]C)(C[6a]C[6a]2)(B[5]O[5]2){3|C<4>,3|H<1>,5|C<3>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	123.0690	1.588	2	123.0690	2.522	2	123.1135	0.844	4	123.1135	0.844	4	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:N[5]-3:B[5]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]N[5]C)(O[5]C[5])2	C[5](C[5]C[5,6a]CC)(N[5]C[5,6a]C)(B[5]O[5]2)(CC[6a]HH)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]N[5]C)(O[5]C[5])2{2|C<3>,7|C<4>}	C[5](C[5]C[5,6a]CC)(N[5]C[5,6a]C)(B[5]O[5]2)(CC[6a]HH){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	123.1785	4.627	2	123.1785	21.405	2	123.1785	21.405	2	123.1785	21.405	2	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:C[5]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2H)(O[5]C[5])2	C[5](C[5]C[6a]C[5]H)(C[5]C[5]HH)(B[5]O[5]2)(H)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2H)(O[5]C[5])2{1|C<3>,3|H<1>,6|C<4>}	C[5](C[5]C[6a]C[5]H)(C[5]C[5]HH)(B[5]O[5]2)(H){2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.4340	0.516	2	123.4340	0.266	2	123.4340	0.266	2	123.4340	0.266	2	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:4:3:3:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5,5]-4:C[5]-4:B[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]B[5,5]B[5]C[5])(O[5]C[5])2	C[5](B[5,5]N[5,6]O[5]2)(C[5]C[5,6]HH)(B[5]O[5]2)2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]B[5,5]B[5]C[5])(O[5]C[5])2{1|C<3>,1|N<3>,2|H<1>,4|C<4>,4|O<2>}	C[5](B[5,5]N[5,6]O[5]2)(C[5]C[5,6]HH)(B[5]O[5]2)2{2|C<3>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|B<4>,3|C<4>}	123.9868	2.259	4	123.9868	5.103	4	123.9868	5.103	4	123.9868	5.103	4	123.0105	6.512	35	123.2219	7.727	38
2	474	976	0:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:4:2:	3:3:4:1:	3:3:	C[5]-4:B[5]-4:O[5]-2:	N[5]-3:B[5]-3:C[5]-4:H-1:	B[5]-3:C[5]-3:	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5])	C[5](N[5]C[6a]C[5])(B[5]B[5]O[5])(C[5]C[5]CC)(H)	O[5](B[5]B[5]C[5])(C[5]C[5]C)	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5]){1|C<3>,1|H<1>,1|N<3>,6|C<4>}	C[5](N[5]C[6a]C[5])(B[5]B[5]O[5])(C[5]C[5]CC)(H){2|C<4>,3|H<1>,5|C<3>}	O[5](B[5]B[5]C[5])(C[5]C[5]C){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	113.5410	0.000	1	113.5410	0.000	1	113.5410	0.000	1	113.5410	0.000	1	123.0105	6.512	35	123.2219	7.727	38
2	474	976	5:SP2_SP2_SP3	B[5,5]	C[5,5]	O[5]	4:4:2:	4:3:3:4:	3:4:	C[5]-4:C[5,5]-4:O[5]-2:	C[5]-4:B[5,5]-3:C[5]-3:C-4:	B[5,5]-3:C[5]-4:	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5])	C[5,5](C[5]C[6a]2C[5])(B[5,5]C[5]O[5])(C[5]C[5]C)(CH3)	O[5](B[5,5]C[5,5]C[5])(C[5]C[5]HH)	B[5,5](C[5]C[6a]C[5]C)(C[5,5]C[5]2C)(O[5]C[5]){2|C<4>,2|H<1>,4|C<3>}	C[5,5](C[5]C[6a]2C[5])(B[5,5]C[5]O[5])(C[5]C[5]C)(CH3){2|C<4>,2|H<1>,5|C<3>}	O[5](B[5,5]C[5,5]C[5])(C[5]C[5]HH){2|C<4>,5|C<3>}	113.9280	0.000	1	113.9280	0.000	1	113.9280	0.000	1	113.9280	0.000	1	113.9280	0.000	1	110.6076	3.108	7
2	474	976	5:SP2_SP2_SP3	B[5]	C[5]	O[5]	3:4:2:	3:4:1:1:	3:4:	C[6a]-3:C[5]-4:O[5]-2:	B[5]-3:C[5]-4:H-1:H-1:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5])	C[5](B[5]C[6a]O[5])(C[5]C[5]HP)(H)2	O[5](B[5]C[6a]C[5])(C[5]C[5]BH)	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5]){1|B<4>,1|P<4>,2|C<3>,2|F<1>,2|H<1>}	C[5](B[5]C[6a]O[5])(C[5]C[5]HP)(H)2{1|B<4>,1|H<1>,2|C<3>}	O[5](B[5]C[6a]C[5])(C[5]C[5]BH){1|P<4>,2|C<3>,3|H<1>}	111.3470	0.000	1	111.3470	0.000	1	111.3470	0.000	1	111.3470	0.000	1	110.0542	1.157	6	110.6076	3.108	7
2	474	976	5:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:1:	4:3:1:1:	4:3:	C[5]-4:O[5]-2:O-1:	C[5,6]-4:B[5]-3:H-1:H-1:	C[5,6]-4:B[5]-3:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O)	C[5](C[5,6]C[5,6]C[6]H)(B[5]O[5]O)(H)2	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O)	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6]C[6]H)(B[5]O[5]O)(H)2{5|C<4>}	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O){2|C<4>,5|H<1>}	110.4700	0.000	1	110.4700	0.000	1	110.4700	0.000	1	110.4700	0.000	1	110.0542	1.157	6	110.6076	3.108	7
2	474	976	5:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:1:1:	4:3:	C[5]-4:O[5]-2:O-2:	C[4,5]-4:B[5]-3:H-1:H-1:	C[4,5]-4:B[5]-3:	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH)	C[5](C[4,5]C[4,5]C[6a]C[4])(B[5]O[5]O)(H)2	O[5](C[4,5]C[4,5]C[4,6]H)(B[5]C[5]O)	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH){1|C<3>,1|H<1>,2|C<4>}	C[5](C[4,5]C[4,5]C[6a]C[4])(B[5]O[5]O)(H)2{1|C<4>,2|C<3>,3|H<1>}	O[5](C[4,5]C[4,5]C[4,6]H)(B[5]C[5]O){1|C<3>,2|H<1>,3|C<4>}	110.6070	0.000	1	110.6070	0.000	1	110.6070	0.000	1	110.1140	0.183	3	110.0542	1.157	6	110.6076	3.108	7
2	474	976	5:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:2:	4:3:1:1:	4:3:	C[5]-4:O[5]-2:O-2:	C[5,6]-4:B[5]-3:H-1:H-1:	C[5,6]-4:B[5]-3:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH)	C[5](C[5,6]C[5,6]C[6,6]H)(B[5]O[5]O)(H)2	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O)	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6]C[6,6]H)(B[5]O[5]O)(H)2{5|C<4>}	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O){2|C<4>,5|H<1>}	109.8675	0.045	2	109.8675	0.002	2	109.8675	0.002	2	110.1140	0.183	3	110.0542	1.157	6	110.6076	3.108	7
2	474	976	5:SP2_SP2_SP3	B[5]	C[5]	O[5]	4:2:4:	3:3:4:1:	3:3:	C[5]-4:O[5]-2:C-4:	N[5]-3:B[5]-3:C-4:H-1:	B[5]-3:C[5]-3:	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH)	C[5](N[5]C[6a]C[5])(B[5]O[5]C)(CCCH)(H)	O[5](B[5]C[5]C)(C[5]N[5]O)	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH){1|C<3>,1|O<1>}	C[5](N[5]C[6a]C[5])(B[5]O[5]C)(CCCH)(H){1|O<1>,2|C<3>}	O[5](B[5]C[5]C)(C[5]N[5]O){1|C<3>,1|C<4>,1|H<1>}	108.1660	0.000	1	108.1660	0.000	1	108.1660	0.000	1	108.1660	0.000	1	110.0542	1.157	6	110.6076	3.108	7
2	478	542	5:SP2_SP2_SP3	B[5]	C[4,5]	N[5]	4:3:3:	4:3:3:3:	3:3:3:	C[4,5]-4:N[5]-3:C[6a]-3:	C[4,5]-4:B[5]-3:C[4]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2)	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(C[6a]C[6a]2)	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|S<1>,2|H<1>,9|C<3>}	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2){10|C<3>,1|S<1>,2|H<1>}	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(C[6a]C[6a]2){2|H<1>,8|C<3>}	107.2935	0.296	2	107.2935	0.088	2	107.2935	0.088	2	107.2935	0.088	2	107.4320	0.101	3	107.4320	0.101	3
2	478	542	5:SP2_SP2_SP3	B[5]	C[4,5]	N[5]	4:3:3:	4:3:3:3:	3:3:4:	C[4,5]-4:C[6a]-3:N[5]-3:	C[4,5]-4:B[5]-3:C[4]-3:C[6a]-3:	B[5]-3:C[5]-3:C-4:	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C)	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2)	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(CH3)	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C){1|S<1>,2|H<1>,7|C<3>}	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2){1|C<4>,1|S<1>,2|H<1>,9|C<3>}	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(CH3){6|C<3>}	107.7090	0.000	1	107.7090	0.000	1	107.7090	0.000	1	107.7090	0.000	1	107.4320	0.101	3	107.4320	0.101	3
2	478	643	0:SP2_SP2_SP3	B[5]	C[4,5]	C[6a]	4:3:3:	4:3:3:3:	3:3:3:	C[4,5]-4:C[6a]-3:N[5]-3:	C[4,5]-4:B[5]-3:C[4]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C)	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2)	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C){1|S<1>,2|H<1>,7|C<3>}	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2){1|C<4>,1|S<1>,2|H<1>,9|C<3>}	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,4|C<3>}	129.3610	0.000	1	129.3610	0.000	1	129.3610	0.000	1	127.1680	3.623	3	127.1680	3.623	3	127.1680	3.623	3
2	478	643	0:SP2_SP2_SP3	B[5]	C[4,5]	C[6a]	4:3:3:	4:3:3:3:	3:3:3:	C[4,5]-4:N[5]-3:C[6a]-3:	C[4,5]-4:B[5]-3:C[4]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2)	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|S<1>,2|H<1>,9|C<3>}	C[4,5](C[4,5]C[6a]C[4]C[5])(B[5]C[6a]N[5])(C[4]C[6a]C[4])(C[6a]C[6a]2){10|C<3>,1|S<1>,2|H<1>}	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,5|C<3>}	126.0715	0.179	2	126.0715	0.032	2	126.0715	0.032	2	127.1680	3.623	3	127.1680	3.623	3	127.1680	3.623	3
2	478	976	0:SP2_SP2_SP3	B[5]	C[4]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[4]-4:O[5]-2:O[5]-2:	C[4]-4:C[4]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2H)(O[5]C[5])2	C[4](C[4]C[4]CC)(C[4]C[4]HH)(B[5]O[5]2)(H)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2H)(O[5]C[5])2{1|C<3>,2|H<1>,6|C<4>}	C[4](C[4]C[4]CC)(C[4]C[4]HH)(B[5]O[5]2)(H){2|C<4>,2|H<1>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.0670	0.513	2	123.0670	0.264	2	123.0670	0.264	2	123.0670	0.264	2	123.3598	2.158	16	123.3598	2.158	16
2	478	976	0:SP2_SP2_SP3	B[5]	C[4]	O[5]	4:2:2:	4:4:3:4:	3:4:	C[4]-4:O[5]-2:O[5]-2:	C[4]-4:C[4]-4:B[5]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2C)(O[5]C[5])2	C[4](C[4]C[4]HH)2(B[5]O[5]2)(CC[6a]CH)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2C)(O[5]C[5])2{4|H<1>,5|C<4>}	C[4](C[4]C[4]HH)2(B[5]O[5]2)(CC[6a]CH){1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	123.4410	0.666	2	123.4410	0.444	2	123.4410	0.444	2	123.4410	0.444	2	123.3598	2.158	16	123.3598	2.158	16
2	478	976	0:SP2_SP2_SP3	B[5]	C[4]	O[5]	4:2:2:	4:4:4:3:	3:4:	C[4]-4:O[5]-2:O[5]-2:	C[4]-4:C[4]-4:C[6]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2C[6])(O[5]C[5])2	C[4](C[4]C[4]HH)2(C[6]C[6]2H)(B[5]O[5]2)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2C[6])(O[5]C[5])2{5|H<1>,7|C<4>}	C[4](C[4]C[4]HH)2(C[6]C[6]2H)(B[5]O[5]2){1|Br<1>,4|C<4>,5|H<1>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	123.4790	2.885	2	123.3951	2.860	12	123.3951	2.860	12	123.3951	2.860	12	123.3598	2.158	16	123.3598	2.158	16
2	478	976	0:SP2_SP2_SP3	B[5]	C[4]	O[5]	4:2:2:	4:4:4:3:	3:4:	C[4]-4:O[5]-2:O[5]-2:	C[4]-4:C[4]-4:C[6]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2C[6])(O[5]C[5])2	C[4](C[4]C[4]HH)2(C[6]C[6]2H)(B[5]O[5]2)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2C[6])(O[5]C[5])2{5|H<1>,7|C<4>}	C[4](C[4]C[4]HH)2(C[6]C[6]2H)(B[5]O[5]2){1|C<3>,4|C<4>,5|H<1>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	123.3783	1.603	10	123.3951	2.860	12	123.3951	2.860	12	123.3951	2.860	12	123.3598	2.158	16	123.3598	2.158	16
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:3:3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:N[3]-3:B[5]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]N[3]C)(O[5]C[5])2	C[3](C[3]C[6a]N[3]H)(N[3]C[3]N[5])(B[5]O[5]2)(CCHO)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]N[3]C)(O[5]C[5])2{1|C<3>,1|H<1>,1|N<3>,4|C<4>}	C[3](C[3]C[6a]N[3]H)(N[3]C[3]N[5])(B[5]O[5]2)(CCHO){2|C<4>,4|C<3>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	123.0450	0.561	2	123.0450	0.315	2	123.0450	0.315	2	123.0450	0.315	2	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:3:4:3:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[6a]-3:C[3]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2	C[3](C[3]C[3]SeC)(C[6a]C[6a]2)(C[3]C[3]HH)(B[5]O[5]2)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2{1|Se<2>,2|C<3>,2|H<1>,5|C<4>}	C[3](C[3]C[3]SeC)(C[6a]C[6a]2)(C[3]C[3]HH)(B[5]O[5]2){2|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	123.7945	0.564	2	123.7945	0.318	2	123.3058	2.308	4	123.3058	2.308	4	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:3:4:3:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[6a]-3:C[3]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2	C[3](C[3]C[6a]C[3]C)(C[6a]C[6a]2)(C[3]C[3]HH)(B[5]O[5]2)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2{2|H<1>,4|C<3>,4|C<4>}	C[3](C[3]C[6a]C[3]C)(C[6a]C[6a]2)(C[3]C[3]HH)(B[5]O[5]2){2|C<4>,2|H<1>,4|C<3>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	122.8170	2.377	2	122.8170	5.652	2	123.3058	2.308	4	123.3058	2.308	4	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3,6]-4:C[3,6]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[3]C[3,6]2H)(O[5]C[5])2	C[3](C[3,6]C[6,6a]C[3,6]H)(C[3,6]C[3,6]C[6]H)(B[5]O[5]2)(H)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3,6]2H)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[3](C[3,6]C[6,6a]C[3,6]H)(C[3,6]C[3,6]C[6]H)(B[5]O[5]2)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.0705	3.743	2	123.0705	14.008	2	123.0705	14.008	2	123.2391	2.362	8	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[3]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2H)(O[5]C[5])2	C[3](C[3]C[6a]C[3]C)(C[3]C[3]HH)(B[5]O[5]2)(H)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2H)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[3](C[3]C[6a]C[3]C)(C[3]C[3]HH)(B[5]O[5]2)(H){2|C<3>,2|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.3430	0.868	4	123.3430	0.753	4	123.2953	0.490	6	123.2391	2.362	8	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:4:3:1:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[3]-4:B[5]-3:H-1:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2H)(O[5]C[5])2	C[3](C[3]C[6a]C[3]H)(C[3]C[3]CH)(B[5]O[5]2)(H)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2H)(O[5]C[5])2{1|C<3>,2|H<1>,5|C<4>}	C[3](C[3]C[6a]C[3]H)(C[3]C[3]CH)(B[5]O[5]2)(H){2|C<3>,2|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	123.2000	0.403	2	123.2000	0.162	2	123.2953	0.490	6	123.2391	2.362	8	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:4:3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[3]-4:B[5]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2C)(O[5]C[5])2	C[3](C[3]C[3]HH)2(B[5]O[5]2)(CC[6a]HN)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2C)(O[5]C[5])2{4|C<4>,4|H<1>}	C[3](C[3]C[3]HH)2(B[5]O[5]2)(CC[6a]HN){2|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	123.5820	3.548	2	123.5820	12.590	2	123.3815	7.140	4	123.3815	7.140	4	123.2640	2.668	18	123.2640	2.668	18
2	486	976	0:SP2_SP2_SP3	B[5]	C[3]	O[5]	4:2:2:	4:4:3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	C[3]-4:C[3]-4:B[5]-3:C-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2C)(O[5]C[5])2	C[3](C[3]C[6a]C[3]H)(C[3]C[3]HH)(B[5]O[5]2)(CC[6a]HH)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2C)(O[5]C[5])2{1|C<3>,3|H<1>,4|C<4>}	C[3](C[3]C[6a]C[3]H)(C[3]C[3]HH)(B[5]O[5]2)(CC[6a]HH){2|C<3>,2|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	123.1810	2.944	2	123.1810	8.669	2	123.3815	7.140	4	123.3815	7.140	4	123.2640	2.668	18	123.2640	2.668	18
2	490	542	0:SP2_SP2_SP3	B[5]	C	N[5]	3:3:4:	3:3:2:1:	3:4:3:	N[5]-3:N[5]-3:C-4:	C[6a]-3:B[5]-3:O-2:H-1:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(CC[6a]HO)	C(C[6a]C[6a]2)(B[5]N[5]2)(OSi)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	B[5](N[5]C[6a]C[5])2(CC[6a]HO){4|C<3>,4|H<1>}	C(C[6a]C[6a]2)(B[5]N[5]2)(OSi)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	125.4470	3.387	2	125.4470	11.472	2	125.4470	11.472	2	125.4470	11.472	2	125.4470	11.472	2	125.4470	11.472	2
2	490	727	0:SP2_SP2_SP3	B[5]	C	C[5,6a]	3:3:4:	3:4:1:1:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C-4:	B[5]-3:C-4:H-1:H-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(CCHH)	C(B[5]C[5,6a]2)(CCHH)(H)2	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(CCHH){2|H<1>,4|C<3>}	C(B[5]C[5,6a]2)(CCHH)(H)2	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){1|C<4>,1|H<1>,3|C<3>}	127.8605	5.196	4	127.8605	27.000	4	127.8605	27.000	4	127.8605	27.000	4	127.8605	27.000	4	127.8605	27.000	4
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:1:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:H-1:H-1:H-1:	C[3x5]-4:B[5]-3:	B[5](O[5]C[3x5])2(CH3)	C(B[5]O[5]2)(H)3	O[5](C[3x5]C[3x5]C[5,6]C[5])(B[5]O[5]C)	B[5](O[5]C[3x5])2(CH3){1|C<3>,3|C<4>}	C(B[5]O[5]2)(H)3	O[5](C[3x5]C[3x5]C[5,6]C[5])(B[5]O[5]C){1|H<1>,1|O<2>,2|C<3>,4|C<4>}	123.2010	0.000	1	123.2010	0.000	1	123.1815	0.001	2	123.0007	9.004	4	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:1:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:H-1:H-1:H-1:	C[3x5]-4:B[5]-3:	B[5](O[5]C[3x5])2(CH3)	C(B[5]O[5]2)(H)3	O[5](C[3x5]C[5,6,6]C[3x5]C[5])(B[5]O[5]C)	B[5](O[5]C[3x5])2(CH3){1|C<3>,3|C<4>}	C(B[5]O[5]2)(H)3	O[5](C[3x5]C[5,6,6]C[3x5]C[5])(B[5]O[5]C){1|C<3>,1|O<2>,5|C<4>}	123.1620	0.000	1	123.1620	0.000	1	123.1815	0.001	2	123.0007	9.004	4	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:1:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:H-1:I-1:I-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CHII)	C(B[5]O[5]2)(H)(I)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CHII){4|C<4>}	C(B[5]O[5]2)(H)(I)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.8200	5.185	2	122.8200	26.879	2	122.8200	26.879	2	123.0007	9.004	4	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:3:4:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:B[5]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]2C)	C(B[5]O[5]2)3(CC[6a]HH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]2C){4|C<4>}	C(B[5]O[5]2)3(CC[6a]HH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4767	3.198	6	123.4767	10.230	6	123.4767	10.230	6	123.4767	10.230	6	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]CH)	C(B[5]O[5]2)2(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]CH){4|C<4>}	C(B[5]O[5]2)2(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6972	0.951	4	123.6972	0.904	4	123.6972	0.904	4	123.1139	0.668	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CN[6]O)(CH3)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CN[6]O)(CH3)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.8900	0.649	2	122.8900	0.421	2	122.8900	0.421	2	123.1139	0.668	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]CH)	C(B[5]O[5]2)(C[5]C[5]2)(CH3)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]CH){4|C<4>}	C(B[5]O[5]2)(C[5]C[5]2)(CH3)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2128	0.222	6	123.2128	0.049	6	123.2128	0.049	6	123.1139	0.668	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:N[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CN[5]CH)	C(B[5]O[5]2)(N[5]C[5]2)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CN[5]CH){4|C<4>}	C(B[5]O[5]2)(N[5]C[5]2)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.8880	1.547	2	122.8880	2.394	2	122.8880	2.394	2	123.1139	0.668	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[6a]-3:B[5]-3:C-4:H-1:	C[5,5]-4:B[5]-3:	B[5](O[5]C[5,5])2(CC[6a]CH)	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]2H)(H)	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C)	B[5](O[5]C[5,5])2(CC[6a]CH){2|C<3>,2|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]2H)(H)	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C){1|C<4>,3|C<3>}	122.6070	0.988	4	122.6070	0.976	4	122.6070	0.976	4	123.1139	0.668	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	3:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	B[5]-3:C[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CCHH)(H)2	O[5](B[5]O[5]C)(C[5]C[5]C)	B[5](O[5]C[5])2(CCHH){3|C<4>}	C(B[5]O[5]2)(CCHH)(H)2	O[5](B[5]O[5]C)(C[5]C[5]C){2|C<4>}	124.0290	0.000	1	124.0290	0.000	1	124.0290	0.000	1	124.0290	0.000	1	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	B[5]-4:B[5]-3:	B[5](O[5]B[5])(O[5]C[5])(CCHH)	C(B[5]O[5]2)(CHHP)(H)2	O[5](B[5]C[6a]2C[5])(B[5]O[5]C)	B[5](O[5]B[5])(O[5]C[5])(CCHH){1|H<1>,3|C<3>}	C(B[5]O[5]2)(CHHP)(H)2	O[5](B[5]C[6a]2C[5])(B[5]O[5]C){1|H<1>,5|C<3>}	121.0150	0.000	1	121.0150	0.000	1	121.0150	0.000	1	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]B[5])(O[5]C[5])(CCHH)	C(B[5]O[5]2)(CHHP)(H)2	O[5](C[5]C[6a]B[5]H)(B[5]O[5]C)	B[5](O[5]B[5])(O[5]C[5])(CCHH){1|H<1>,3|C<3>}	C(B[5]O[5]2)(CHHP)(H)2	O[5](C[5]C[6a]B[5]H)(B[5]O[5]C){4|C<3>}	121.9330	0.000	1	121.9330	0.000	1	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CCCH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|C<4>}	C(B[5]O[5]2)(CCCH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1408	1.362	6	123.1408	1.856	6	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){3|C<4>}	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){1|C<4>}	122.8980	0.000	1	123.8250	2.657	7	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|C<4>}	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.9795	1.729	6	123.8250	2.657	7	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]HH)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|H<1>}	C(B[5]O[5]2)(CCHH)(H)2	O[5](C[5]C[5]HH)(B[5]O[5]C){2|H<1>}	123.2475	0.870	2	123.2475	0.758	2	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CC[5a]CC)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|C<4>}	C(B[5]O[5]2)(CC[5a]CC)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2465	3.061	2	123.2465	9.370	2	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	C(B[5]O[5]2)(CC[6a]CH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|C<4>}	C(B[5]O[5]2)(CC[6a]CH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4098	1.812	12	123.4098	3.282	12	123.3820	2.598	30	123.3056	2.693	31	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CCHH)(CCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CCHH)(CCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.0747	1.762	4	123.0747	3.103	4	123.1852	7.405	10	123.1445	6.260	12	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CCHH)(CCH)(H)	O[5](C[5]C[5]CH)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){2|C<4>,2|H<1>}	C(B[5]O[5]2)(CCHH)(CCH)(H)	O[5](C[5]C[5]CH)(B[5]O[5]C){1|C<4>,1|H<1>}	123.4303	4.213	4	123.4303	17.753	4	123.1852	7.405	10	123.1445	6.260	12	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CCHO)(CCH)(H)	O[5](C[5]C[5]CH)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){2|C<4>,2|H<1>}	C(B[5]O[5]2)(CCHO)(CCH)(H)	O[5](C[5]C[5]CH)(B[5]O[5]C){1|C<4>,1|H<1>}	122.9160	1.909	2	122.9160	3.645	2	123.1852	7.405	10	123.1445	6.260	12	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:N-3:H-1:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(CCHN)	C(B[5]O[5]2)(CCCH)(NHS)(H)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]O[5]C)	B[5](O[5]C[5,6,6])2(CCHN){1|H<1>,3|C<4>}	C(B[5]O[5]2)(CCCH)(NHS)(H)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]O[5]C){2|H<1>,3|C<4>}	123.9680	0.000	1	123.9680	0.000	1	122.9410	2.109	2	123.1445	6.260	12	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:N-3:H-1:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(CCHN)	C(B[5]O[5]2)(CCCH)(NHS)(H)	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]O[5]C)	B[5](O[5]C[5,6,6])2(CCHN){1|H<1>,3|C<4>}	C(B[5]O[5]2)(CCCH)(NHS)(H)	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]O[5]C){2|H<1>,3|C<4>}	121.9140	0.000	1	121.9140	0.000	1	122.9410	2.109	2	123.1445	6.260	12	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:B-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CBCH)	C(B[5]O[5]2)(BC[6a]2C)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CBCH){4|C<4>}	C(B[5]O[5]2)(BC[6a]2C)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.9130	0.113	2	123.9130	0.013	2	123.9130	0.013	2	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CCCH)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CCCH)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	124.2970	1.014	2	124.2970	1.028	2	123.5639	6.644	16	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CCHH)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CCHH)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5302	2.570	4	123.5302	6.604	4	123.5639	6.644	16	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CC[5a]CH)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CC[5a]CH)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4722	3.563	6	123.4722	12.694	6	123.5639	6.644	16	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CC[6a]HH)(CHHN)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CC[6a]HH)(CHHN)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2460	1.632	2	123.2460	2.663	2	123.5639	6.644	16	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	3:4:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	C(B[5]O[5]2)(CC[6a]HN)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	C(B[5]O[5]2)(CC[6a]HN)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4910	3.367	2	123.4910	11.338	2	123.5639	6.644	16	123.6027	5.876	18	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[4]-4:B[5]-3:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[4]HH)	C(C[4]C[6a]C[4]2)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[4]HH){4|C<4>}	C(C[4]C[6a]C[4]2)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5710	1.638	2	123.5710	2.682	2	123.5710	2.682	2	123.5640	4.020	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]HH)	C(C[5]C[5,6]C[5]C)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]HH){4|C<4>}	C(C[5]C[5,6]C[5]C)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4345	4.552	2	123.4345	20.717	2	123.6128	7.614	4	123.5640	4.020	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]HH)	C(C[5]C[5,6]C[5]H)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]HH){4|C<4>}	C(C[5]C[5,6]C[5]H)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.7910	1.413	2	123.7910	1.996	2	123.6128	7.614	4	123.5640	4.020	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:1:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[6]-4:B[5]-3:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]HH)	C(C[6]C[6]2H)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]HH){4|C<4>}	C(C[6]C[6]2H)(B[5]O[5]2)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4595	1.609	2	123.4595	2.588	2	123.4595	2.588	2	123.5640	4.020	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:3:1:	4:3:	O[5]-2:O[5]-2:C-4:	C-4:B[5]-3:B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]CH)	C(CC[6a]B[5]H)(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]CH){4|C<4>}	C(CC[6a]B[5]H)(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6225	1.516	4	123.6225	2.298	4	123.6225	2.298	4	123.6225	2.298	4	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]CH)	C(C[5]C[5]2H)(B[5]O[5]2)(CHHO)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]CH){4|C<4>}	C(C[5]C[5]2H)(B[5]O[5]2)(CHHO)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4580	2.382	2	123.4580	5.672	2	123.4580	5.672	2	123.6589	1.437	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[6]-4:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]CH)	C(C[6]C[6]2H)(B[5]O[5]2)(CCCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]CH){4|C<4>}	C(C[6]C[6]2H)(B[5]O[5]2)(CCCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	124.1470	0.958	4	124.1470	0.919	4	123.7091	1.023	8	123.6589	1.437	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[6]-4:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]CH)	C(C[6]C[6]N[6]H)(B[5]O[5]2)(CC[5a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]CH){4|C<4>}	C(C[6]C[6]N[6]H)(B[5]O[5]2)(CC[5a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2345	0.237	2	123.2345	0.056	2	123.7091	1.023	8	123.6589	1.437	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	2:2:4:	4:3:4:1:	4:3:	O[5]-2:O[5]-2:C-4:	C[6]-4:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]CH)	C(C[6]C[6]N[6]H)(B[5]O[5]2)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]CH){4|C<4>}	C(C[6]C[6]N[6]H)(B[5]O[5]2)(CC[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3080	1.676	2	123.3080	2.808	2	123.7091	1.023	8	123.6589	1.437	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	3:2:4:	3:4:1:1:	4:3:	O[5]-3:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5]Li)(O[5]C[5])(CCHH)	C(B[5]O[5]2)(CBHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5]Li)(O[5]C[5])(CCHH){4|C<4>}	C(B[5]O[5]2)(CBHH)(H)2	O[5](C[5]C[5]CC)(B[5]O[5]C){1|Li<5>,2|C<4>}	124.0500	0.000	1	124.0500	0.000	1	124.0500	0.000	1	124.0500	0.000	1	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	3:4:2:	3:3:3:1:	4:3:	O[5]-3:C-4:O[5]-2:	C[6a]-3:B[5]-3:N-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5]Mg)(CC[6a]HN)(O[5]C[5])	C(C[6a]C[6a]2)(B[5]O[5]2)(NC[6a]Mg)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5]Mg)(CC[6a]HN)(O[5]C[5]){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(NC[6a]Mg)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){1|Mg<4>,2|C<4>}	125.8060	0.000	1	125.8060	0.000	1	125.8060	0.000	1	125.8060	0.000	1	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:2:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:O-2:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]HO)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(OB[5])(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]HO)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(OB[5])(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.6285	1.439	2	122.6285	2.071	2	122.6285	2.071	2	122.6285	2.071	2	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[5a]-3:B[5]-3:B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](CC[5a]B[5]H)(O[5]C[5])2	C(C[5a]C[5a,6a]C[5a])(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[5a]B[5]H)(O[5]C[5])2{4|C<4>}	C(C[5a]C[5a,6a]C[5a])(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2133	1.800	4	123.2133	3.240	4	123.2133	3.240	4	123.2759	2.034	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]H)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]H)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)2(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3748	1.683	4	123.3748	2.833	4	123.3748	2.833	4	123.2759	2.034	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]2H)(O[5]C[5])2	C(C[6a]C[6a]2)2(B[5]O[5]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]2H)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)2(B[5]O[5]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2035	0.148	2	123.2035	0.022	2	123.2035	0.022	2	123.2759	2.034	10	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:B[5]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]2)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)3	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]2)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)3	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4748	0.719	6	123.4748	0.516	6	123.4748	0.516	6	123.4005	0.618	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]2B[5])(O[5]C[5])2	C(C[6a]C[6a]2)2(B[5]O[5]2)2	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]2B[5])(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)2(B[5]O[5]2)2	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1775	1.269	2	123.1775	1.611	2	123.1775	1.611	2	123.4005	0.618	8	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:4:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]C)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)2(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]C)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)2(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3155	0.925	8	123.3155	0.856	8	123.3155	0.856	8	123.2606	0.757	11	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:3:4:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-3:C-4:	C[5]-4:B[5]-3:	B[5](CC[6a]CC)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CB[5]C)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CC)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CB[5]C)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1143	0.863	3	123.1143	0.744	3	123.1143	0.744	3	123.2606	0.757	11	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	B[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CB[6a]CH)(O[5]C[5])2	C(B[6a]N[6a]2)(B[5]O[5]2)(CB[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CB[6a]CH)(O[5]C[5])2{4|C<4>}	C(B[6a]N[6a]2)(B[5]O[5]2)(CB[6a]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3017	1.351	4	123.3017	1.825	4	123.4319	2.816	16	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	B[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CB[6a]CH)(O[5]C[5])2	C(B[6a]N[6a]2)(B[5]O[5]2)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CB[6a]CH)(O[5]C[5])2{4|C<4>}	C(B[6a]N[6a]2)(B[5]O[5]2)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2690	2.333	6	123.2690	5.445	6	123.4319	2.816	16	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	B[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CB[6a]CH)(O[5]C[5])2	C(B[6a]N[6a]2)(B[5]O[5]2)(CC[5]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CB[6a]CH)(O[5]C[5])2{4|C<4>}	C(B[6a]N[6a]2)(B[5]O[5]2)(CC[5]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6815	1.337	6	123.6815	1.788	6	123.4319	2.816	16	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CB[5]2H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CB[5]2H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6510	0.263	2	123.6510	0.069	2	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CCCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1455	1.221	4	123.1455	1.492	4	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2364	0.378	8	123.2364	0.143	8	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHS)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHS)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1235	2.153	2	123.1235	4.636	2	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6]HH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.8340	0.634	2	122.8340	0.401	2	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:1:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:H-1:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CSeCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CSeCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.0855	0.337	2	123.0855	0.114	2	123.1930	0.601	20	123.2992	1.548	36	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:2:	3:3:4:4:	4:3:	C-4:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C-4:C-4:	C[5]-4:B[5]-3:	B[5](CC[6a]CC)(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHH)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CC)(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCHH)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1115	2.780	2	123.1115	7.726	2	123.1115	7.726	2	123.1115	7.726	2	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:4:	3:4:1:1:	4:3:	C[5]-4:O[5]-2:C-4:	B[5]-3:C-4:H-1:H-1:	C[5]-4:B[5]-3:	B[5](C[5]C[5]RuB)(O[5]C[5])(CCHH)	C(B[5]C[5]O[5])(CCHH)(H)2	O[5](C[5]C[5]CO)(B[5]C[5]C)	B[5](C[5]C[5]RuB)(O[5]C[5])(CCHH){1|B<5>,1|C<3>,1|O<2>}	C(B[5]C[5]O[5])(CCHH)(H)2	O[5](C[5]C[5]CO)(B[5]C[5]C){1|Ru<11>,1|B<5>,1|B<6>}	114.6720	0.000	1	114.6720	0.000	1	114.6720	0.000	1	114.6720	0.000	1	123.2923	3.127	185	123.2923	3.127	185
2	490	976	0:SP2_SP2_SP3	B[5]	C	O[5]	4:2:4:	3:4:4:1:	3:3:	C[5]-4:O[5]-2:C-4:	B[5]-3:C-4:C-4:H-1:	B[5]-3:C[5]-3:	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH)	C(B[5]C[5]O[5])(CCHH)2(H)	O[5](B[5]C[5]C)(C[5]N[5]O)	B[5](C[5]N[5]CH)(O[5]C[5])(CCCH){1|C<3>,1|O<1>}	C(B[5]C[5]O[5])(CCHH)2(H)	O[5](B[5]C[5]C)(C[5]N[5]O){1|C<3>,1|C<4>,1|H<1>}	120.8770	0.000	1	120.8770	0.000	1	120.8770	0.000	1	120.8770	0.000	1	123.2923	3.127	185	123.2923	3.127	185
2	542	542	0:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:4:3:	3:3:3:	3:4:4:	N[5]-3:C[5]-4:N[5]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[5]-4:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2)	N[5](C[5,6a]C[5,6a]C[6a])(B[5]C[5]N[5])(C[6a]C[6a]2)	N[5](B[5]C[5]N[5])(C[5]C[5]HH)2	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(N[5]C[5]2){2|C<4>,4|C<3>,4|H<1>}	N[5](C[5,6a]C[5,6a]C[6a])(B[5]C[5]N[5])(C[6a]C[6a]2){3|H<1>,4|C<3>,4|C<4>}	N[5](B[5]C[5]N[5])(C[5]C[5]HH)2{3|C<3>,6|H<1>}	127.5090	0.000	1	127.5090	0.000	1	127.5090	0.000	1	127.5090	0.000	1	127.5090	0.000	1	127.5090	0.000	1
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:1:	3:4:3:	3:3:3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]B)	B[5](N[5]C[6a]C[5])2(Br){1|B<4>,2|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){1|B<4>,2|C<4>,3|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]B){2|C<4>,2|H<1>,3|C<3>}	107.7150	0.000	1	107.7150	0.000	1	106.8800	1.394	2	106.8800	1.394	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:1:	3:4:3:	3:3:3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:B[5]-3:C[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]H)	B[5](N[5]C[6a]C[5])2(Br){3|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){1|H<1>,2|C<4>,3|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]H){2|C<4>,2|H<1>,3|C<3>}	106.0450	0.000	1	106.0450	0.000	1	106.8800	1.394	2	106.8800	1.394	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:1:	4:3:3:	4:3:3:	N[5]-3:N[5]-3:Cl-1:	C[5]-4:C[6a]-3:B[5]-3:	C[5]-4:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]C[5])2(Cl)	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl)	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl)	B[5](N[5]C[6a]C[5])2(Cl){2|Cl<1>,2|H<1>,4|C<3>}	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl){1|Cl<1>,1|H<1>,2|C<4>,3|C<3>}	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl){1|Cl<1>,1|H<1>,2|C<4>,3|C<3>}	109.3450	0.000	1	109.3450	0.000	1	109.3450	0.000	1	109.3450	0.000	1	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:2:	3:3:3:	3:3:3:	N[5]-3:N[5]-3:O-2:	C[6a]-3:B[5]-3:C[5]-3:	C[6a]-3:B[5]-3:N[5]-3:	B[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(OAl)	N[5](C[6a]C[6a]2)(B[5]N[5]O)(C[5]N[5]C)	N[5](C[6a]C[6a]2)(B[5]N[5]O)(N[5]C[5]H)	B[5](N[5]C[6a]C[5])(N[5]C[6a]N[5])(OAl){1|C<4>,1|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]O)(C[5]N[5]C){1|H<1>,2|C<4>,3|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]O)(N[5]C[5]H){1|C<4>,2|H<1>,3|C<3>}	102.6760	0.000	1	102.6760	0.000	1	102.6760	0.000	1	102.6760	0.000	1	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:N[5]-3:B[5]-3:	B[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]B[5])2(B[5]N[5]2)	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N)	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N)	B[5](N[5]C[6a]B[5])2(B[5]N[5]2){2|B<3>,2|N<3>,6|C<3>}	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N){2|H<1>,3|C<3>,3|N<3>}	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N){2|H<1>,3|C<3>,3|N<3>}	111.6215	0.060	2	111.6215	0.004	2	111.6215	0.004	2	111.6215	0.004	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:3:4:	3:3:3:	N[5]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[5]-3:	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2)	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]Cl)	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2){1|Cl<1>,4|H<1>,6|C<3>}	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|Cl<1>,2|C<4>,5|C<3>}	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]Cl){2|C<4>,2|H<1>,5|C<3>}	103.8510	1.080	2	103.8510	1.167	2	103.8510	1.167	2	103.8510	1.167	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:B-3:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(BOO)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	B[5](N[5]C[6a]C[5])2(BOO){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	107.0350	0.000	1	107.0350	0.000	1	107.0350	0.000	1	108.3757	1.348	3	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:C-3:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(CC[6a]O)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	B[5](N[5]C[6a]C[5])2(CC[6a]O){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	109.0460	0.000	2	109.0460	0.000	2	109.0460	0.000	2	108.3757	1.348	3	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	B[5]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](B[5]O[5]2)(N[5]C[5]C)2	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH)	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH)	B[5](B[5]O[5]2)(N[5]C[5]C)2{2|C<4>,4|H<1>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|H<1>,2|O<2>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CCCH){1|C<4>,2|H<1>,2|O<2>}	108.2250	0.000	1	108.2250	0.000	1	107.8935	0.220	2	107.8783	0.111	3	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	B[5]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](B[5]O[5]2)(N[5]C[5]C)2	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3)	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3)	B[5](B[5]O[5]2)(N[5]C[5]C)2{2|C<4>,4|H<1>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	N[5](B[5]B[5]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	107.5620	0.000	1	107.5620	0.000	1	107.8935	0.220	2	107.8783	0.111	3	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	B[5a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](B[5a]O[5a]2)(N[5]C[5]C)2	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3)	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3)	B[5](B[5a]O[5a]2)(N[5]C[5]C)2{2|C<3>,4|H<1>}	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	N[5](B[5]B[5a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	107.8480	0.000	1	107.8480	0.000	1	107.8480	0.000	1	107.8783	0.111	3	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	4:3:4:	4:3:4:	N[5]-3:N[5]-3:C-3:	C[5]-4:B[5]-3:C-4:	C[5]-4:B[5]-3:C-4:	B[5](N[5]C[5]C)2(CC[6]H)	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3)	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3)	B[5](N[5]C[5]C)2(CC[6]H){4|H<1>}	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3){1|C<4>,2|H<1>}	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3){1|C<4>,2|H<1>}	107.6800	0.000	1	107.6800	0.000	1	107.6800	0.000	1	107.6800	0.000	1	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:3:	5:3:3:	3:3:3:	N[5]-3:N[5]-3:N-3:	Ge[3,3,5]-5:C[6a]-3:B[5]-3:	Ge[5]-3:C[6a]-3:B[5]-3:	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC)	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N)	N[5](Ge[5]Ge[3,3,5]C)(C[6a]C[6a]2)(B[5]N[5]N)	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC){1|B<4>,1|C<2>,2|N<3>,4|C<3>}	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N){1|C<2>,1|N<3>,2|C<4>,5|C<3>}	N[5](Ge[5]Ge[3,3,5]C)(C[6a]C[6a]2)(B[5]N[5]N){1|B<4>,2|C<4>,2|N<3>,3|C<3>}	117.4845	0.674	2	117.4845	0.454	2	117.4845	0.454	2	117.4845	0.454	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:4:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:C-4:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(CC[6a]HO)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	B[5](N[5]C[6a]C[5])2(CC[6a]HO){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	109.1020	0.000	1	109.1020	0.000	1	109.1020	0.000	1	109.1020	0.000	1	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	3:3:4:	4:3:3:	3:4:3:	N[5]-3:N[5]-3:Si-4:	C[5]-4:C[6a]-3:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(SiC[6a]CC)	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(B[5]N[5]Si)	N[5](C[6a]C[6a]N[6a])(C[5]C[6a]C[5]H)(B[5]N[5]Si)	B[5](N[5]C[6a]C[5])2(SiC[6a]CC){1|N<2>,2|H<1>,5|C<3>}	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(B[5]N[5]Si){1|O<2>,2|H<1>,6|C<3>}	N[5](C[6a]C[6a]N[6a])(C[5]C[6a]C[5]H)(B[5]N[5]Si){2|H<1>,6|C<3>}	105.7470	0.000	1	105.7470	0.000	1	105.7470	0.000	1	105.7470	0.000	1	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP2	B[5]	N[5]	N[5]	4:3:3:	3:3:4:	3:3:4:	B[3,3]-4:N[5]-3:N[5]-3:	B[5]-3:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[5]-4:	B[5](B[3,3]B[3,3]H[3]2)(N[5]C[6a]C[5])2	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	B[5](B[3,3]B[3,3]H[3]2)(N[5]C[6a]C[5])2{1|B<3>,4|C<3>,4|H<1>}	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|B<4>,2|C<4>,2|H<1>,2|H<2>,3|C<3>}	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|B<4>,2|C<4>,2|H<1>,2|H<2>,3|C<3>}	108.2465	0.076	2	108.2465	0.006	2	108.2465	0.006	2	108.2465	0.006	2	108.5466	13.994	21	108.5466	13.994	21
2	542	542	5:SP2_SP2_SP3	B[5]	N[5]	N[5]	3:3:1:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	B[5](N[5]C[6a]C[5])2(Br){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){2|C<4>,2|H<1>,3|C<3>}	111.6740	0.000	2	111.6740	0.000	2	111.6740	0.000	2	111.6740	0.000	2	109.6942	2.547	6	109.6942	2.547	6
2	542	542	5:SP2_SP2_SP3	B[5]	N[5]	N[5]	3:3:2:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:O-2:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(OC)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O)	B[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O){2|C<4>,2|H<1>,3|C<3>}	109.5230	0.000	1	109.5230	0.000	1	109.5230	0.000	1	109.5230	0.000	1	109.6942	2.547	6	109.6942	2.547	6
2	542	542	5:SP2_SP2_SP3	B[5]	N[5]	N[5]	3:3:3:	3:4:3:	3:4:3:	N[5]-3:N[5]-3:B-3:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5](N[5]C[6a]C[5])2(BBr2)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	B[5](N[5]C[6a]C[5])2(BBr2){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	108.2080	0.000	1	108.2080	0.000	1	108.2080	0.000	1	108.2080	0.000	1	109.6942	2.547	6	109.6942	2.547	6
2	542	542	5:SP2_SP2_SP3	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	108.6030	0.000	1	108.6030	0.000	1	108.5430	0.007	2	108.5430	0.007	2	109.6942	2.547	6	109.6942	2.547	6
2	542	542	5:SP2_SP2_SP3	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3)	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|C<3>,2|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|C<3>,2|H<1>}	108.4830	0.000	1	108.4830	0.000	1	108.5430	0.007	2	108.5430	0.007	2	109.6942	2.547	6	109.6942	2.547	6
2	542	542	5:SP2_SP3_SP3	B[5]	N[5]	N[5]	3:3:3:	3:4:4:	3:4:4:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[5]-4:C-4:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	109.0960	0.000	1	109.0960	0.000	1	109.0960	0.000	1	109.0960	0.000	1	109.0960	0.000	1	109.0960	0.000	1
2	542	643	0:SP2_SP2_SP2	B[5]	N[5,6]	C[6a]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[5]-3:C[6a]-3:	C[5,6]-3:B[5]-3:C[6]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H)	C[6a](B[5]N[5,6]C[5])(C[6a]C[6a]H)2	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|H<1>,7|C<3>}	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H){2|H<1>,5|C<3>}	C[6a](B[5]N[5,6]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>}	119.5360	0.000	1	119.5360	0.000	1	119.5360	0.000	1	119.5360	0.000	1	119.5360	0.000	1	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:C[6a]-3:C[5]-3:	B[5]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C)	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C){2|H<1>,6|C<3>}	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|B<3>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	121.9335	1.798	2	121.9335	3.233	2	121.9335	3.233	2	123.2070	3.451	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2)	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]Cl)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2){1|Cl<1>,4|H<1>,6|C<3>}	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]Cl){2|C<4>,2|H<1>,5|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|C<4>,2|H<1>,4|C<3>}	124.4805	0.795	2	124.4805	0.633	2	124.4805	0.633	2	123.2070	3.451	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:3:4:	3:3:3:	N[5]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[5]-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2)	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(C[6a]C[6a]2){1|Cl<1>,4|H<1>,6|C<3>}	N[5](B[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|Cl<1>,2|C<4>,5|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|C<4>,2|H<1>,4|C<3>}	131.6665	0.288	2	131.6665	0.083	2	131.6665	0.083	2	131.6665	0.083	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(C[6a]C[6a]2){2|C<4>,6|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	125.8670	0.000	1	125.8670	0.000	1	125.8670	0.000	1	126.6570	1.248	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(C[6a]C[6a]2)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(C[6a]C[6a]2){2|C<4>,6|C<3>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	127.4470	0.000	1	127.4470	0.000	1	127.4470	0.000	1	126.6570	1.248	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(CC3)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(CC3){4|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	131.0500	0.291	2	131.0500	0.085	2	130.7643	0.287	3	128.8736	6.996	5	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HN)(CC3)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|N<3>,4|C<3>,4|H<1>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HN)(CC3){4|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	130.1930	0.000	1	130.1930	0.000	1	130.7643	0.287	3	128.8736	6.996	5	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|C<3>,2|H<1>,4|C<4>}	125.4910	0.000	1	125.4910	0.000	1	126.0375	0.597	2	128.8736	6.996	5	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|B<3>,1|C<3>,1|H<1>,4|C<4>}	126.5840	0.000	1	126.5840	0.000	1	126.0375	0.597	2	128.8736	6.996	5	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	4:3:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	C[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	N[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	125.6047	0.597	3	125.6047	0.357	3	125.6047	0.357	3	126.1178	1.291	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	4:3:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	C[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](C[5]C[5,5a]C[6a]H)(B[5]N[5,5a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	N[5](C[5]C[5,5a]C[6a]H)(B[5]N[5,5a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	127.6570	0.000	1	127.6570	0.000	1	127.6570	0.000	1	126.1178	1.291	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3){1|H<1>,1|N<3>,5|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	130.9250	1.556	3	130.9250	2.422	3	129.3843	11.110	4	129.3843	11.110	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC[6a]HH)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]C)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){2|C<4>,2|H<1>,5|C<3>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC[6a]HH){1|N<3>,5|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,3|C<3>}	124.7620	0.000	1	124.7620	0.000	1	129.3843	11.110	4	129.3843	11.110	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	3:3:4:	3:3:2:	3:3:3:	N[5]-3:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:N[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5])	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,5|C<3>}	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]){4|H<1>,5|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|N<2>,3|C<3>,4|H<1>}	129.9060	1.207	4	129.9060	1.456	4	129.9060	1.456	4	129.9060	1.456	4	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	4:3:3:	3:3:1:	3:3:3:	C[5,6]-4:C[6a]-3:N[5]-3:	N[5,6]-3:B[5]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H)	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H){1|B<3>,2|C<4>,6|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,4|H<1>,6|C<3>}	124.1120	0.000	1	125.4235	3.440	2	125.4235	3.440	2	125.4235	3.440	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	4:3:3:	3:3:1:	3:3:3:	C[5,6]-4:C[6a]-3:N[5]-3:	N[5,6]-3:B[5]-3:H-1:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H)	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]H){1|B<3>,2|C<4>,6|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H){1|C<4>,1|H<1>,6|C<3>}	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,4|H<1>,6|C<3>}	126.7350	0.000	1	125.4235	3.440	2	125.4235	3.440	2	125.4235	3.440	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	4:3:3:	3:3:2:	3:3:3:	C[5]-4:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:N[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2)	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5])	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](C[5]C[6a]C[5]H)(N[5]C[6a]N[5])(C[6a]C[6a]2){2|H<1>,7|C<3>}	N[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]){1|H<1>,2|C<4>,6|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|N<2>,3|H<1>,4|C<3>}	127.3090	0.000	1	127.3090	0.000	1	127.3090	0.000	1	127.3090	0.000	1	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	4:3:3:	3:3:3:	3:3:3:	C[4,5]-4:N[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(C[6a]C[6a]2)	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2	B[5](C[4,5]C[4,5]C[6a]C[4])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|S<1>,2|H<1>,9|C<3>}	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,5|C<3>}	126.5960	0.157	2	126.5960	0.025	2	126.5960	0.025	2	126.5960	0.025	2	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP2	B[5]	N[5]	C[6a]	4:3:3:	3:3:4:	3:3:3:	C[4,5]-4:C[6a]-3:N[5]-3:	B[5]-3:C[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(CH3)	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2	B[5](C[4,5]C[4,5]C[6a]C[4])(C[6a]C[6a]2)(N[5]C[5]C){1|S<1>,2|H<1>,7|C<3>}	N[5](B[5]C[4,5]C[6a])(C[5]C[4,5]S)(CH3){6|C<3>}	C[6a](B[5]C[4,5]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,4|C<3>}	122.9280	0.000	1	122.9280	0.000	1	122.9280	0.000	1	122.9280	0.000	1	127.4113	9.332	31	127.1652	10.969	32
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	3:3:3:	3:3:3:	N[5]-3:C[6a]-3:C[5]-3:	B[5]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C)	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C){2|H<1>,6|C<3>}	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|B<3>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	122.5290	1.099	2	122.5290	1.207	2	122.5290	1.207	2	122.5290	1.207	2	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	3:3:4:	3:3:3:	C[6a]-3:C[5]-3:N[5]-3:	B[5]-3:N[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C)	N[5](B[5]C[6a]C[5])(N[5]B[5]C)(CCCH)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C){1|C<4>,2|H<1>,3|C<3>}	N[5](B[5]C[6a]C[5])(N[5]B[5]C)(CCCH){1|C<4>,3|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|B<3>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	123.0265	0.879	6	123.0265	0.772	6	123.0265	0.772	6	123.0265	0.772	6	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CC3){1|C<4>,2|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|C<3>,2|H<1>,4|C<4>}	125.6030	0.811	3	125.6030	0.658	3	125.4352	0.551	4	126.8564	10.512	5	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	C[6a]-3:N[5]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[6a]C[6a]2)(N[5]C[5]C)2	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3)	C[6a](C[6a]C[6a]H)2(B[5]N[5]2)	B[5](C[6a]C[6a]2)(N[5]C[5]C)2{2|C<3>,6|H<1>}	N[5](B[5]C[6a]N[5])(C[5]C[5]HH)(CH3){1|C<4>,2|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]N[5]2){1|B<3>,1|C<3>,1|H<1>,4|C<4>}	124.9320	0.000	1	124.9320	0.000	1	125.4352	0.551	4	126.8564	10.512	5	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	3:4:4:	3:3:3:	N[5,5a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(CC3)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(CC3){4|C<3>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	132.5410	0.000	1	132.5410	0.000	1	132.5410	0.000	1	126.8564	10.512	5	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3){1|H<1>,1|N<3>,5|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	131.0110	0.000	1	131.0110	0.000	1	131.0110	0.000	1	131.0110	0.000	1	124.6040	10.965	15	124.6040	10.965	15
2	542	643	0:SP2_SP2_SP3	B[5]	N[5]	C[6a]	4:3:3:	3:4:4:	3:3:3:	N[5,6]-4:C[6a]-3:N[5]-3:	B[5]-3:N[5]-4:C-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](N[5,6]B[5,6]N[6]Li)(C[6a]C[6a]2)(N[5]N[5]C)	N[5](B[5]N[5,6]C[6a])(N[5]B[5,6]LiC)(CH3)	C[6a](B[5]N[5,6]N[5])(C[6a]C[6a]H)2	B[5](N[5,6]B[5,6]N[6]Li)(C[6a]C[6a]2)(N[5]N[5]C){1|Li<5>,1|B<5>,1|N<4>,2|C<4>,2|H<1>,3|C<3>}	N[5](B[5]N[5,6]C[6a])(N[5]B[5,6]LiC)(CH3){2|N<4>,3|C<3>}	C[6a](B[5]N[5,6]N[5])(C[6a]C[6a]H)2{1|Li<5>,1|B<5>,1|C<3>,1|C<4>,2|H<1>,2|N<4>}	120.5500	0.000	1	120.5500	0.000	1	120.5500	0.000	1	120.5500	0.000	1	124.6040	10.965	15	124.6040	10.965	15
2	542	654	0:SP2_SP2_SP3	B[5]	N[5]	B[3,3]	4:3:3:	3:3:4:	4:2:2:3:	B[3,3]-4:N[5]-3:N[5]-3:	B[5]-3:C[6a]-3:C[5]-4:	B[3,3]-4:H[3]-2:H[3]-2:B[5]-3:	B[5](B[3,3]B[3,3]H[3]2)(N[5]C[6a]C[5])2	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH)	B[3,3](B[3,3]B[5]H[3]2)(H[3]B[3,3])2(B[5]N[5]2)	B[5](B[3,3]B[3,3]H[3]2)(N[5]C[6a]C[5])2{1|B<3>,4|C<3>,4|H<1>}	N[5](B[5]B[3,3]N[5])(C[6a]C[6a]2)(C[5]C[5]HH){1|B<4>,2|C<4>,2|H<1>,2|H<2>,3|C<3>}	B[3,3](B[3,3]B[5]H[3]2)(H[3]B[3,3])2(B[5]N[5]2){2|C<3>,2|C<4>,2|N<3>}	125.8678	1.323	4	125.8678	1.749	4	125.8678	1.749	4	125.8678	1.749	4	125.8678	1.749	4	125.8678	1.749	4
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:2:	4:3:4:	3:3:3:	C[5,6a]-3:N[5]-3:N-2:	C[5]-4:B[5]-3:C-4:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a])	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]){1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3){2|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	105.9330	0.000	1	105.9330	0.000	1	105.9330	0.000	1	105.9330	0.000	1	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	3:4:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(C[6a]C[6a]2){2|C<4>,6|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,3|H<1>,4|C<3>}	105.5360	0.000	1	105.5360	0.000	1	105.5360	0.000	1	105.5360	0.000	1	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	3:4:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]CH)(CC3){4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){2|C<4>,3|C<3>,3|H<1>}	106.1490	0.021	2	106.1490	0.000	2	106.3513	0.123	3	106.3513	0.123	3	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	3:4:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HN)(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|N<3>,4|C<3>,4|H<1>}	N[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HN)(CC3){4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	106.7560	0.000	1	106.7560	0.000	1	106.3513	0.123	3	106.3513	0.123	3	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	C[5]-4:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]C[6a])(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	N[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){3|H<1>,5|C<3>}	105.3360	0.277	3	105.3360	0.077	3	105.3360	0.077	3	105.5170	0.075	6	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:3:	3:3:3:	C[5,6a]-3:N[5]-3:N-3:	C[5]-4:B[5]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H)	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H){1|N<3>,2|H<1>,4|C<3>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(C[6a]C[6a]2){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|N<3>,2|C<3>,3|H<1>}	105.6980	0.108	3	105.6980	0.012	3	105.6980	0.012	3	105.5170	0.075	6	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3){1|H<1>,1|N<3>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){2|C<4>,3|C<3>,3|H<1>}	106.8313	0.316	3	106.8313	0.100	3	106.4625	0.611	4	106.4200	0.467	5	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC[6a]HH)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){2|C<4>,2|H<1>,5|C<3>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC[6a]HH){1|N<3>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,3|H<1>,4|C<3>}	105.3560	0.000	1	105.3560	0.000	1	106.4625	0.611	4	106.4200	0.467	5	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP2	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:N[5]-3:N-3:	C[5]-4:B[5]-3:C-4:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H)	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H){1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3){2|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	106.2500	0.000	1	106.2500	0.000	1	106.2500	0.000	1	106.4200	0.467	5	105.9828	0.357	16	105.9828	0.357	16
2	542	727	5:SP2_SP2_SP3	B[5]	N[5]	C[5,6a]	3:3:3:	4:3:4:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	C[5]-4:B[5]-3:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](C[5]C[5,6a]C[5]H)(B[5]C[5,6a]C[6a])(CC3){1|H<1>,1|N<3>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){2|C<4>,3|C<3>,3|H<1>}	106.5820	0.000	1	106.5820	0.000	1	106.5820	0.000	1	106.5820	0.000	1	106.5820	0.000	1	106.5820	0.000	1
2	542	770	0:SP2_SP2_SP2	B[5]	N[5]	B	3:3:3:	3:4:3:	3:1:1:	N[5]-3:N[5]-3:B-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:Br-1:Br-1:	B[5](N[5]C[6a]C[5])2(BBr2)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	B(B[5]N[5]2)(Br)2	B[5](N[5]C[6a]C[5])2(BBr2){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	B(B[5]N[5]2)(Br)2	126.4980	0.000	1	126.4980	0.000	1	126.4980	0.000	1	126.4980	0.000	1	126.4433	1.957	3	126.4433	1.957	3
2	542	770	0:SP2_SP2_SP2	B[5]	N[5]	B	3:3:3:	3:4:3:	3:2:2:	N[5]-3:N[5]-3:B-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:O-2:O-2:	B[5](N[5]C[6a]C[5])2(BOO)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	B(B[5]N[5]2)(OC)2	B[5](N[5]C[6a]C[5])2(BOO){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	B(B[5]N[5]2)(OC)2	126.4160	1.977	2	126.4160	3.909	2	126.4160	3.909	2	126.4160	3.909	2	126.4433	1.957	3	126.4433	1.957	3
2	542	770	0:SP2_SP2_SP3	B[5]	N[5]	B	3:3:3:	3:4:3:	3:1:1:	N[5]-3:N[5]-3:B-3:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:Br-1:Br-1:	B[5](N[5]C[6a]C[5])2(BBr2)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B)	B(B[5]N[5]2)(Br)2	B[5](N[5]C[6a]C[5])2(BBr2){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]B){2|C<4>,2|H<1>,3|C<3>}	B(B[5]N[5]2)(Br)2	125.2600	0.000	1	125.2600	0.000	1	125.2600	0.000	1	125.2600	0.000	1	125.2600	0.000	1	125.2600	0.000	1
2	542	786	5:SP2_SP3_SP3	B[5]	N[5]	B[5]	3:4:3:	4:3:3:	3:3:1:1:	N[5]-3:B[5]-4:N-3:	C[6]-4:B[5]-3:C[5]-3:	N[5]-3:B[5]-3:Cl-1:Cl-1:	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC)	N[5](C[6]C[6]2H)(B[5]B[5]N)(C[5]N[5]N)	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC){1|H<1>,1|N<3>,3|C<4>}	N[5](C[6]C[6]2H)(B[5]B[5]N)(C[5]N[5]N){2|Cl<1>,3|C<4>,4|H<1>}	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2{1|H<1>,1|N<3>,3|C<4>}	105.0780	0.000	1	105.0780	0.000	1	105.0780	0.000	1	105.0780	0.000	1	105.0780	0.000	1	105.0780	0.000	1
2	542	790	0:SP2_SP-NON_SP2	B[5]	N[5]	Cl	3:3:1:	4:3:3:	3:	N[5]-3:N[5]-3:Cl-1:	C[5]-4:C[6a]-3:B[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Cl)	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl)	Cl(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Cl){2|Cl<1>,2|H<1>,4|C<3>}	N[5](C[5]C[5]ClH)(C[6a]C[6a]2)(B[5]N[5]Cl){1|Cl<1>,1|H<1>,2|C<4>,3|C<3>}	Cl(B[5]N[5]2)	125.3270	0.197	2	125.3270	0.039	2	125.3270	0.039	2	125.3270	0.039	2	125.3270	0.039	2	125.3270	0.039	2
2	542	813	5:SP2_SP2_SP2	B[5]	N[5]	N[5,5a]	3:3:3:	3:4:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(C[6a]C[6a]2)	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(C[6a]C[6a]2){2|C<4>,6|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){1|C<4>,3|C<3>,3|H<1>}	105.8990	0.000	1	105.8990	0.000	1	105.8990	0.000	1	105.8990	0.000	1	105.8975	0.000	2	105.8975	0.000	2
2	542	813	5:SP2_SP2_SP2	B[5]	N[5]	N[5,5a]	3:3:3:	4:3:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	C[5]-4:B[5]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	N[5](C[5]C[5,5a]C[6a]H)(B[5]N[5,5a]C[6a])(C[6a]C[6a]2)	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	N[5](C[5]C[5,5a]C[6a]H)(B[5]N[5,5a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){3|H<1>,4|C<3>}	105.8960	0.000	1	105.8960	0.000	1	105.8960	0.000	1	105.8960	0.000	1	105.8975	0.000	2	105.8975	0.000	2
2	542	813	5:SP2_SP2_SP3	B[5]	N[5]	N[5,5a]	3:3:3:	3:4:4:	3:3:3:	N[5,5a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[5]-4:C-4:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C)	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(CC3)	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	N[5](B[5]N[5,5a]C[6a])(C[5]C[5,5a]CH)(CC3){4|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){2|C<3>,2|C<4>,3|H<1>}	106.7350	0.000	1	106.7350	0.000	1	106.7350	0.000	1	106.7350	0.000	1	106.7350	0.000	1	106.7350	0.000	1
2	542	818	0:SP2_SP2_SP2	B[5]	N[5]	C[5]	6:3:3:	3:3:3:	3:3:3:	C[5x3,6x5,20x6]-6:N[5]-3:C[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5]-3:N[5]-3:N[5]-3:	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2)	N[5](B[5]C[5x3,6x5,20x6]C[5])(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2)	C[5](B[5]C[5x3,6x5,20x6]N[5])(N[5]C[5]C)2	B[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[6a]C[5])(C[5]N[5]2){3|C<4>,4|C<3>,4|H<1>,5|B<6>}	N[5](B[5]C[5x3,6x5,20x6]C[5])(C[5]C[5x3,6x5,20x6]C)(C[6a]C[6a]2){2|C<3>,2|C<4>,2|N<3>,6|B<6>}	C[5](B[5]C[5x3,6x5,20x6]N[5])(N[5]C[5]C)2{1|C<6>,2|C<3>,2|C<4>,4|B<6>}	128.4170	0.132	2	128.4170	0.017	2	128.4170	0.017	2	128.4170	0.017	2	128.4170	0.017	2	128.4170	0.017	2
2	542	818	5:SP2_SP2_SP2	B[5]	N[5,6]	C[5]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[5]-3:C[6a]-3:	C[5,6]-3:B[5]-3:C[6]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H)	C[5](B[5]N[5,6]C[6a])(C[5]C[5,6]C[6a])(C[6a]C[6a]2)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|H<1>,7|C<3>}	N[5,6](C[5,6]C[5]C[6])(B[5]C[6a]C[5])(C[6]C[6]H){2|H<1>,5|C<3>}	C[5](B[5]N[5,6]C[6a])(C[5]C[5,6]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	106.9000	0.000	1	106.9000	0.000	1	106.9000	0.000	1	106.9000	0.000	1	106.9000	0.000	1	108.4363	1.867	3
2	542	818	5:SP2_SP2_SP2	B[5]	N[5]	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5]-3:C[6a]-3:C[5]-3:	B[5]-3:N[5]-3:C[6a]-3:	B[5]-3:B[5]-3:C-4:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C)	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2)	C[5](B[5]C[6a]N[5])2(CH3)	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C){2|H<1>,6|C<3>}	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[5](B[5]C[6a]N[5])2(CH3){6|C<3>}	109.2045	0.441	2	109.2045	0.194	2	109.2045	0.194	2	109.2045	0.194	2	109.2045	0.194	2	108.4363	1.867	3
2	542	818	5:SP2_SP2_SP3	B[5]	N[5]	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5]-3:C[6a]-3:C[5]-3:	B[5]-3:N[5]-3:C[6a]-3:	B[5]-3:B[5]-3:C-4:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C)	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2)	C[5](B[5]C[6a]N[5])2(CH3)	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C){2|H<1>,6|C<3>}	N[5](B[5]C[6a]C[5])(N[5]C[6a]B[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[5](B[5]C[6a]N[5])2(CH3){6|C<3>}	108.4640	0.253	2	108.4640	0.064	2	108.4640	0.064	2	108.4640	0.064	2	109.6063	0.524	8	109.6063	0.524	8
2	542	818	5:SP2_SP2_SP3	B[5]	N[5]	C[5]	3:3:3:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:N[5]-3:	B[5]-3:N[5]-3:C-4:	B[5]-3:B[5]-3:C-4:	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C)	N[5](B[5]C[6a]C[5])(N[5]B[5]C)(CCCH)	C[5](B[5]C[6a]N[5])2(CH3)	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C){1|C<4>,2|H<1>,3|C<3>}	N[5](B[5]C[6a]C[5])(N[5]B[5]C)(CCCH){1|C<4>,3|C<3>}	C[5](B[5]C[6a]N[5])2(CH3){2|C<4>,4|C<3>}	109.9870	0.158	6	109.9870	0.025	6	109.9870	0.025	6	109.9870	0.025	6	109.6063	0.524	8	109.6063	0.524	8
2	542	880	0:SP2_SP2_SP3	B[5]	N[5]	Si	3:3:4:	3:4:3:	3:3:4:4:	N[5]-3:N[5]-3:Si-4:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:B[5]-3:C-4:C-4:	B[5](N[5]C[6a]C[5])2(SiC[6a]CC)	N[5](C[6a]C[6a]N[6a])(C[5]C[6a]C[5]H)(B[5]N[5]Si)	Si(C[6a]C[6a]2)(B[5]N[5]2)(CH3)2	B[5](N[5]C[6a]C[5])2(SiC[6a]CC){1|N<2>,2|H<1>,5|C<3>}	N[5](C[6a]C[6a]N[6a])(C[5]C[6a]C[5]H)(B[5]N[5]Si){2|H<1>,6|C<3>}	Si(C[6a]C[6a]2)(B[5]N[5]2)(CH3)2	128.8660	0.000	1	128.8660	0.000	1	128.8660	0.000	1	128.8660	0.000	1	126.7965	8.566	2	126.7965	8.566	2
2	542	880	0:SP2_SP2_SP3	B[5]	N[5]	Si	3:3:4:	4:3:3:	3:3:4:4:	N[5]-3:N[5]-3:Si-4:	C[5]-4:C[6a]-3:B[5]-3:	C[6a]-3:B[5]-3:C-4:C-4:	B[5](N[5]C[6a]C[5])2(SiC[6a]CC)	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(B[5]N[5]Si)	Si(C[6a]C[6a]2)(B[5]N[5]2)(CH3)2	B[5](N[5]C[6a]C[5])2(SiC[6a]CC){1|N<2>,2|H<1>,5|C<3>}	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(B[5]N[5]Si){1|O<2>,2|H<1>,6|C<3>}	Si(C[6a]C[6a]2)(B[5]N[5]2)(CH3)2	124.7270	0.000	1	124.7270	0.000	1	124.7270	0.000	1	124.7270	0.000	1	126.7965	8.566	2	126.7965	8.566	2
2	542	893	0:SP2_SP2_SP2	B[5]	N[5]	O	3:3:2:	3:4:3:	3:4:	N[5]-3:N[5]-3:O-2:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])2(OC)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O)	O(B[5]N[5]2)(CC[6a]HH)	B[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O){2|C<4>,2|H<1>,3|C<3>}	O(B[5]N[5]2)(CC[6a]HH)	121.2560	0.000	1	121.2560	0.000	1	121.2560	0.000	1	121.2560	0.000	1	121.0156	73.584	5	121.0156	73.584	5
2	542	893	0:SP2_SP2_SP2	B[5]	N[5]	O	3:4:2:	3:3:3:	3:4:	N[5]-3:C[5]-4:O-2:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,1|H<1>,2|C<3>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,1|H<1>,2|C<3>,2|C<4>}	O(B[5]C[5]N[5])(CH3)	129.6450	0.000	1	120.9555	98.087	4	120.9555	98.087	4	120.9555	98.087	4	121.0156	73.584	5	121.0156	73.584	5
2	542	893	0:SP2_SP2_SP2	B[5]	N[5]	O	3:4:2:	3:3:3:	3:4:	N[5]-3:C[5]-4:O-2:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<3>,2|C<3>,2|H<1>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,2|C<3>,2|C<4>,2|H<1>}	O(B[5]C[5]N[5])(CH3)	129.4190	0.000	1	120.9555	98.087	4	120.9555	98.087	4	120.9555	98.087	4	121.0156	73.584	5	121.0156	73.584	5
2	542	893	0:SP2_SP2_SP2	B[5]	N[5]	O	3:4:2:	3:3:3:	3:4:	N[5]-3:C[5]-4:O-2:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC)	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B)	O(B[5]C[5]N[5])(CH3)	B[5](N[5]C[6a]C[5])(C[5]C[5]Si2)(OC){1|B<4>,2|C<3>,2|H<1>}	N[5](C[6a]C[6a]2)(B[5]C[5]O)(C[5]C[5]B){2|Si<4>,2|C<3>,2|C<4>,2|H<1>}	O(B[5]C[5]N[5])(CH3)	112.3790	0.107	2	120.9555	98.087	4	120.9555	98.087	4	120.9555	98.087	4	121.0156	73.584	5	121.0156	73.584	5
2	542	893	0:SP2_SP2_SP3	B[5]	N[5]	O	3:3:2:	3:4:3:	3:4:	N[5]-3:N[5]-3:O-2:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:C-4:	B[5](N[5]C[6a]C[5])2(OC)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O)	O(B[5]N[5]2)(CC[6a]HH)	B[5](N[5]C[6a]C[5])2(OC){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]O){2|C<4>,2|H<1>,3|C<3>}	O(B[5]N[5]2)(CC[6a]HH)	129.2210	0.000	1	129.2210	0.000	1	129.2210	0.000	1	129.2210	0.000	1	129.2210	0.000	1	129.2210	0.000	1
2	542	924	0:SP2_SP-NON_SP2	B[5]	N[5]	Br	3:3:1:	3:3:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]B)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){1|B<4>,2|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]B){2|C<4>,2|H<1>,3|C<3>}	Br(B[5]N[5]2)	123.5250	0.000	1	123.5250	0.000	1	124.7310	2.909	2	124.7310	2.909	2	125.9943	4.002	6	125.9943	4.002	6
2	542	924	0:SP2_SP-NON_SP2	B[5]	N[5]	Br	3:3:1:	3:3:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]H)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){3|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(B[5]N[5]Br)(C[5]C[5]H){2|C<4>,2|H<1>,3|C<3>}	Br(B[5]N[5]2)	125.9370	0.000	1	125.9370	0.000	1	124.7310	2.909	2	124.7310	2.909	2	125.9943	4.002	6	125.9943	4.002	6
2	542	924	0:SP2_SP-NON_SP2	B[5]	N[5]	Br	3:3:1:	3:4:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){1|B<4>,2|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){1|B<4>,2|C<4>,3|C<3>}	Br(B[5]N[5]2)	128.7370	0.000	1	126.6260	4.104	4	126.6260	4.104	4	126.6260	4.104	4	125.9943	4.002	6	125.9943	4.002	6
2	542	924	0:SP2_SP-NON_SP2	B[5]	N[5]	Br	3:3:1:	3:4:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){3|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){1|H<1>,2|C<4>,3|C<3>}	Br(B[5]N[5]2)	127.9830	0.000	1	126.6260	4.104	4	126.6260	4.104	4	126.6260	4.104	4	125.9943	4.002	6	125.9943	4.002	6
2	542	924	0:SP2_SP-NON_SP2	B[5]	N[5]	Br	3:3:1:	3:4:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){2|C<4>,2|H<1>,3|C<3>}	Br(B[5]N[5]2)	124.8920	0.000	2	126.6260	4.104	4	126.6260	4.104	4	126.6260	4.104	4	125.9943	4.002	6	125.9943	4.002	6
2	542	924	0:SP2_SP-NON_SP3	B[5]	N[5]	Br	3:3:1:	3:4:3:	3:	N[5]-3:N[5]-3:Br-1:	C[6a]-3:C[5]-4:B[5]-3:	B[5]-3:	B[5](N[5]C[6a]C[5])2(Br)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br)	Br(B[5]N[5]2)	B[5](N[5]C[6a]C[5])2(Br){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]Br){2|C<4>,2|H<1>,3|C<3>}	Br(B[5]N[5]2)	123.4300	0.000	2	123.4300	0.000	2	123.4300	0.000	2	123.4300	0.000	2	123.4300	0.000	2	123.4300	0.000	2
2	542	930	0:SP2_SP2_SP2	B[5]	N[5]	C	3:3:3:	3:4:3:	3:3:1:	N[5]-3:N[5]-3:C-3:	C[6a]-3:C[5]-4:B[5]-3:	C[6a]-3:B[5]-3:O-1:	B[5](N[5]C[6a]C[5])2(CC[6a]O)	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C)	C(C[6a]C[6a]2)(B[5]N[5]2)(O)	B[5](N[5]C[6a]C[5])2(CC[6a]O){4|C<3>,4|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]HH)(B[5]N[5]C){2|C<4>,2|H<1>,3|C<3>}	C(C[6a]C[6a]2)(B[5]N[5]2)(O)	125.4765	2.536	4	125.4765	6.433	4	125.4765	6.433	4	125.4765	6.433	4	125.6480	4.751	6	125.6480	4.751	6
2	542	930	0:SP2_SP2_SP2	B[5]	N[5]	C	3:3:3:	4:3:4:	3:3:1:	N[5]-3:N[5]-3:C-3:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6]-3:H-1:	B[5](N[5]C[5]C)2(CC[6]H)	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3)	C(B[5]N[5]2)(C[6]C[6]2)(H)	B[5](N[5]C[5]C)2(CC[6]H){4|H<1>}	N[5](C[5]C[5]HH)(B[5]N[5]C)(CH3){1|C<4>,2|H<1>}	C(B[5]N[5]2)(C[6]C[6]2)(H)	125.9910	2.025	2	125.9910	4.101	2	125.9910	4.101	2	125.9910	4.101	2	125.6480	4.751	6	125.6480	4.751	6
2	542	941	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:2:	4:3:4:	3:3:	C[5,6a]-3:N[5]-3:N-2:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a])	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]){1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3){2|C<3>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)	127.1460	0.000	1	127.1460	0.000	1	127.1460	0.000	1	127.1460	0.000	1	128.2605	2.484	2	128.2605	2.484	2
2	542	941	0:SP2_SP2_SP2	B[5]	N[5]	N	3:4:2:	3:3:3:	3:3:	N[5]-3:C[5]-4:N-2:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:C[6a]-3:	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a])	N[5](C[6a]C[6a]2)(B[5]C[5]N)(C[5]C[5]C)	N(B[5]C[5]N[5])(C[6a]C[6a]2)	B[5](N[5]C[6a]C[5])(C[5]C[5]2C)(NC[6a]){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	N[5](C[6a]C[6a]2)(B[5]C[5]N)(C[5]C[5]C){1|H<1>,3|C<3>,3|C<4>}	N(B[5]C[5]N[5])(C[6a]C[6a]2)	129.3750	0.000	1	129.3750	0.000	1	129.3750	0.000	1	129.3750	0.000	1	128.2605	2.484	2	128.2605	2.484	2
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:3:	3:3:3:	3:4:4:	N[5]-3:B[5]-3:N-3:	B[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC)	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N)	N(B[5]B[5]N[5])(CH3)2	B[5](N[5]C[6a]B[5])(B[5]N[5]N)(NCC){1|B<3>,3|C<3>}	N[5](B[5]B[5]N[5])(C[6a]C[6a]2)(B[5]B[5]N){2|H<1>,3|C<3>,3|N<3>}	N(B[5]B[5]N[5])(CH3)2	123.9468	1.845	4	123.9468	3.406	4	123.9468	3.406	4	122.8575	4.903	6	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:3:	3:3:3:	3:4:4:	N[5]-3:N[5]-3:N-3:	Ge[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC)	N[5](Ge[5]Ge[3,3,5]C)(C[6a]C[6a]2)(B[5]N[5]N)	N(B[5]N[5]2)(CCCH)2	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC){1|B<4>,1|C<2>,2|N<3>,4|C<3>}	N[5](Ge[5]Ge[3,3,5]C)(C[6a]C[6a]2)(B[5]N[5]N){1|B<4>,2|C<4>,2|N<3>,3|C<3>}	N(B[5]N[5]2)(CCCH)2	120.6790	0.243	2	120.6790	0.059	2	120.6790	0.059	2	122.8575	4.903	6	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:3:	4:3:3:	3:3:1:	C[5,6a]-3:N[5]-3:N-3:	C[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H)	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(C[6a]C[6a]2)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H){1|N<3>,2|H<1>,4|C<3>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(C[6a]C[6a]2){2|C<4>,4|C<3>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	124.1817	0.658	3	124.1817	0.433	3	124.1817	0.433	3	124.1817	0.433	3	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:3:	4:3:4:	3:3:1:	C[5,6a]-3:N[5]-3:N-3:	C[5]-4:B[5]-3:C-4:	B[5]-3:C[6a]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H)	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H){1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]HN)(B[5]C[5,6a]N)(CC3){2|C<3>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	126.5700	0.000	1	126.5700	0.000	1	126.5700	0.000	1	126.5700	0.000	1	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:3:3:	5:3:3:	3:4:4:	N[5]-3:N[5]-3:N-3:	Ge[3,3,5]-5:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC)	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N)	N(B[5]N[5]2)(CCCH)2	B[5](N[5]Ge[3,3,5]C[6a])(N[5]C[6a]Ge[5])(NCC){1|B<4>,1|C<2>,2|N<3>,4|C<3>}	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N){1|C<2>,1|N<3>,2|C<4>,5|C<3>}	N(B[5]N[5]2)(CCCH)2	121.8360	0.430	2	121.8360	0.185	2	121.8360	0.185	2	121.8360	0.185	2	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP2	B[5]	N[5]	N	3:4:3:	3:3:3:	3:4:4:	N[5]-3:C[5]-4:N-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC)	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]N)	N(B[5]C[5]N[5])(CCCH)2	B[5](N[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(NCC){4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]N){2|C<4>,3|H<1>,4|C<3>}	N(B[5]C[5]N[5])(CCCH)2	126.5280	0.000	1	126.5280	0.000	1	126.5280	0.000	1	126.5280	0.000	1	123.5738	4.458	13	123.5738	4.458	13
2	542	956	0:SP2_SP2_SP3	B[5]	N[5]	N	3:4:3:	3:3:3:	3:4:4:	N[5]-3:C[5]-4:N-3:	N[5]-3:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC)	N[5](N[5]C[6a]B[5])(C[6a]C[6a]2)(B[5]C[5]N)	N(B[5]C[5]N[5])(CH3)2	B[5](N[5]C[6a]N[5])(C[5]B[5]CH)(NCC){1|N<3>,3|C<3>}	N[5](N[5]C[6a]B[5])(C[6a]C[6a]2)(B[5]C[5]N){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	N(B[5]C[5]N[5])(CH3)2	122.7860	1.021	2	122.7860	1.043	2	122.7860	1.043	2	122.7860	1.043	2	123.1470	0.912	3	123.1470	0.912	3
2	542	956	0:SP2_SP2_SP3	B[5]	N[5]	N	3:4:3:	4:3:3:	3:4:4:	N[5]-3:B[5]-4:N-3:	C[6]-4:B[5]-3:C[5]-3:	B[5]-3:C-4:C-4:	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC)	N[5](C[6]C[6]2H)(B[5]B[5]N)(C[5]N[5]N)	N(B[5]B[5]N[5])(CH3)2	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC){1|H<1>,1|N<3>,3|C<4>}	N[5](C[6]C[6]2H)(B[5]B[5]N)(C[5]N[5]N){2|Cl<1>,3|C<4>,4|H<1>}	N(B[5]B[5]N[5])(CH3)2	123.8690	0.000	1	123.8690	0.000	1	123.8690	0.000	1	123.8690	0.000	1	123.1470	0.912	3	123.1470	0.912	3
2	562	893	0:SP2_SP2_SP3	B[5]	Si[5]	O	4:4:2:	3:3:3:1:	3:4:	Si[5]-4:C[5]-4:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:H-1:	B[5]-3:C-4:	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC)	Si[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]O)(H)	O(B[5]Si[5]C[5])(CC3)	B[5](Si[5]C[5,6a]C[6a]H)(C[5]C[5,6a]Si2)(OC){4|C<3>}	Si[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]O)(H){2|Si<4>,3|C<4>,4|C<3>}	O(B[5]Si[5]C[5])(CC3)	133.4510	0.000	1	133.4510	0.000	1	133.4510	0.000	1	133.4510	0.000	1	133.4510	0.000	1	133.4510	0.000	1
2	610	976	0:SP2_SP2_SP3	B[5]	B	O[5]	4:2:2:	3:3:3:3:	4:3:	B-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:N[6]-3:	C[5]-4:B[5]-3:	B[5](BC[6a]2N[6])(O[5]C[5])2	B(C[6a]C[6a]2)2(B[5]O[5]2)(N[6]C[6]2)	O[5](C[5]C[5]CC)(B[5]O[5]B)	B[5](BC[6a]2N[6])(O[5]C[5])2{4|C<4>}	B(C[6a]C[6a]2)2(B[5]O[5]2)(N[6]C[6]2)	O[5](C[5]C[5]CC)(B[5]O[5]B){2|C<4>}	124.3185	0.702	2	124.3185	0.493	2	124.3185	0.493	2	124.3185	0.493	2	124.3185	0.493	2	124.3185	0.493	2
2	622	818	0:SP2_SP2_SP2	B[5,6]	O[6]	C[5]	3:3:2:	3:3:	3:3:3:	O[5,6,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:B[5,6]-3:	B[5,6]-3:C[5]-3:C[6a]-3:	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6])	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5])	C[5](B[5,6]O[5,6,6]O[6])(C[5]B[5,6]C[6a])(C[6a]C[6a]2)	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6]){1|Cl<1>,3|O<3>,5|C<3>}	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5]){3|B<4>,4|C<3>}	C[5](B[5,6]O[5,6,6]O[6])(C[5]B[5,6]C[6a])(C[6a]C[6a]2){1|Cl<1>,1|B<3>,1|B<4>,1|O<3>,2|H<1>,4|C<3>}	131.5460	0.000	1	131.5460	0.000	1	131.5460	0.000	1	130.3890	2.677	2	130.3890	2.677	2	130.3890	2.677	2
2	622	818	0:SP2_SP2_SP2	B[5,6]	O[6]	C[5]	3:3:2:	3:3:	3:3:3:	O[5,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:B[5,6]-3:	B[5,6]-3:C[5]-3:C[6a]-3:	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6])	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5])	C[5](B[5,6]O[5,6]O[6])(C[5]C[6a]B[5])(C[6a]C[6a]2)	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6]){2|Cl<1>,2|O<3>,5|C<3>}	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5]){3|B<4>,4|C<3>}	C[5](B[5,6]O[5,6]O[6])(C[5]C[6a]B[5])(C[6a]C[6a]2){2|Cl<1>,1|B<3>,1|B<4>,2|H<1>,4|C<3>}	129.2320	0.000	1	129.2320	0.000	1	129.2320	0.000	1	130.3890	2.677	2	130.3890	2.677	2	130.3890	2.677	2
2	622	916	6:SP2_SP2_SP3	B[5,6]	O[6]	O[5,6,6]	3:3:2:	3:3:	4:4:3:	O[5,6,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:B[5,6]-3:	B[5,6,6]-4:B[5,6]-4:B[5,6]-3:	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6])	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5])	O[5,6,6](B[5,6,6]O[5,6]2C[5])(B[5,6]O[5,6]C[5]Cl)(B[5,6]C[5]O[6])	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6]){1|Cl<1>,3|O<3>,5|C<3>}	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5]){3|B<4>,4|C<3>}	O[5,6,6](B[5,6,6]O[5,6]2C[5])(B[5,6]O[5,6]C[5]Cl)(B[5,6]C[5]O[6]){2|B<4>,3|B<3>,4|C<3>}	118.1410	0.000	1	118.1410	0.000	1	118.1410	0.000	1	118.1410	0.000	1	118.1410	0.000	1	118.3925	0.127	2
2	622	916	6:SP2_SP2_SP3	B[5,6]	O[6]	O[5,6]	3:3:2:	3:3:	4:3:4:	O[5,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:B[5,6]-3:	B[5,6,6]-4:B[5,6]-3:B[5]-4:	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6])	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5])	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]C[5]O[6])(B[5]C[5]Cl2)	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6]){2|Cl<1>,2|O<3>,5|C<3>}	O[6](B[5,6]O[5,6,6]C[5])(B[5,6]O[5,6]C[5]){3|B<4>,4|C<3>}	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]C[5]O[6])(B[5]C[5]Cl2){2|B<3>,2|B<4>,4|C<3>}	118.6440	0.000	1	118.6440	0.000	1	118.6440	0.000	1	118.6440	0.000	1	118.6440	0.000	1	118.3925	0.127	2
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,5a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]2)(C[6a]C[6a]C)2	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H)	B[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|S<2>,4|C<3>}	C[6a](B[5]C[5,5a]2)(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|Si<4>,1|S<2>,3|C<3>}	128.7075	3.128	2	128.7075	9.781	2	128.7075	9.781	2	129.4301	2.650	7	129.4301	2.650	7	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,5a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])2(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]2)(C[6a]C[6a]C)2	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])	B[5](C[5,5a]C[5a,6a]C[5,5a])2(C[6a]C[6a]2){2|C<4>,2|S<2>,6|C<3>}	C[6a](B[5]C[5,5a]2)(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a]){1|H<1>,1|S<2>,5|C<3>}	128.5645	0.032	2	128.5645	0.001	2	128.5645	0.001	2	129.4301	2.650	7	129.4301	2.650	7	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]N[5a])(B[5]C[5,6a]C[6a])	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|N<3>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]N[5a])(B[5]C[5,6a]C[6a]){1|C<4>,1|H<1>,6|C<3>}	130.6290	0.000	1	130.6290	0.000	1	130.4890	0.105	3	129.4301	2.650	7	129.4301	2.650	7	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]O[5a])(B[5]C[5,6a]C[6a])	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|O<2>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]O[5a])(B[5]C[5,6a]C[6a]){1|H<1>,6|C<3>}	130.7200	0.000	1	130.7200	0.000	1	130.4890	0.105	3	129.4301	2.650	7	129.4301	2.650	7	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]S[5a])(B[5]C[5,6a]C[6a])	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|S<2>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]S[5a])(B[5]C[5,6a]C[6a]){1|H<1>,6|C<3>}	130.1180	0.000	1	130.1180	0.000	1	130.4890	0.105	3	129.4301	2.650	7	129.4301	2.650	7	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|N<3>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|N<3>,2|H<1>,4|C<3>}	126.3730	0.000	1	126.8143	0.251	3	126.8143	0.251	3	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|O<2>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|O<2>,2|H<1>,4|C<3>}	126.7110	0.000	1	126.8143	0.251	3	126.8143	0.251	3	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|S<2>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,5a]C[5,6a])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|S<2>,2|H<1>,4|C<3>}	127.3590	0.000	1	126.8143	0.251	3	126.8143	0.251	3	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]2)(C[6a]C[6a]2)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){3|H<1>,7|C<3>}	C[6a](B[5]C[5,6a]2)(C[6a]C[6a]2)(C[6a]C[6a]H){2|H<1>,7|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	128.0143	3.420	6	128.0143	11.698	6	128.0204	5.347	20	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]2)(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,6|C<3>}	C[6a](B[5]C[5,6a]2)(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	128.0230	1.821	14	128.0230	3.315	14	128.0204	5.347	20	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	C[6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]B[5])(B[5]C[5,6a]2)(C[6a]C[6a]F)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){1|B<4>,3|F<1>,6|C<3>}	C[6a](C[6a]C[6a]B[5])(B[5]C[5,6a]2)(C[6a]C[6a]F){1|O<3>,2|F<1>,7|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F){2|F<1>,5|C<3>}	128.7780	1.747	2	128.7780	3.050	2	128.7780	3.050	2	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]F)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]F)	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|F<1>,7|C<3>}	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]F)2{2|F<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]F){2|F<1>,5|C<3>}	124.9395	5.802	2	124.9395	33.661	2	124.9395	33.661	2	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){2|C<4>,2|H<1>,5|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,3|H<1>,4|C<3>}	129.8820	0.000	1	129.8820	0.000	1	123.4433	7.341	8	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){2|C<4>,3|C<3>,3|H<1>}	122.4357	0.858	6	122.5234	0.668	7	123.4433	7.341	8	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(N[5]C[5]C){1|N<3>,4|C<3>,4|H<1>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	123.0500	0.000	1	122.5234	0.668	7	123.4433	7.341	8	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){1|C<4>,3|H<1>,4|C<3>}	128.4040	0.000	1	128.8810	0.234	4	128.8810	0.234	4	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	C[6a](B[5]C[5,6a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]N[5])(C[6a]C[6a]H){3|H<1>,5|C<3>}	129.0400	0.446	3	128.8810	0.234	4	128.8810	0.234	4	126.9578	8.998	39	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:4:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:B[5]-4:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H)	C[6a](B[5]C[5,6a]B[5])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]B[5])(C[6a]C[6a]C)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H){2|H<1>,2|N<3>,3|C<4>,4|C<3>}	C[6a](B[5]C[5,6a]B[5])(C[6a]C[6a]C)2{1|C<4>,3|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]B[5])(C[6a]C[6a]C){4|C<3>,5|H<1>}	123.4100	0.000	1	123.4100	0.000	1	123.4100	0.000	1	123.2687	4.908	3	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:4:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:B[5]-4:	C[6a,6a]-3:C[6a,6a]-3:B[5]-3:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(B[5]C[5,6a]B[5])	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]B[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP){1|H<1>,7|C<3>}	C[6a](C[6a,6a]C[6a,6a]C[6a])2(B[5]C[5,6a]B[5]){2|H<1>,2|P<4>,8|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]B[5])(C[6a]C[6a]H){1|H<1>,2|P<4>,5|C<3>}	120.9860	0.000	1	120.9860	0.000	1	120.9860	0.000	1	123.2687	4.908	3	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:3:4:	3:3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH)	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]C)2	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]C)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(C[5]C[5]CH){2|H<1>,3|C<4>,4|C<3>}	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]C)2{1|C<4>,3|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]C){4|C<3>,5|H<1>}	125.4100	0.000	1	125.4100	0.000	1	125.4100	0.000	1	123.2687	4.908	3	126.7486	9.404	43	127.1240	9.269	50
2	643	727	0:SP2_SP2_SP2	B[5]	C[6a]	C[5,6a]	3:4:3:	3:3:3:	3:3:3:	C[5,6a]-3:P[5]-4:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]P[5])(C[6a]C[6a]C)2	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]P[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){1|H<1>,2|C<4>,5|C<3>}	C[6a](B[5]C[5,6a]P[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,4|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]P[5])(C[6a]C[6a]H){1|H<1>,2|C<4>,5|C<3>}	129.0280	0.000	1	129.0280	0.000	1	129.0280	0.000	1	129.0280	0.000	1	126.7486	9.404	43	127.1240	9.269	50
2	643	786	0:SP2_SP2_SP3	B[5]	C[6a]	B[5]	3:3:4:	3:3:3:	3:3:4:4:	C[5,6a]-3:C[6a]-3:B[5]-4:	C[6a,6a]-3:C[6a,6a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:P-4:P-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(B[5]C[5,6a]B[5])	B[5](C[5,6a]C[5,6a,6a]C[6a,6a])(B[5]C[5,6a]C[6a])(PC3)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP){1|H<1>,7|C<3>}	C[6a](C[6a,6a]C[6a,6a]C[6a])2(B[5]C[5,6a]B[5]){2|H<1>,2|P<4>,8|C<3>}	B[5](C[5,6a]C[5,6a,6a]C[6a,6a])(B[5]C[5,6a]C[6a])(PC3)2{6|C<3>}	135.3960	0.000	1	135.3960	0.000	1	135.3960	0.000	1	135.3960	0.000	1	134.3153	0.877	3	134.3153	0.877	3
2	643	786	0:SP2_SP2_SP3	B[5]	C[6a]	B[5]	3:3:4:	3:3:3:	3:4:3:1:	C[5,6a]-3:C[6a]-3:B[5]-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-4:C[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H)	C[6a](B[5]C[5,6a]B[5])(C[6a]C[6a]C)2	B[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[5]N[5]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H){2|H<1>,2|N<3>,3|C<4>,4|C<3>}	C[6a](B[5]C[5,6a]B[5])(C[6a]C[6a]C)2{1|C<4>,3|H<1>,4|C<3>}	B[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[5]N[5]2)(H){2|C<4>,6|C<3>}	133.7390	0.000	1	133.7390	0.000	1	133.7390	0.000	1	133.7390	0.000	1	134.3153	0.877	3	134.3153	0.877	3
2	643	786	0:SP2_SP2_SP3	B[5]	C[6a]	B[5]	4:3:4:	3:3:3:	3:3:4:1:	B[5]-4:C[6a]-3:C[5]-4:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:N[5]-4:I-1:	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH)	C[6a](B[5]B[5]C[5])(C[6a]C[6a]C)2	B[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]CC)(I)	B[5](B[5]C[6a]N[5]I)(C[6a]C[6a]2)(C[5]C[5]HH){2|H<1>,4|C<3>,4|C<4>}	C[6a](B[5]B[5]C[5])(C[6a]C[6a]C)2{1|C<4>,1|I<1>,1|N<4>,2|C<3>,4|H<1>}	B[5](B[5]C[6a]C[5])(C[6a]C[6a]2)(N[5]C[5]CC)(I){2|C<4>,4|C<3>,4|H<1>}	133.8110	0.000	1	133.8110	0.000	1	133.8110	0.000	1	133.8110	0.000	1	134.3153	0.877	3	134.3153	0.877	3
2	643	813	0:SP2_SP2_SP2	B[5]	C[6a]	N[5,5a]	3:3:3:	3:3:3:	3:3:3:	N[5,5a]-3:C[6a]-3:N[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(C[6a]C[6a]2)(N[5]C[5]C){1|C<4>,4|C<3>,4|H<1>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{2|C<4>,2|H<1>,3|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){2|C<3>,2|C<4>,3|H<1>}	120.6970	0.000	1	120.6970	0.000	1	120.6970	0.000	1	124.4957	10.825	3	124.4957	10.825	3	125.2875	9.724	4
2	643	813	0:SP2_SP2_SP2	B[5]	C[6a]	N[5,5a]	3:3:3:	3:3:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){1|C<4>,3|C<3>,3|H<1>}	126.3470	0.000	1	126.3950	0.005	2	126.3950	0.005	2	124.4957	10.825	3	124.4957	10.825	3	125.2875	9.724	4
2	643	813	0:SP2_SP2_SP2	B[5]	C[6a]	N[5,5a]	3:3:3:	3:3:3:	3:3:3:	N[5,5a]-3:N[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H)	B[5](N[5,5a]C[5,5a]C[5a])(N[5]C[6a]C[5])(C[6a]C[6a]2){4|H<1>,7|C<3>}	C[6a](B[5]N[5,5a]N[5])(C[6a]C[6a]H)2{1|C<4>,2|H<1>,4|C<3>}	N[5,5a](C[5,5a]C[5a]C[5])(B[5]C[6a]N[5])(C[5a]C[5a]H){3|H<1>,4|C<3>}	126.4430	0.000	1	126.3950	0.005	2	126.3950	0.005	2	124.4957	10.825	3	124.4957	10.825	3	125.2875	9.724	4
2	643	813	0:SP2_SP2_SP2	B[5]	C[6a]	N[5,6a]	3:3:3:	3:3:3:	3:3:3:	N[5,6a]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]N[5,6a]C[5])(C[6a]C[6a]H)2	N[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[5a,6a]C)(B[5]C[6a]C[5])	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[6a](B[5]N[5,6a]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>}	N[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[5a,6a]C)(B[5]C[6a]C[5]){1|C<4>,1|N<3>,5|C<3>}	127.6630	0.000	1	127.6630	0.000	1	127.6630	0.000	1	127.6630	0.000	1	127.6630	0.000	1	125.2875	9.724	4
2	643	813	0:SP2_SP2_SP3	B[5]	C[6a]	N[5,5a]	3:4:3:	3:3:3:	3:3:3:	N[5,5a]-3:C[5,6]-4:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	N[5,5a,6]-3:B[5]-3:C[5a]-3:	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)	C[6a](B[5]N[5,5a]C[5,6])(C[6a]C[6a]2)2	N[5,5a](N[5,5a,6]C[5,6,6]B[5a,6])(B[5]C[5,6]C[6a])(C[5a]O[5a]O)	B[5](N[5,5a]N[5,5a,6]C[5a])(C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2){1|B<3>,1|O<1>,1|O<2>,2|C<4>,6|C<3>}	C[6a](B[5]N[5,5a]C[5,6])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,3|H<1>,7|C<3>}	N[5,5a](N[5,5a,6]C[5,6,6]B[5a,6])(B[5]C[5,6]C[6a])(C[5a]O[5a]O){1|C<4>,1|H<1>,5|C<3>}	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:2:	3:3:3:	3:3:3:	C[5]-3:C[6a]-3:O[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	N[5]-3:B[5]-3:C[6a]-3:	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5])	C[6a](B[5]C[5]O[5])(C[6a]C[6a]C)2	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2)	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5]){1|O<2>,3|C<4>,5|C<3>}	C[6a](B[5]C[5]O[5])(C[6a]C[6a]C)2{1|B<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2){1|O<2>,3|C<4>,6|C<3>}	126.2250	0.000	1	126.2250	0.000	1	126.2250	0.000	1	126.2250	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]F)2	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|F<1>,7|C<3>}	C[6a](B[5]C[5,6a]C[5])(C[6a]C[6a]F)2{2|F<1>,5|C<3>}	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|F<1>,8|C<3>}	125.1205	3.146	2	125.1205	9.897	2	125.1205	9.897	2	127.6550	6.864	10	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:C[6a]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){2|H<1>,5|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>}	127.5827	1.193	6	127.5827	1.422	6	127.5827	1.422	6	127.6550	6.864	10	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	N[5,6]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]N[5,6]C[5])(C[6a]C[6a]H)2	C[5](B[5]N[5,6]C[6a])(C[5]C[5,6]C[6a])(C[6a]C[6a]2)	B[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|H<1>,7|C<3>}	C[6a](B[5]N[5,6]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>}	C[5](B[5]N[5,6]C[6a])(C[5]C[5,6]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	133.3000	0.000	1	133.3000	0.000	1	133.3000	0.000	1	127.6550	6.864	10	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	N[5,6a]-3:C[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[6a](B[5]N[5,6a]C[5])(C[6a]C[6a]H)2	C[5](B[5]N[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2)	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	C[6a](B[5]N[5,6a]C[5])(C[6a]C[6a]H)2{2|H<1>,5|C<3>}	C[5](B[5]N[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	127.5130	0.000	1	127.5130	0.000	1	127.5130	0.000	1	127.6550	6.864	10	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6a]-3:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:Si-4:	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2{2|C<4>,4|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){2|Si<4>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3){1|Si<4>,5|C<3>}	126.6730	2.404	2	126.6730	5.780	2	126.7390	2.437	4	127.3804	1.812	14	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6a]-3:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:Si-4:	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(SiC3)	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2{1|B<3>,2|H<1>,3|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){2|Si<4>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(SiC3){1|Si<4>,3|C<3>}	127.6750	0.000	1	127.6750	0.000	1	126.7390	2.437	4	127.3804	1.812	14	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6a]-3:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:Si-4:	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2{1|B<3>,2|H<1>,3|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){2|Si<4>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3){1|Si<4>,1|B<3>,4|C<3>}	125.9350	0.000	1	125.9350	0.000	1	126.7390	2.437	4	127.3804	1.812	14	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:4:	C[6a]-3:C[5]-3:N[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:B[5]-3:C-4:	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	C[5](B[5]C[6a]N[5])2(CH3)	B[5](C[6a]C[6a]2)(C[5]B[5]C)(N[5]N[5]C){1|C<4>,2|H<1>,3|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|B<3>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[5](B[5]C[6a]N[5])2(CH3){2|C<4>,4|C<3>}	126.9482	0.810	6	126.9482	0.656	6	126.9482	0.656	6	127.3804	1.812	14	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:4:	N[5]-3:C[6a]-3:C[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:B[5]-3:C-4:	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C)	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2	C[5](B[5]C[6a]N[5])2(CH3)	B[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(C[5]B[5]C){2|H<1>,6|C<3>}	C[6a](B[5]C[5]N[5])(C[6a]C[6a]H)2{1|B<3>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](B[5]C[6a]N[5])2(CH3){6|C<3>}	128.6700	1.087	4	128.6700	1.181	4	128.6700	1.181	4	127.3804	1.812	14	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:3:4:	3:3:3:	3:3:3:	C[5]-3:C[6a]-3:C[5]-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH)	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(C[6a]C[6a]2)	B[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(C[5]N[5]HH){3|C<4>,5|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,3|C<3>,4|H<1>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(C[6a]C[6a]2){1|C<4>,4|H<1>,6|C<3>}	132.1140	0.000	1	132.1140	0.000	1	132.1140	0.000	1	132.1140	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:4:3:	3:3:3:	3:3:1:	C[6a]-3:C[5]-4:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:H-1:	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H)	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(H)	B[5](C[6a]C[6a]2)(C[5]N[5]CH)(C[5]C[5]H){2|C<4>,4|C<3>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,3|C<3>,4|H<1>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]N[5])(H){1|H<1>,6|C<3>}	132.2180	0.000	1	132.2180	0.000	1	132.2180	0.000	1	132.2180	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	3:4:3:	3:3:3:	3:3:3:	C[6a]-3:C[5]-4:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:P-3:	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P)	C[6a](C[6a]C[6a]C)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]N[5]C)(PC[6a]2)	B[5](C[6a]C[6a]2)(C[5]N[5]HH)(C[5]C[5]P){3|C<3>,3|C<4>}	C[6a](C[6a]C[6a]C)2(B[5]C[5]2){1|N<3>,1|P<3>,2|C<3>,4|H<1>}	C[5](B[5]C[6a]C[5])(C[5]N[5]C)(PC[6a]2){2|H<1>,3|C<3>}	135.1940	0.000	1	135.1940	0.000	1	135.1940	0.000	1	135.1940	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	4:3:3:	3:3:3:	3:3:2:	C[5]-4:C[6a]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:C-2:	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C)	C[6a](C[6a]C[6a]H)2(B[5]C[5]2)	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(CO)	B[5](C[5]C[5]Si2)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>}	C[6a](C[6a]C[6a]H)2(B[5]C[5]2){2|Si<4>,1|C<2>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(CO){2|Si<4>,3|C<3>}	120.6500	0.000	1	120.6500	0.000	1	120.6500	0.000	1	120.6500	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	818	0:SP2_SP2_SP2	B[5]	C[6a]	C[5]	4:3:3:	3:3:3:	3:3:4:	C[5,5,6]-4:C[6a]-3:C[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-3:C-4:	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C)	C[6a](B[5]C[5,5,6]C[5])(C[6a]C[6a]H)2	C[5](B[5]C[5,5,6]C[6a])(C[5]C[5,5,6]C)(CCHH)	B[5](C[5,5,6]C[5,5,6]2C)(C[6a]C[6a]2)(C[5]C[5]C){1|B<3>,2|H<1>,3|C<3>,4|C<4>}	C[6a](B[5]C[5,5,6]C[5])(C[6a]C[6a]H)2{2|C<3>,2|H<1>,4|C<4>}	C[5](B[5]C[5,5,6]C[6a])(C[5]C[5,5,6]C)(CCHH){2|C<3>,4|C<4>}	124.8320	0.000	1	124.8320	0.000	1	124.8320	0.000	1	124.8320	0.000	1	127.7036	8.377	30	127.7036	8.377	30
2	643	955	0:SP2_SP2_SP3	B[5]	C[6a]	P[5]	3:4:3:	3:3:3:	3:3:4:4:	C[5,6a]-3:P[5]-4:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2)	C[6a](B[5]C[5,6a]P[5])(C[6a]C[6a]C)2	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6a])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){1|H<1>,2|C<4>,5|C<3>}	C[6a](B[5]C[5,6a]P[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,4|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6a])(CCCH)2{1|H<1>,5|C<3>}	129.0210	0.000	1	129.0210	0.000	1	129.0210	0.000	1	129.0210	0.000	1	122.1004	15.381	5	122.1004	15.381	5
2	643	955	0:SP2_SP2_SP3	B[5]	C[6a]	P[5]	4:3:3:	3:3:3:	3:3:3:4:	P[5]-4:B[5]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2)	C[6a](B[5]B[5]P[5])(C[6a]C[6a]C)2	P[5](B[5]C[6a]B[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	B[5](P[5]C[6a]2C[5])(B[5]C[6a]P[5])(C[6a]C[6a]2){10|C<3>,2|C<4>,2|H<1>}	C[6a](B[5]B[5]P[5])(C[6a]C[6a]C)2{1|C<4>,1|P<4>,2|H<1>,4|C<3>}	P[5](B[5]C[6a]B[5])(C[6a]C[6a]2)2(C[5]P[5]HH){4|H<1>,9|C<3>}	120.3702	0.743	4	120.3702	0.552	4	120.3702	0.552	4	120.3702	0.552	4	122.1004	15.381	5	122.1004	15.381	5
2	643	960	0:SP2_SP2_SP2	B[5]	C[6a]	N[5]	4:3:2:	3:3:3:	3:3:	C[5,6]-4:C[6a]-3:N[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	N[5,6]-3:B[5]-3:	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6])	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])	B[5](C[5,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(N[5]N[5,6]){1|B<3>,2|C<4>,6|C<3>}	C[6a](B[5]C[5,6]N[5])(C[6a]C[6a]2)2{1|C<4>,1|N<3>,3|H<1>,6|C<3>}	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a]){1|C<4>,1|H<1>,6|C<3>}	122.9470	0.000	1	122.9470	0.000	1	122.9470	0.000	1	122.9470	0.000	1	122.9470	0.000	1	122.9470	0.000	1
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	127.5620	0.000	1	127.5620	0.000	1	123.1695	11.317	4	123.1695	11.317	4	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	119.3660	0.000	1	119.3660	0.000	1	123.1695	11.317	4	123.1695	11.317	4	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,3|C<4>,3|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	122.9680	0.000	1	122.9680	0.000	1	123.1695	11.317	4	123.1695	11.317	4	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,3|C<4>,3|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	122.7820	0.000	1	122.7820	0.000	1	123.1695	11.317	4	123.1695	11.317	4	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:2:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:N[6a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]N[6a])(O[5]C[5])2	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]N[6a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(B[5]O[5]2){2|C<3>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	123.0250	2.722	2	123.0250	7.411	2	123.0250	7.411	2	123.0250	7.411	2	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[5,6a]-3:C[5,6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[5,6a]2)(O[5]C[5])2	C[6a](C[5,6a]C[5,6a]Se[5])(C[5,6a]C[5,6a]C[5])(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5,6a]2)(O[5]C[5])2{1|Se<2>,3|C<3>,4|C<4>}	C[6a](C[5,6a]C[5,6a]Se[5])(C[5,6a]C[5,6a]C[5])(B[5]O[5]2){1|Se<2>,1|H<1>,2|C<4>,4|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	124.0390	1.177	2	124.0390	1.384	2	124.0390	1.384	2	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[5a,6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[5a,6a]2)(O[5]C[5])2	C[6a](C[5a,6a]C[5a,6a]C[5a])(C[5a,6a]C[5a,6a]S[5a])(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5a,6a]2)(O[5]C[5])2{1|S<2>,3|C<3>,4|C<4>}	C[6a](C[5a,6a]C[5a,6a]C[5a])(C[5a,6a]C[5a,6a]S[5a])(B[5]O[5]2){1|H<1>,1|S<2>,2|C<4>,4|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.7182	0.927	4	123.7182	0.859	4	123.7182	0.859	4	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2	C[6a](C[5a,6a]C[5a,6a]2)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[5a,6a]C[5a,6a]2)(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,1|S<2>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.6255	3.242	2	123.6255	10.511	2	123.3562	4.641	6	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2	C[6a](C[5a,6a]C[5a,6a]C[5a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[5a,6a]C[5a,6a]C[5a])(C[6a]C[6a]H)(B[5]O[5]2){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2215	2.039	4	123.2215	4.158	4	123.3562	4.641	6	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2	C[6a](C[6,6a]C[6,6a,6a]C[6])(C[6a]C[6a,6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6,6a]C[6,6a,6a]C[6])(C[6a]C[6a,6a]H)(B[5]O[5]2){1|N<3>,1|O<1>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.4292	1.095	4	122.4292	1.198	4	122.5335	0.963	6	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2	C[6a](C[6,6a]C[6,6a]C[6])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6,6a]C[6,6a]C[6])(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|O<1>,2|C<4>,3|O<2>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.7420	1.044	2	122.7420	1.089	2	122.5335	0.963	6	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a,6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a,6a]H)(B[5]O[5]2){1|H<1>,2|C<4>,4|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.8185	3.915	4	123.8185	15.326	4	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2){2|C<4>,2|H<1>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	124.1440	3.978	2	124.1440	15.826	2	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6565	1.709	2	122.6565	2.921	2	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]B[5])(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|B<3>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]B[5])(B[5]O[5]2){1|H<1>,2|C<4>,2|O<2>,4|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1290	0.987	8	123.1290	0.974	8	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]H)(B[5]O[5]2){1|H<1>,2|C<4>,4|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3340	3.472	4	123.3340	12.058	4	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2){1|Br<1>,1|H<1>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.3205	0.050	2	122.3205	0.003	2	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O[6a])(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|O<2>,3|C<3>,4|C<4>}	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O[6a])(B[5]O[5]2){1|H<1>,2|C<4>,5|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0355	1.682	4	123.0355	2.830	4	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	C[6a](C[6a,6a]C[6a,6a]N[6a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6a](C[6a,6a]C[6a,6a]N[6a])(C[6a]C[6a]H)(B[5]O[5]2){1|B<3>,2|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3610	3.159	2	123.3610	9.982	2	123.2410	4.884	28	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[5,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[5,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4995	0.161	2	123.4995	0.026	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[5a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[5a,6a]C[6a])(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.5315	1.636	2	123.5315	2.675	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4300	0.291	6	123.4300	0.085	6	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[5a,6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[5a,6a]H)2(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3655	2.942	2	123.3655	8.657	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]C)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]C)(B[5]O[5]2){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4675	2.862	2	123.4675	8.189	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0135	2.712	2	123.1965	1.972	18	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|S<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0990	1.473	8	123.1965	1.972	18	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3397	1.236	8	123.1965	1.972	18	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a,6a]Br)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|Br<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a,6a]Br)2(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9785	0.235	2	122.9785	0.055	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(B[5]O[5]2){1|H<1>,2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1135	1.809	2	123.1135	3.274	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a,6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a,6a]H)2(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1684	1.733	14	123.1684	3.003	14	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(B[5]O[5]2){2|Br<1>,2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0927	4.819	4	123.1910	10.619	8	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(B[5]O[5]2){2|C<4>,2|H<1>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2892	1.236	4	123.1910	10.619	8	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]Bi)(C[6a]C[6a]F)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Bi<5>,1|F<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]Bi)(C[6a]C[6a]F)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.8947	1.069	6	122.8947	1.143	6	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Br<1>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.8955	4.393	2	123.8955	19.301	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<2>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|B<3>,1|C<2>,1|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.5770	1.198	2	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<2>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2015	4.484	2	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<2>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3895	3.364	2	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.9330	4.588	4	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9928	1.154	4	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3032	2.584	30	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4278	2.278	4	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3072	3.289	4	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4799	2.521	8	123.3319	6.603	60	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,6|C<4>}	C[6a](C[6a]C[6a]C)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1600	0.000	1	123.1600	0.000	1	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]Cl)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Cl<1>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]Cl)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.8425	5.426	2	123.8425	29.437	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|F<1>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|F<1>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9062	4.384	4	123.0099	11.468	10	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|F<1>,1|H<1>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0790	3.016	6	123.0099	11.468	10	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2){1|Br<1>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.4573	1.421	4	123.3460	3.730	20	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2435	1.562	10	123.3460	3.730	20	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1255	1.054	2	123.3460	3.730	20	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.6012	3.707	4	123.3460	3.730	20	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|O<2>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(B[5]O[5]2){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.8270	2.582	4	122.8270	6.667	4	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|P<4>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2930	1.007	2	123.2930	1.014	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<3>,1|N<2>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(B[5]O[5]2){1|Cl<1>,1|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.7410	0.400	4	122.7410	0.160	4	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]O)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<3>,1|H<1>,1|N<2>,1|O<2>,4|C<4>}	C[6a](C[6a]C[6a]H)(C[6a]N[6a]O)(B[5]O[5]2){1|C<3>,1|N<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6810	3.267	2	122.6810	10.672	2	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|B<3>,1|C<2>,1|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.7280	0.098	2	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.8083	0.613	3	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|B<3>,1|C<3>,3|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.7018	0.597	4	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|F<1>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9695	1.466	2	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6885	1.323	8	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2498	1.042	16	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0800	0.300	2	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.1684	0.804	71	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|S<2>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0620	0.000	1	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|H<1>,2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9982	0.928	4	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6683	0.673	4	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0340	0.734	2	123.0844	0.732	119	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]HH)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,6|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>}	122.9638	0.527	6	122.9638	0.277	6	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]N[6])(C[6a]C[6a]O)(B[5]O[5]2)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|N<3>,1|O<2>,2|C<3>,4|C<4>}	C[6a](C[6a]C[6a]N[6])(C[6a]C[6a]O)(B[5]O[5]2){1|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0803	1.836	4	123.0803	3.370	4	123.1741	3.101	300	123.1828	3.178	346	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2	C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2{1|C<4>,1|N<2>,3|C<3>,3|H<1>}	C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|N<2>,1|S<2>,2|C<4>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	120.1370	1.181	2	120.1370	1.394	2	123.0155	11.991	4	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2	C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(B[5]O[5]2)	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2{1|C<4>,1|N<2>,3|C<3>,3|H<1>}	C[6a](C[5a,6a]C[5a,6a]N[5a])(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,1|H<1>,1|N<2>,1|S<2>,2|C<4>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	125.8940	1.198	2	125.8940	1.435	2	123.0155	11.991	4	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(B[5]O[5]2)	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	123.9820	3.614	4	123.9820	13.058	4	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(B[5]O[5]2)	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	121.9490	3.975	4	121.9490	15.803	4	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,5]C[5,5]C[5,6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,2|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,5]C[5,5]C[5,6]H)(B[5]C[6a]O[5]){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	123.3713	0.729	7	123.3713	0.532	7	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,3|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	122.7198	0.194	4	122.7198	0.038	4	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{2|C<3>,2|N<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5]){1|H<1>,1|N<3>,4|C<3>}	123.4710	0.499	2	123.4710	0.249	2	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,5]C[5,5]O[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,2|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,5]C[5,5]O[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>}	123.4497	1.539	7	123.4497	2.369	7	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,3|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	122.9440	0.099	4	122.9440	0.010	4	123.1584	3.710	32	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>,2|O<2>}	122.1530	0.000	1	122.0303	0.087	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|C<4>,1|N<3>,1|S<2>,2|C<3>,2|H<1>}	121.6930	0.000	1	122.0303	0.087	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	122.2450	0.000	1	122.0303	0.087	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|C<4>,3|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){3|H<1>,4|C<3>}	124.6710	0.000	1	124.3810	0.090	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	124.4010	0.000	1	124.3810	0.090	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	124.0710	0.000	1	124.3810	0.090	3	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[5,6]O[6]C)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[5,6]O[6]C)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>}	124.4920	0.000	1	124.4920	0.000	1	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	C[6a](C[6a]C[6a]H)2(B[5]O[5]2)	O[5](C[5,6]C[6,6a]C[5,6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|C<4>,3|C<3>,4|H<1>}	C[6a](C[6a]C[6a]H)2(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5,6]C[6,6a]C[5,6]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	121.8780	0.000	1	121.8780	0.000	1	123.2005	1.723	8	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5])2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2)	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<4>,3|H<1>,4|C<3>}	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(B[5]O[5]2){1|C<3>,2|C<4>,2|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5]){1|H<1>,5|C<3>}	123.3800	3.322	2	123.3800	11.036	2	123.3800	11.036	2	123.1629	3.873	46	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:3:2:	3:3:3:	4:3:	C[5]-3:C[6a]-3:O[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	B[4,5]-4:B[5]-3:	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5])	C[6a](B[5]C[5]O[5])(C[6a]C[6a]C)2	O[5](B[4,5]C[4]N[5]O[4])(B[5]C[6a]C[5])	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5]){1|O<2>,3|C<4>,5|C<3>}	C[6a](B[5]C[5]O[5])(C[6a]C[6a]C)2{1|B<4>,1|N<3>,2|C<3>,2|H<1>}	O[5](B[4,5]C[4]N[5]O[4])(B[5]C[6a]C[5]){3|C<4>,4|C<3>}	126.3630	0.000	1	126.3630	0.000	1	126.3630	0.000	1	126.3630	0.000	1	123.1820	3.327	400	123.1820	3.327	400
2	643	976	0:SP2_SP2_SP2	B[5]	C[6a]	O[5]	3:4:2:	3:3:3:	3:4:	C[6a]-3:C[5]-4:O[5]-2:	B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5])	C[6a](B[5]C[5]O[5])(C[6a]C[6a]F)2	O[5](B[5]C[6a]C[5])(C[5]C[5]BH)	B[5](C[6a]C[6a]2)(C[5]C[5]HH)(O[5]C[5]){1|B<4>,1|P<4>,2|C<3>,2|F<1>,2|H<1>}	C[6a](B[5]C[5]O[5])(C[6a]C[6a]F)2{1|C<3>,2|C<4>,2|F<1>,2|H<1>}	O[5](B[5]C[6a]C[5])(C[5]C[5]BH){1|P<4>,2|C<3>,3|H<1>}	120.9550	0.000	1	120.9550	0.000	1	120.9550	0.000	1	120.9550	0.000	1	123.1820	3.327	400	123.1820	3.327	400
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,5a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,5a]-3:C[6a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	C[5,5a]-3:B[5]-3:C[5a]-3:	B[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2)	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H)	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H)	B[5](C[5,5a]C[5,5a]C[5a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,2|S<2>,4|C<3>}	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|Si<4>,1|S<2>,3|C<3>}	C[5,5a](C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])(C[5a]C[5a]H){1|Si<4>,1|S<2>,3|C<3>}	102.5320	0.000	1	102.5320	0.000	1	102.5320	0.000	1	102.6790	0.043	2	102.6790	0.043	2	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,5a]	C[5,5a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,5a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])2(C[6a]C[6a]2)	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a])	B[5](C[5,5a]C[5a,6a]C[5,5a])2(C[6a]C[6a]2){2|C<4>,2|S<2>,6|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a]){1|H<1>,1|S<2>,5|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,5a]S[5a])(B[5]C[5,5a]C[6a]){1|H<1>,1|S<2>,5|C<3>}	102.8260	0.000	1	102.8260	0.000	1	102.8260	0.000	1	102.6790	0.043	2	102.6790	0.043	2	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,5a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]N[5a])(B[5]C[5,6a]C[6a])	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|N<3>,2|C<4>,6|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]N[5a])(B[5]C[5,6a]C[6a]){1|C<4>,1|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|N<3>,2|H<1>,4|C<3>}	102.9160	0.000	1	102.9160	0.000	1	102.6000	0.075	3	102.6000	0.075	3	102.6000	0.075	3	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,5a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]O[5a])(B[5]C[5,6a]C[6a])	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|O<2>,2|C<4>,6|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]O[5a])(B[5]C[5,6a]C[6a]){1|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|O<2>,2|H<1>,4|C<3>}	102.4400	0.000	1	102.4400	0.000	1	102.6000	0.075	3	102.6000	0.075	3	102.6000	0.075	3	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,5a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,5a]-3:C[5,6a]-3:C[6a]-3:	C[5a,6a]-3:C[5,5a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]S[5a])(B[5]C[5,6a]C[6a])	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H)	B[5](C[5,5a]C[5a,6a]C[5,5a])(C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2){1|H<1>,1|S<2>,2|C<4>,6|C<3>}	C[5,5a](C[5a,6a]C[5a,6a]C[6a])(C[5,5a]C[5,6a]S[5a])(B[5]C[5,6a]C[6a]){1|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[5,5a]C[6a])(B[5]C[5,5a]C[6a])(C[6a]C[6a]H){1|S<2>,2|H<1>,4|C<3>}	102.4440	0.000	1	102.4440	0.000	1	102.6000	0.075	3	102.6000	0.075	3	102.6000	0.075	3	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:1:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:Br-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(Br)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(Br){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H){2|H<1>,3|C<3>}	105.8950	0.680	3	105.8950	0.463	3	105.8950	0.463	3	105.9093	0.309	4	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:1:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:Cl-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(Cl)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(Cl){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H){2|H<1>,3|C<3>}	105.9520	0.000	1	105.9520	0.000	1	105.9520	0.000	1	105.9093	0.309	4	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:2:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:O-2:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(OC)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(OC){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H){2|H<1>,3|C<3>}	104.6657	0.166	3	104.6657	0.028	3	104.6657	0.028	3	104.6657	0.028	3	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(CCH)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(CCH){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>}	103.7050	0.000	1	103.7050	0.000	1	103.7050	0.000	1	103.5991	0.617	13	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){1|B<4>,3|F<1>,6|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F){2|F<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]F){2|F<1>,5|C<3>}	102.2070	0.000	1	102.2070	0.000	1	103.6832	0.626	11	103.5991	0.617	13	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){2|C<4>,2|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	103.8489	0.795	7	103.8308	0.429	10	103.6832	0.626	11	103.5991	0.617	13	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(C[6a]C[6a]2){3|H<1>,7|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[6a])(C[6a]C[6a]H){2|H<1>,5|C<3>}	103.7887	0.166	3	103.8308	0.429	10	103.6832	0.626	11	103.5991	0.617	13	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:N-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(NSi2)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(NSi2){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H){2|H<1>,3|C<3>}	102.5680	0.000	1	102.5680	0.000	1	102.5680	0.000	1	103.5991	0.617	13	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:4:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(CCHH)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(CCHH){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){1|C<4>,1|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){1|C<4>,1|H<1>,3|C<3>}	104.2130	1.755	2	104.2130	3.080	2	104.2130	3.080	2	103.8293	1.982	3	104.1700	1.353	23	103.8953	1.470	28
2	727	727	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5,6a]	3:3:4:	3:3:3:	3:3:3:	C[5,6a]-3:C[5,6a]-3:C[5]-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(C[5]C[5]2Fe)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[5])(C[6a]C[6a]H)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a]C[6a])2(C[5]C[5]2Fe){2|C<4>,4|C<3>,4|H<1>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[5])(C[6a]C[6a]H){1|Fe<10>,2|C<4>,2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C[5])(C[6a]C[6a]H){1|Fe<10>,2|C<4>,2|H<1>,3|C<3>}	103.0620	0.000	1	103.0620	0.000	1	103.0620	0.000	1	103.8293	1.982	3	104.1700	1.353	23	103.8953	1.470	28
2	727	786	5:SP2_SP2_SP3	B[5]	C[5,6a]	B[5]	3:3:4:	3:3:3:	3:3:4:4:	C[5,6a]-3:C[6a]-3:B[5]-4:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:P-4:P-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]B[5])(C[6a]C[6a]H)	B[5](C[5,6a]C[5,6a,6a]C[6a,6a])(B[5]C[5,6a]C[6a])(PC3)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(C[6a]C[6a,6a]2)(B[5]C[5,6a]PP){1|H<1>,7|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]B[5])(C[6a]C[6a]H){1|H<1>,2|P<4>,5|C<3>}	B[5](C[5,6a]C[5,6a,6a]C[6a,6a])(B[5]C[5,6a]C[6a])(PC3)2{6|C<3>}	103.5460	0.000	1	103.5460	0.000	1	103.5460	0.000	1	103.5460	0.000	1	103.1615	0.296	2	103.1615	0.296	2
2	727	786	5:SP2_SP2_SP3	B[5]	C[5,6a]	B[5]	3:3:4:	3:3:3:	3:4:3:1:	C[5,6a]-3:C[6a]-3:B[5]-4:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C[5]-4:C[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]B[5])(C[6a]C[6a]C)	B[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[5]N[5]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(B[5]C[5]2H){2|H<1>,2|N<3>,3|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]B[5])(C[6a]C[6a]C){4|C<3>,5|H<1>}	B[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]HH)(C[5]N[5]2)(H){2|C<4>,6|C<3>}	102.7770	0.000	1	102.7770	0.000	1	102.7770	0.000	1	102.7770	0.000	1	103.1615	0.296	2	103.1615	0.296	2
2	727	790	0:SP2_SP-NON_SP2	B[5]	C[5,6a]	Cl	3:3:1:	3:3:3:	3:	C[5,6a]-3:C[5,6a]-3:Cl-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(Cl)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H)	Cl(B[5]C[5,6a]2)	B[5](C[5,6a]C[5,6a]C[6a])2(Cl){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Cl)(C[6a]C[6a]H){2|H<1>,3|C<3>}	Cl(B[5]C[5,6a]2)	127.0015	1.029	2	127.0015	1.059	2	127.0015	1.059	2	127.0015	1.059	2	127.0015	1.059	2	127.0015	1.059	2
2	727	818	0:SP2_SP2_SP2	B[5]	C[5a]	C[5]	3:3:3:	3:2:3:	3:3:3:	C[5a]-3:C[5]-3:C[5]-3:	C[5a]-3:O[5a]-2:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5a]C[5a]O[5a])(C[5]C[6a]C[5])2	C[5a](C[5a]C[5a]H)(O[5a]C[5a])(B[5]C[5]2)	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5a]C[5a]O[5a])(C[5]C[6a]C[5])2{1|H<1>,8|C<3>}	C[5a](C[5a]C[5a]H)(O[5a]C[5a])(B[5]C[5]2){1|C<4>,1|H<1>,4|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|O<2>,2|H<1>,7|C<3>}	127.2920	6.510	2	127.2920	42.375	2	127.2920	42.375	2	127.3547	12.207	6	127.3547	12.207	6	127.3547	12.207	6
2	727	818	0:SP2_SP2_SP2	B[5]	C[5a]	C[5]	3:3:3:	3:2:3:	3:3:3:	C[5a]-3:C[5]-3:C[5]-3:	C[5a]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5a]C[5a]S[5a])(C[5]C[6a]C[5])2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]C[5]2)	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5a]C[5a]S[5a])(C[5]C[6a]C[5])2{1|H<1>,8|C<3>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]C[5]2){1|Si<4>,1|H<1>,4|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|S<2>,2|H<1>,7|C<3>}	127.3860	2.493	4	127.3860	6.217	4	127.3860	6.217	4	127.3547	12.207	6	127.3547	12.207	6	127.3547	12.207	6
2	727	818	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5]	3:3:1:	3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:Br-1:	C[5,6a]-3:C[6a]-3:B[5]-3:	C[5]-3:B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(B[5]C[5]Br)	C[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br){1|F<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(B[5]C[5]Br){2|F<1>,3|C<3>}	C[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]2){2|F<1>,6|C<3>}	105.1630	0.000	1	105.1630	0.000	1	105.1630	0.000	1	105.1630	0.000	1	103.0727	5.434	3	103.0727	5.434	3
2	727	818	5:SP2_SP2_SP2	B[5]	C[5,6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]F)	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){3|F<1>,7|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(B[5]C[6a]C[5])(C[6a]C[6a]F){2|F<1>,5|C<3>}	C[5](B[5]C[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|F<1>,8|C<3>}	102.0275	2.077	2	102.0275	4.313	2	102.0275	4.313	2	102.0275	4.313	2	103.0727	5.434	3	103.0727	5.434	3
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH)	C[5,6a](C[5,6a]B[5,5a]C[6a])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]B[5,5a]C[6a])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	127.3910	0.000	1	127.3910	0.000	1	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH)	C[5,6a](C[5,6a]B[5,6]C[6a])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]B[5,6]C[6a])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	127.3780	1.114	2	127.3780	1.242	2	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH)	C[5,6a](C[5,6a]C[6a]B[5])(C[6a]C[6a]F)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH){1|F<1>,1|O<2>,1|O<3>,2|C<3>}	C[5,6a](C[5,6a]C[6a]B[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,1|O<2>,1|O<3>,2|F<1>}	O(B[5]C[5,6a]O[5])(H)	125.9320	0.000	1	125.9320	0.000	1	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(B[5]O[5]O){1|C<3>,4|H<1>}	O(B[5]C[5,6a]O[5])(H)	129.4150	0.000	1	129.4150	0.000	1	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|C<4>,3|H<1>}	O(B[5]C[5,6a]O[5])(H)	132.5210	0.000	1	130.0547	3.617	8	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,4|H<1>}	O(B[5]C[5,6a]O[5])(H)	130.0365	1.654	6	130.0547	3.617	8	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|F<1>,1|N<2>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	127.6980	0.000	1	130.0547	3.617	8	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|Cl<1>,1|F<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O){1|Cl<1>,1|C<3>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	122.2985	2.251	2	122.8877	2.208	4	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|F<1>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,1|O<2>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	123.4770	0.412	2	122.8877	2.208	4	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]H)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|H<1>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|O<2>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	122.9090	0.000	1	122.9090	0.000	1	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:2:2:	3:3:3:	3:1:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH)	C[5,6a](C[5,6a]C[6a]Si[5])(C[6a]C[6a]F)(B[5]O[5]O)	O(B[5]C[5,6a]O[5])(H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH){1|F<1>,2|C<3>,2|C<4>}	C[5,6a](C[5,6a]C[6a]Si[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,2|C<4>,2|F<1>}	O(B[5]C[5,6a]O[5])(H)	124.2310	0.000	1	124.2310	0.000	1	127.1907	11.478	19	127.1907	11.478	19	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:3:2:	3:3:3:	3:4:	C[5,6a]-3:C[5,6a]-3:O-2:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C-4:	B[5](C[5,6a]C[5,6a]C[6a])2(OC)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H)	O(B[5]C[5,6a]2)(CC[6a]2P)	B[5](C[5,6a]C[5,6a]C[6a])2(OC){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H){2|H<1>,3|C<3>}	O(B[5]C[5,6a]2)(CC[6a]2P)	127.6610	11.093	2	127.6610	123.057	2	127.5938	40.429	6	127.5938	40.429	6	127.2874	17.062	25	127.2874	17.062	25
2	727	893	0:SP2_SP2_SP2	B[5]	C[5,6a]	O	3:3:2:	3:3:3:	3:4:	C[5,6a]-3:C[5,6a]-3:O-2:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C-4:	B[5](C[5,6a]C[5,6a]C[6a])2(OC)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H)	O(B[5]C[5,6a]2)(CH3)	B[5](C[5,6a]C[5,6a]C[6a])2(OC){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]O)(C[6a]C[6a]H){2|H<1>,3|C<3>}	O(B[5]C[5,6a]2)(CH3)	127.5602	5.134	4	127.5602	26.358	4	127.5938	40.429	6	127.5938	40.429	6	127.2874	17.062	25	127.2874	17.062	25
2	727	924	0:SP2_SP-NON_SP2	B[5]	C[5,6a]	Br	3:3:1:	3:3:3:	3:	C[5,6a]-3:C[5,6a]-3:Br-1:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])2(Br)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H)	Br(B[5]C[5,6a]2)	B[5](C[5,6a]C[5,6a]C[6a])2(Br){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]H){2|H<1>,3|C<3>}	Br(B[5]C[5,6a]2)	127.0518	1.113	6	127.0518	1.238	6	127.0518	1.238	6	127.1500	1.099	7	127.1500	1.099	7	127.1500	1.099	7
2	727	924	0:SP2_SP-NON_SP2	B[5]	C[5,6a]	Br	3:3:1:	3:3:3:	3:	C[5,6a]-3:C[5]-3:Br-1:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(B[5]C[5]Br)	Br(B[5]C[5,6a]C[5])	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br){1|F<1>,5|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(B[5]C[5]Br){2|F<1>,3|C<3>}	Br(B[5]C[5,6a]C[5])	127.7390	0.000	1	127.7390	0.000	1	127.7390	0.000	1	127.1500	1.099	7	127.1500	1.099	7	127.1500	1.099	7
2	727	930	0:SP2_SP2_SP2	B[5]	C[5,6a]	C	3:3:3:	3:3:3:	3:3:1:	C[5,6a]-3:C[5,6a]-3:C-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])2(CCH)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H)	C(B[5]C[5,6a]2)(CCH)(H)	B[5](C[5,6a]C[5,6a]C[6a])2(CCH){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]C)(C[6a]C[6a]H){2|H<1>,3|C<3>}	C(B[5]C[5,6a]2)(CCH)(H)	127.9855	1.074	2	127.9855	1.154	2	127.9855	1.154	2	127.9855	1.154	2	127.9855	1.154	2	127.9855	1.154	2
2	727	941	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:3:2:	3:3:3:	3:3:	C[5,6a]-3:N[5]-3:N-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a])	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]){1|N<3>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)	126.8780	0.000	1	126.8780	0.000	1	126.8780	0.000	1	126.8780	0.000	1	126.8780	0.000	1	126.8780	0.000	1
2	727	955	5:SP2_SP2_SP3	B[5]	C[5,6a]	P[5]	3:4:3:	3:3:3:	3:3:3:3:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a,6a]-3:C[6a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]2)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2){1|H<1>,7|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N){1|H<1>,5|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]2)2{5|H<1>,7|C<3>}	103.7300	0.000	1	103.7300	0.000	1	103.7300	0.000	1	103.7300	0.000	1	102.1273	1.794	4	102.1273	1.794	4
2	727	955	5:SP2_SP2_SP3	B[5]	C[5,6a]	P[5]	3:4:3:	3:3:3:	3:3:4:4:	C[5,6a]-3:P[5]-4:C[6a]-3:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]P[5])(C[6a]C[6a]H)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6a])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6a]C[6a]2){1|H<1>,2|C<4>,5|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6a]P[5])(C[6a]C[6a]H){1|H<1>,2|C<4>,5|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6a])(CCCH)2{1|H<1>,5|C<3>}	101.3770	0.000	1	101.3770	0.000	1	101.3770	0.000	1	102.0245	0.839	2	102.1273	1.794	4	102.1273	1.794	4
2	727	955	5:SP2_SP2_SP3	B[5]	C[5,6a]	P[5]	3:4:3:	3:3:3:	3:3:4:4:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a,6a]-3:C[6a]-3:B[5]-3:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC){1|H<1>,3|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N){1|H<1>,2|C<4>,3|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(CCCH)2{1|H<1>,3|C<3>}	102.6720	0.000	1	102.6720	0.000	1	102.6720	0.000	1	102.0245	0.839	2	102.1273	1.794	4	102.1273	1.794	4
2	727	955	5:SP2_SP2_SP3	B[5]	C[5,6a]	P[5]	3:4:4:	3:3:3:	3:3:4:4:	C[5,6a]-3:P[5]-4:C[6]-4:	C[5,6a,6a]-3:B[5]-3:C[6a]-3:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6]P[5])(C[6a]C[6a]H)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(C[6]C[6]2H){2|C<4>,3|C<3>,5|H<1>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(B[5]C[6]P[5])(C[6a]C[6a]H){2|H<1>,3|C<3>,4|C<4>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]C[6])(CCCH)2{2|C<4>,2|H<1>,3|C<3>}	100.7300	0.000	1	100.7300	0.000	1	100.7300	0.000	1	100.7300	0.000	1	102.1273	1.794	4	102.1273	1.794	4
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:3:3:	3:3:3:	3:3:1:	C[5,6a]-3:N[5]-3:N-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[6a]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(NC[6a]H){1|N<3>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	127.1600	0.000	1	127.1600	0.000	1	129.3575	2.377	4	129.3575	2.377	4	130.0390	7.695	9	130.0390	7.695	9
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:3:3:	3:3:3:	3:3:1:	C[5,6a]-3:N[5]-3:N-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[6a]-3:H-1:	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N)	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	B[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(NC[6a]H){1|N<3>,2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]N[5]N){1|N<3>,2|C<3>,3|H<1>}	N(B[5]C[5,6a]N[5])(C[6a]C[6a]2)(H)	130.0900	0.588	3	130.0900	0.346	3	129.3575	2.377	4	129.3575	2.377	4	130.0390	7.695	9	130.0390	7.695	9
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:3:3:	3:3:3:	3:4:4:	C[5,6a]-3:C[5,6a]-3:N-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:Si-4:Si-4:	B[5](C[5,6a]C[5,6a]C[6a])2(NSi2)	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H)	N(B[5]C[5,6a]2)(SiC3)2	B[5](C[5,6a]C[5,6a]C[6a])2(NSi2){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[5,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]H){2|H<1>,3|C<3>}	N(B[5]C[5,6a]2)(SiC3)2	128.7155	0.605	2	128.7155	0.366	2	128.7155	0.366	2	128.7155	0.366	2	130.0390	7.695	9	130.0390	7.695	9
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:3:3:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N)	N(B[5]C[5,6a]P[5])(C[6a]C[6a]2)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2){1|H<1>,7|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N){1|H<1>,5|C<3>}	N(B[5]C[5,6a]P[5])(C[6a]C[6a]2)2	132.7290	0.000	1	132.7290	0.000	1	132.7290	0.000	1	132.7290	0.000	1	130.0390	7.695	9	130.0390	7.695	9
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:4:4:	C[5,6a]-3:C[5,5]-4:N-3:	C[5,6a]-3:B[5]-3:C[6a]-3:	B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC)	C[5,6a](C[5,6a]N[5,5]C[6a])(B[5]C[5,5]N)(C[6a]C[6a]H)	N(B[5]C[5,6a]C[5,5])(CCHH)2	B[5](C[5,6a]C[5,6a]C[6a])(C[5,5]N[5,5]C[5]C)(NCC){1|H<1>,2|C<3>,4|C<4>}	C[5,6a](C[5,6a]N[5,5]C[6a])(B[5]C[5,5]N)(C[6a]C[6a]H){1|C<3>,1|H<1>,4|C<4>}	N(B[5]C[5,6a]C[5,5])(CCHH)2	127.0290	0.000	1	127.0290	0.000	1	127.0290	0.000	1	131.3805	37.871	2	130.0390	7.695	9	130.0390	7.695	9
2	727	956	0:SP2_SP2_SP2	B[5]	C[5,6a]	N	3:4:3:	3:3:3:	3:4:4:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC)	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N)	N(B[5]C[5,6a]P[5])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC){1|H<1>,3|C<3>}	C[5,6a](C[5,6a,6a]C[6a,6a]C[5,6a])(C[6a]C[6a]H)(B[5]P[5]N){1|H<1>,2|C<4>,3|C<3>}	N(B[5]C[5,6a]P[5])(CCCH)2	135.7320	0.000	1	135.7320	0.000	1	135.7320	0.000	1	131.3805	37.871	2	130.0390	7.695	9	130.0390	7.695	9
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a,6]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2	C[5a](C[5a,6]C[5a,6]C[6])(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2{2|C<3>,5|C<4>}	C[5a](C[5a,6]C[5a,6]C[6])(S[5a]C[5a])(B[5]O[5]2){1|B<3>,2|H<1>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	122.9622	1.418	4	122.9622	2.011	4	122.9398	2.740	6	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a,6]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2	C[5a](C[5a,6]C[5a,6]O[6])(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2{1|O<2>,2|C<3>,4|C<4>}	C[5a](C[5a,6]C[5a,6]O[6])(S[5a]C[5a])(B[5]O[5]2){1|H<1>,1|O<2>,3|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	122.8950	2.768	2	122.8950	7.660	2	122.9398	2.740	6	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:N[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]Br)(N[5a]N[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|Br<1>,1|C<3>,1|N<3>,4|C<4>}	C[5a](C[5a]C[5a]Br)(N[5a]N[5a])(B[5]O[5]2){4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	123.0850	2.669	2	123.0850	7.122	2	123.0850	7.122	2	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:O[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]O[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]H)(O[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]O[5a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	C[5a](C[5a]C[5a]H)(O[5a]C[5a])(B[5]O[5]2){1|C<2>,1|H<1>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|O<2>,2|C<4>}	122.5845	0.175	2	122.5845	0.031	2	122.5845	0.031	2	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]2)(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{3|C<3>,4|C<4>}	C[5a](C[5a]C[5a]2)(S[5a]C[5a])(B[5]O[5]2){1|H<1>,2|C<4>,3|C<3>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	123.0891	2.549	8	123.0891	6.496	8	123.0207	4.055	18	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]C[6])(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{2|C<3>,5|C<4>}	C[5a](C[5a]C[5a]C[6])(S[5a]C[5a])(B[5]O[5]2){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	122.9650	1.901	4	122.9650	3.615	4	123.0207	4.055	18	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]O[5]2){1|C<3>,3|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	122.9715	1.824	4	122.9715	3.327	4	123.0207	4.055	18	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:2:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:S[5a]-2:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CH)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{2|C<3>,2|C<4>,3|H<1>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(B[5]O[5]2){1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CH){1|C<3>,1|C<4>,1|H<1>,1|S<2>}	122.9570	1.601	2	122.9570	2.563	2	123.0207	4.055	18	122.9768	3.339	28	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5,5a]-3:C[5a,6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6a]C[5,5a])(O[5]C[5])2	C[5a](C[5,5a]C[5,5a]C[5,6a])(C[5a,6a]C[5a,6a]C[6a])(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6a]C[5,5a])(O[5]C[5])2{4|C<3>,4|C<4>}	C[5a](C[5,5a]C[5,5a]C[5,6a])(C[5a,6a]C[5a,6a]C[6a])(B[5]O[5]2){1|F<1>,2|C<4>,5|C<3>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.0015	1.534	2	123.0015	2.352	2	123.0015	2.352	2	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a,6a]-3:C[5a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6a]C[5a])(O[5]C[5])2	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]H)(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6a]C[5a])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]H)(B[5]O[5]2){1|H<1>,2|C<3>,3|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.8190	1.885	4	122.8190	3.554	4	122.8190	3.554	4	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:C[5a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]2)(O[5]C[5])2	C[5a](C[5a]C[5a]H)(C[5a]N[5a]C)(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[5a](C[5a]C[5a]H)(C[5a]N[5a]C)(B[5]O[5]2){1|Cu<4>,1|C<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6960	2.068	4	122.6960	4.277	4	122.6960	4.277	4	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:N[5a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	C[5a](C[5a]C[5a,6a]H)(N[5a]C[5a,6a]C)(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	C[5a](C[5a]C[5a,6a]H)(N[5a]C[5a,6a]C)(B[5]O[5]2){1|C<3>,1|N<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	123.0130	2.959	2	123.0130	8.753	2	122.8792	4.479	4	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	C[5a]-3:N[5a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	C[5a](C[5a]C[5a]Cl)(N[5a]N[5a]C)(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|Cl<1>,1|C<3>,1|N<2>,5|C<4>}	C[5a](C[5a]C[5a]Cl)(N[5a]N[5a]C)(B[5]O[5]2){1|H<1>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	122.7455	2.147	2	122.7455	4.612	2	122.8792	4.479	4	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	0:SP2_SP2_SP2	B[5]	C[5a]	O[5]	3:2:2:	3:3:3:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	N[5a]-3:C[5a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	C[5a](N[5a]C[6a]N[5a])(C[5a]C[5a]H)(B[5]O[5]2)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|H<1>,1|N<2>,2|C<3>,4|C<4>}	C[5a](N[5a]C[6a]N[5a])(C[5a]C[5a]H)(B[5]O[5]2){2|C<3>,3|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	122.5080	3.483	2	122.5080	12.133	2	122.5080	12.133	2	122.7873	3.449	16	122.9079	3.308	44	122.9079	3.308	44
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	3:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OAl)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](B[5]C[5,6a]O)(C[5]C[5,6a]H)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OAl){2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,3|H<1>}	O[5](B[5]C[5,6a]O)(C[5]C[5,6a]H){2|C<3>}	107.1790	0.147	2	107.1790	0.022	2	107.1790	0.022	2	112.5354	13.422	7	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	3:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:I[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|F<1>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,1|O<2>,2|H<1>}	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O){2|C<3>}	114.6450	0.255	2	114.6450	0.065	2	114.7280	0.053	3	112.5354	13.422	7	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	3:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:I[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|H<1>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|O<2>,2|H<1>}	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O){2|C<3>}	114.8940	0.000	1	114.8940	0.000	1	114.7280	0.053	3	112.5354	13.422	7	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	3:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	I[5]-3:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O)	O[5](I[5]C[5,6a]Cl)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|Cl<1>,1|F<1>,2|C<3>}	C[5,6a](C[5,6a]C[6a]I[5])(C[6a]C[6a]F)(B[5]O[5]O){1|Cl<1>,1|C<3>,2|H<1>}	O[5](I[5]C[5,6a]Cl)(B[5]C[5,6a]O){2|C<3>}	114.6030	0.225	2	114.6030	0.051	2	114.6030	0.051	2	112.5354	13.422	7	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5,5a]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH)	C[5,6a](C[5,6a]B[5,5a]C[6a])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](B[5,5a]C[5,6a]N[5a,6]O[5a])(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]B[5,5a]C[6a])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	O[5](B[5,5a]C[5,6a]N[5a,6]O[5a])(B[5]C[5,6a]O){5|C<3>}	109.8650	0.000	1	109.8650	0.000	1	109.8650	0.000	1	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5,6]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH)	C[5,6a](C[5,6a]B[5,6]C[6a])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](B[5,6]C[5,6a]N[5a,6]O[6])(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[5,6a](C[5,6a]B[5,6]C[6a])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	O[5](B[5,6]C[5,6a]N[5a,6]O[6])(B[5]C[5,6a]O){5|C<3>}	109.7680	0.013	2	109.7680	0.000	2	109.7680	0.000	2	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH)	C[5,6a](C[5,6a]C[6a]B[5])(C[6a]C[6a]F)(B[5]O[5]O)	O[5](B[5]C[5,6a]OO)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH){1|F<1>,1|O<2>,1|O<3>,2|C<3>}	C[5,6a](C[5,6a]C[6a]B[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,1|O<2>,1|O<3>,2|F<1>}	O[5](B[5]C[5,6a]OO)(B[5]C[5,6a]O){2|C<3>}	109.8180	0.000	1	109.8180	0.000	1	109.8180	0.000	1	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(B[5]O[5]O)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]C)(B[5]O[5]O){1|C<3>,4|H<1>}	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O){2|C<3>}	108.0280	0.000	1	108.0280	0.000	1	108.3238	0.043	9	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](C[5]C[5,6a]CH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|C<4>,3|H<1>}	O[5](C[5]C[5,6a]CH)(B[5]C[5,6a]O){2|C<3>}	108.6060	0.000	1	108.6060	0.000	1	108.3238	0.043	9	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|H<1>,3|C<3>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,1|F<1>,1|N<2>,2|H<1>}	O[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]O){4|C<3>}	108.0570	0.000	1	108.0570	0.000	1	108.3238	0.043	9	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|C<3>,3|H<1>}	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(B[5]O[5]O){1|C<3>,4|H<1>}	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O){2|C<3>}	108.3705	0.138	6	108.3705	0.019	6	108.3238	0.043	9	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	727	976	5:SP2_SP2_SP2	B[5]	C[5,6a]	O[5]	3:2:2:	3:3:3:	4:3:	C[5,6a]-3:O[5]-2:O-2:	C[5,6a]-3:C[6a]-3:B[5]-3:	Si[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH)	C[5,6a](C[5,6a]C[6a]Si[5])(C[6a]C[6a]F)(B[5]O[5]O)	O[5](Si[5]C[5,6a]CC)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH){1|F<1>,2|C<3>,2|C<4>}	C[5,6a](C[5,6a]C[6a]Si[5])(C[6a]C[6a]F)(B[5]O[5]O){1|C<3>,2|C<4>,2|F<1>}	O[5](Si[5]C[5,6a]CC)(B[5]C[5,6a]O){2|C<3>}	111.7370	0.000	1	111.7370	0.000	1	111.7370	0.000	1	108.9907	1.119	14	110.1723	7.686	21	110.1723	7.686	21
2	762	976	0:SP2_SP2_SP2	B[5]	C[6]	O[5]	3:2:2:	3:3:3:	3:4:	C[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[6]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2)(O[5]C[5])2	C[6](B[5]O[5]2)(C[6]C[6]H)2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	C[6](B[5]O[5]2)(C[6]C[6]H)2{1|N<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.7283	1.084	8	122.7283	1.174	8	122.7283	1.174	8	122.8841	1.044	10	122.9885	1.045	12	122.9885	1.045	12
2	762	976	0:SP2_SP2_SP2	B[5]	C[6]	O[5]	3:2:2:	3:3:3:	3:4:	C[6]-3:O[5]-2:O[5]-2:	C[6,6a]-3:B[5]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]C[6])(O[5]C[5])2	C[6](C[6,6a]C[6,6a]C[6a])(B[5]O[5]2)(C[6]N[6]H)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]C[6])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(B[5]O[5]2)(C[6]N[6]H){1|B<3>,1|H<1>,2|C<3>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.5075	0.455	2	123.5075	0.207	2	123.5075	0.207	2	122.8841	1.044	10	122.9885	1.045	12	122.9885	1.045	12
2	762	976	0:SP2_SP2_SP2	B[5]	C[6]	O[5]	3:2:2:	4:3:3:	3:4:	C[6]-3:O[5]-2:O[5]-2:	C[5,6]-4:C[6,6]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6,6])(O[5]C[5])2	C[6](C[5,6]C[5,6]C[5]2)(C[6,6]C[6,6]C[6])(B[5]O[5]2)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6,6])(O[5]C[5])2{9|C<4>}	C[6](C[5,6]C[5,6]C[5]2)(C[6,6]C[6,6]C[6])(B[5]O[5]2){1|C<3>,1|O<2>,7|C<4>,7|H<1>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	123.5105	1.200	2	123.5105	1.440	2	123.5105	1.440	2	123.5105	1.440	2	122.9885	1.045	12	122.9885	1.045	12
2	778	951	0:SP2_SP-NON_SPD5	B[5,5,6x6]	C[3,3,3x5,11x6]	H	5:5:1:	5:6:5:3:4:	3:	C[3,3,3x5,11x6]-5:B[3,3,3x5,10x6]-5:H-1:	B[3x3,3x5,9x6]-5:B[5x3,5,5,8x6]-6:B[3x3,3x5,8x6]-5:B[5,5,6x6]-3:C[6]-4:	B[5,5,6x6]-3:	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H)	C[3,3,3x5,11x6](B[3x3,3x5,9x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]C[6])(B[5x3,5,5,8x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]2H)(B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5,5,6x6]B[3,3,3x5,10x6]H)(C[6]C[6]HH)	H(B[5,5,6x6]B[3,3,3x5,10x6]C[3,3,3x5,11x6])	B[5,5,6x6](C[3,3,3x5,11x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,5,5,8x6]C[6])(B[3,3,3x5,10x6]B[3x3,3x5,8x6]2B[5x3,5,5,8x6]H)(H){2|B<6>,2|C<4>,7|H<1>}	C[3,3,3x5,11x6](B[3x3,3x5,9x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]C[6])(B[5x3,5,5,8x6]B[3x3,3x5,8x6]B[3x3,3x5,9x6]B[5x3,3x5,5x6]2H)(B[3x3,3x5,8x6]B[3x3,3x5,8x6]B[5x3,3x5,5x6]B[5x3,5,5,8x6]H)(B[5,5,6x6]B[3,3,3x5,10x6]H)(C[6]C[6]HH){1|B<4>,1|B<6>,1|C<4>,8|H<1>}	H(B[5,5,6x6]B[3,3,3x5,10x6]C[3,3,3x5,11x6])	113.4240	0.000	1	113.4240	0.000	1	113.4240	0.000	1	113.4240	0.000	1	113.4240	0.000	1	113.4240	0.000	1
2	786	956	0:SP2_SP2_SP3	B[5]	B[5]	N	3:4:3:	3:3:1:1:	3:4:4:	N[5]-3:B[5]-4:N-3:	N[5]-3:B[5]-3:Cl-1:Cl-1:	B[5]-3:C-4:C-4:	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC)	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2	N(B[5]B[5]N[5])(CH3)2	B[5](N[5]C[5]C[6])(B[5]N[5]Cl2)(NCC){1|H<1>,1|N<3>,3|C<4>}	B[5](N[5]C[5]C[6])(B[5]N[5]N)(Cl)2{1|H<1>,1|N<3>,3|C<4>}	N(B[5]B[5]N[5])(CH3)2	130.7130	0.000	1	130.7130	0.000	1	130.7130	0.000	1	130.7130	0.000	1	130.7130	0.000	1	130.7130	0.000	1
2	786	976	0:SP2_SP2_SP3	B[5]	B[5,5]	O[5]	4:2:2:	4:3:2:2:	3:4:	B[5,5]-4:O[5]-2:O[5]-2:	N[5,5]-4:B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5,5]N[5,5]O[5]2)(O[5]C[5])2	B[5,5](N[5,5]C[5]2H)(B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC)	B[5](B[5,5]N[5,5]O[5]2)(O[5]C[5])2{1|H<1>,8|C<4>}	B[5,5](N[5,5]C[5]2H)(B[5]O[5]2)(O[5]C[5])2{4|C<4>,6|H<1>}	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC){1|N<4>,2|C<4>,2|O<2>}	124.0520	0.232	2	124.0520	0.054	2	124.0520	0.054	2	124.0520	0.054	2	124.0520	0.054	2	124.3545	1.873	6
2	786	976	0:SP2_SP2_SP3	B[5]	B[5]	O[5]	4:2:2:	3:3:2:2:	3:4:	B[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]C[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(C[5]N[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]C[5]O[5]2)(O[5]C[5])2{2|N<3>,6|C<4>}	B[5](B[5]O[5]2)(C[5]N[5]2)(O[5]C[5])2{2|C<3>,8|C<4>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){1|C<3>,2|C<4>,2|O<2>}	124.6920	2.490	2	124.6920	6.202	2	124.5058	3.013	4	124.5058	3.013	4	124.5058	3.013	4	124.3545	1.873	6
2	786	976	0:SP2_SP2_SP3	B[5]	B[5]	O[5]	4:2:2:	3:3:2:2:	3:4:	B[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5](B[5]C[5]O[5]2)(O[5]C[5])2	B[5](B[5]O[5]2)(C[5]N[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]C[5]O[5]2)(O[5]C[5])2{2|C<4>,2|N<3>,4|H<1>}	B[5](B[5]O[5]2)(C[5]N[5]2)(O[5]C[5])2{2|C<4>,4|C<3>,4|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){1|C<3>,2|H<1>,2|O<2>}	124.3195	1.643	2	124.3195	2.698	2	124.5058	3.013	4	124.5058	3.013	4	124.5058	3.013	4	124.3545	1.873	6
2	786	976	5:SP2_SP2_SP3	B[5]	B[5]	O[5]	4:4:2:	3:3:3:1:	3:3:	C[5]-4:B[5]-4:O[5]-2:	B[5]-3:C[5]-3:C[5]-3:H-1:	B[5]-3:C[5]-3:	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5])	B[5](B[5]C[5]O[5])(C[5]C[5]N[5])(C[5]C[5]H)(H)	O[5](B[5]B[5]C[5])(C[5]C[5]C)	B[5](C[5]C[5]N[5]H)(B[5]C[5]2H)(O[5]C[5]){1|C<3>,1|H<1>,1|N<3>,6|C<4>}	B[5](B[5]C[5]O[5])(C[5]C[5]N[5])(C[5]C[5]H)(H){1|C<3>,1|H<1>,1|N<3>,6|C<4>}	O[5](B[5]B[5]C[5])(C[5]C[5]C){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	103.7940	0.000	1	103.7940	0.000	1	103.7940	0.000	1	103.7940	0.000	1	103.7940	0.000	1	103.7940	0.000	1
2	790	818	0:SP2_SP-NON_SP2	B[5]	Cl	C[5]	3:3:1:	3:	3:3:3:	C[5]-3:O[5,6]-3:Cl-1:	B[5]-3:	C[5]-3:B[5]-3:C[6a]-3:	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl)	Cl(B[5]O[5,6]C[5])	C[5](C[5]B[5,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2)	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl){2|Cl<1>,2|O<3>,4|C<3>}	Cl(B[5]O[5,6]C[5])	C[5](C[5]B[5,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2){1|Cl<1>,1|B<4>,1|O<3>,2|H<1>,4|C<3>}	127.1420	0.000	1	127.1420	0.000	1	127.1420	0.000	1	127.1345	0.000	2	125.9433	2.857	4	125.9433	2.857	4
2	790	818	0:SP2_SP-NON_SP2	B[5]	Cl	C[5]	3:3:1:	3:	3:3:3:	O[5,6]-3:C[5]-3:Cl-1:	B[5]-3:	C[5]-3:B[5]-3:C[6a]-3:	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl)	Cl(B[5]O[5,6]C[5])	C[5](C[5]B[5,6,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2)	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl){1|Cl<1>,3|O<3>,4|C<3>}	Cl(B[5]O[5,6]C[5])	C[5](C[5]B[5,6,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2){1|B<4>,2|H<1>,2|O<3>,4|C<3>}	127.1270	0.000	1	127.1270	0.000	1	127.1270	0.000	1	127.1345	0.000	2	125.9433	2.857	4	125.9433	2.857	4
2	790	818	0:SP2_SP-NON_SP2	B[5]	Cl	C[5]	3:3:1:	3:	3:3:4:	C[5]-3:C[5]-3:Cl-1:	B[5]-3:	C[5]-3:B[5]-3:Si-4:	B[5](C[5]C[5]Si)2(Cl)	Cl(B[5]C[5]2)	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3)	B[5](C[5]C[5]Si)2(Cl){2|C<3>}	Cl(B[5]C[5]2)	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3){1|Si<4>,3|C<3>}	124.7520	1.701	2	124.7520	2.894	2	124.7520	2.894	2	124.7520	2.894	2	125.9433	2.857	4	125.9433	2.857	4
2	790	916	0:SP2_SP-NON_SP3	B[5]	Cl	O[5,6]	3:3:1:	3:	4:4:3:	C[5]-3:O[5,6]-3:Cl-1:	B[5]-3:	B[5,6]-4:B[5,6]-4:B[5]-3:	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl)	Cl(B[5]O[5,6]C[5])	O[5,6](B[5,6]O[5,6,6]C[5]Cl)(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl)	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl){2|Cl<1>,2|O<3>,4|C<3>}	Cl(B[5]O[5,6]C[5])	O[5,6](B[5,6]O[5,6,6]C[5]Cl)(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl){1|B<4>,2|B<3>,4|C<3>}	122.0260	0.000	1	122.0260	0.000	1	122.0260	0.000	1	121.6440	0.292	2	121.6440	0.292	2	121.6440	0.292	2
2	790	916	0:SP2_SP-NON_SP3	B[5]	Cl	O[5,6]	3:3:1:	3:	4:4:3:	O[5,6]-3:C[5]-3:Cl-1:	B[5]-3:	B[5,6,6]-4:B[5,6]-4:B[5]-3:	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl)	Cl(B[5]O[5,6]C[5])	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl)	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl){1|Cl<1>,3|O<3>,4|C<3>}	Cl(B[5]O[5,6]C[5])	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl){2|B<4>,3|B<3>,4|C<3>}	121.2620	0.000	1	121.2620	0.000	1	121.2620	0.000	1	121.6440	0.292	2	121.6440	0.292	2	121.6440	0.292	2
2	811	976	0:SP2_SP2_SP3	B[5]	B[6a]	O[5]	4:2:2:	3:3:3:3:	3:4:	B[6a]-4:O[5]-2:O[5]-2:	C[5a,6a]-3:N[5a,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](B[6a]C[5a,6a]N[5a,6a]C[6a])(O[5]C[5])2	B[6a](C[5a,6a]N[5a,6a]N[5a])(N[5a,6a]C[5a,6a]C[5a])(C[6a]C[6a]2)(B[5]O[5]2)	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	B[5](B[6a]C[5a,6a]N[5a,6a]C[6a])(O[5]C[5])2{2|N<3>,4|C<3>,4|C<4>}	B[6a](C[5a,6a]N[5a,6a]N[5a])(N[5a,6a]C[5a,6a]C[5a])(C[6a]C[6a]2)(B[5]O[5]2){1|B<4>,1|N<3>,3|C<4>,3|H<1>,5|C<3>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){1|N<3>,2|C<3>,2|C<4>}	124.7940	0.151	2	124.7940	0.023	2	124.7940	0.023	2	124.7940	0.023	2	124.7940	0.023	2	124.7940	0.023	2
2	813	818	5:SP2_SP2_SP2	B[5]	N[5,6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	N[5,6a]-3:C[5]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:B[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2)	N[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[5a,6a]C)(B[5]C[6a]C[5])	C[5](B[5]N[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2)	B[5](N[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|C<4>,2|H<1>,7|C<3>}	N[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[5a,6a]C)(B[5]C[6a]C[5]){1|C<4>,1|N<3>,5|C<3>}	C[5](B[5]N[5,6a]C[6a])(C[5]C[5,6a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	104.6190	0.000	1	104.6190	0.000	1	104.6190	0.000	1	104.6190	0.000	1	104.6190	0.000	1	104.6190	0.000	1
2	818	818	0:SP2_SP2_SP2	B[5]	C[5,5]	C[5]	3:3:3:	3:4:3:	3:3:3:	C[5,5]-3:B[5]-3:C[5]-3:	N[5]-3:C[5,5]-4:B[5]-3:	B[5]-3:N[5]-3:N[5]-3:	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2)	C[5,5](N[5]C[6a]C[5])(C[5,5]C[5]2C)(B[5]B[5]C[5])	C[5](B[5]C[5,5]B[5])(N[5]C[5]C)2	B[5](C[5,5]C[5,5]N[5])(B[5]C[5]2)(C[5]N[5]2){1|N<3>,3|C<3>,3|H<1>,6|C<4>}	C[5,5](N[5]C[6a]C[5])(C[5,5]C[5]2C)(B[5]B[5]C[5]){2|C<3>,2|N<3>,3|C<4>,4|H<1>}	C[5](B[5]C[5,5]B[5])(N[5]C[5]C)2{1|N<3>,5|C<4>}	130.0670	0.000	1	130.0670	0.000	1	130.0670	0.000	1	130.0670	0.000	1	130.0670	0.000	1	130.0670	0.000	1
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:1:	3:3:4:	3:3:4:	C[5]-3:C[5]-3:Cl-1:	C[5]-3:B[5]-3:Si-4:	C[5]-3:B[5]-3:Si-4:	B[5](C[5]C[5]Si)2(Cl)	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3)	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3)	B[5](C[5]C[5]Si)2(Cl){2|C<3>}	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3){1|Si<4>,3|C<3>}	C[5](C[5]C[6a]C[5])(B[5]C[5]Cl)(SiC3){1|Si<4>,3|C<3>}	110.2220	0.000	1	110.2220	0.000	1	110.2220	0.000	1	110.2220	0.000	1	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){2|H<1>,8|C<3>}	104.6797	0.324	3	104.6797	0.105	3	104.6797	0.105	3	104.6427	0.319	7	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:N-3:	C[5]-3:C[6a]-3:B[5]-3:	C[5]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5])2(NSi2)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N)	B[5](C[5]C[6a]C[5])2(NSi2){6|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N){2|H<1>,6|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N){2|H<1>,6|C<3>}	103.5460	0.000	1	103.5460	0.000	1	103.5460	0.000	1	104.6427	0.319	7	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5a]-3:C[5]-3:C[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5a]C[5a]O[5a])(C[5]C[6a]C[5])2	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5a]C[5a]O[5a])(C[5]C[6a]C[5])2{1|H<1>,8|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|O<2>,2|H<1>,7|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|O<2>,2|H<1>,7|C<3>}	105.0770	0.000	1	105.0770	0.000	1	104.9713	0.087	3	104.6427	0.319	7	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[5a]-3:C[5]-3:C[5]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5]-3:C[5]-3:C[6a]-3:	B[5](C[5a]C[5a]S[5a])(C[5]C[6a]C[5])2	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2)	B[5](C[5a]C[5a]S[5a])(C[5]C[6a]C[5])2{1|H<1>,8|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|S<2>,2|H<1>,7|C<3>}	C[5](B[5]C[5a]C[5])(C[5]C[6a]C[5])(C[6a]C[6a]2){1|S<2>,2|H<1>,7|C<3>}	104.9185	0.397	2	104.9185	0.157	2	104.9713	0.087	3	104.6427	0.319	7	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:C[5]-3:	B[5]-3:C[5]-3:Si-4:	B[5]-3:C[5]-3:Si-4:	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(SiC3)	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2{1|B<3>,2|H<1>,3|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3){1|Si<4>,1|B<3>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[5]B)(SiC3){1|Si<4>,3|C<3>}	106.3830	0.000	1	106.3830	0.000	1	106.5170	0.036	2	106.5170	0.036	2	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:C[5]-3:	B[5]-3:C[5]-3:Si-4:	B[5]-3:C[5]-3:Si-4:	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3)	B[5](C[6a]C[6a]2)(C[5]C[5]Si)2{2|C<4>,4|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3){1|Si<4>,5|C<3>}	C[5](B[5]C[6a]C[5])(C[5]C[6a]C[5])(SiC3){1|Si<4>,5|C<3>}	106.6510	0.000	1	106.6510	0.000	1	106.5170	0.036	2	106.5170	0.036	2	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:3:	3:3:4:	4:3:3:	C[5]-3:C[5]-3:N-3:	C[5]-3:B[5]-3:Si-4:	Si-4:B[5]-3:C[5]-3:	B[5](C[5]C[5]Si)2(NC[6a]2)	C[5](C[5]C[6a]C[5])(B[5]C[5]N)(SiC3)	C[5](SiC[6a]CC)(B[5]C[5]N)(C[5]C[5]B)	B[5](C[5]C[5]Si)2(NC[6a]2){1|B<4>,1|C<3>}	C[5](C[5]C[6a]C[5])(B[5]C[5]N)(SiC3){1|Si<4>,1|B<4>,2|C<3>}	C[5](SiC[6a]CC)(B[5]C[5]N)(C[5]C[5]B){1|Si<4>,1|C<3>}	106.6700	0.000	1	106.6700	0.000	1	106.6700	0.000	1	106.6700	0.000	1	105.5819	3.058	12	105.5819	3.058	12
2	818	818	5:SP2_SP2_SP2	B[5]	C[5]	C[5]	3:3:4:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:C[5]-4:	C[5]-3:C[6a]-3:B[5]-3:	C[5]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[6a]C[5])2(C[5]C[5]2Mn)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]2)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]2)	B[5](C[5]C[6a]C[5])2(C[5]C[5]2Mn){2|C<4>,2|H<1>,6|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]2){1|Mn<8>,2|C<4>,2|H<1>,6|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]2){1|Mn<8>,2|C<4>,2|H<1>,6|C<3>}	104.5580	0.000	1	104.5580	0.000	1	104.5580	0.000	1	104.5580	0.000	1	105.5819	3.058	12	105.5819	3.058	12
2	818	893	0:SP2_SP2_SP2	B[5]	C[5]	O	2:3:2:	4:3:3:	3:1:	O[5]-2:C[5]-3:O-2:	C[5,6]-4:B[5]-3:C-3:	B[5]-3:H-1:	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH)	C[5](C[5,6]C[5,6,6]C[6]H)(B[5]O[5]O)(CHH)	O(B[5]C[5]O[5])(H)	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6,6]C[6]H)(B[5]O[5]O)(CHH){2|H<1>,3|C<4>}	O(B[5]C[5]O[5])(H)	132.2610	0.000	1	132.2610	0.000	1	132.2610	0.000	1	132.2610	0.000	1	130.1880	8.595	2	130.1880	8.595	2
2	818	893	0:SP2_SP2_SP2	B[5]	C[5]	O	3:2:2:	3:3:3:	3:1:	C[5]-3:O[5]-2:O-2:	C[6a]-3:B[5]-3:C[5]-3:	B[5]-3:H-1:	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH)	C[5](C[6a]C[6a]2)(B[5]O[5]O)(C[5]C[5]C)	O(B[5]C[5]O[5])(H)	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH){1|C<2>,2|C<3>,2|C<4>}	C[5](C[6a]C[6a]2)(B[5]O[5]O)(C[5]C[5]C){2|C<3>,2|C<4>,2|H<1>}	O(B[5]C[5]O[5])(H)	128.1150	0.000	1	128.1150	0.000	1	128.1150	0.000	1	128.1150	0.000	1	130.1880	8.595	2	130.1880	8.595	2
2	818	916	5:SP2_SP2_SP3	B[5,6]	C[5]	O[5,6,6]	3:3:2:	3:3:3:	4:4:3:	O[5,6,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:C[5]-3:C[6a]-3:	B[5,6,6]-4:B[5,6]-4:B[5,6]-3:	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6])	C[5](B[5,6]O[5,6,6]O[6])(C[5]B[5,6]C[6a])(C[6a]C[6a]2)	O[5,6,6](B[5,6,6]O[5,6]2C[5])(B[5,6]O[5,6]C[5]Cl)(B[5,6]C[5]O[6])	B[5,6](O[5,6,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(O[6]B[5,6]){1|Cl<1>,3|O<3>,5|C<3>}	C[5](B[5,6]O[5,6,6]O[6])(C[5]B[5,6]C[6a])(C[6a]C[6a]2){1|Cl<1>,1|B<3>,1|B<4>,1|O<3>,2|H<1>,4|C<3>}	O[5,6,6](B[5,6,6]O[5,6]2C[5])(B[5,6]O[5,6]C[5]Cl)(B[5,6]C[5]O[6]){2|B<4>,3|B<3>,4|C<3>}	110.3110	0.000	1	110.3110	0.000	1	110.3110	0.000	1	110.3110	0.000	1	110.3110	0.000	1	111.1710	0.594	4
2	818	916	5:SP2_SP2_SP3	B[5,6]	C[5]	O[5,6]	3:3:2:	3:3:3:	4:3:4:	O[5,6]-3:C[5]-3:O[6]-2:	B[5,6]-3:C[5]-3:C[6a]-3:	B[5,6,6]-4:B[5,6]-3:B[5]-4:	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6])	C[5](B[5,6]O[5,6]O[6])(C[5]C[6a]B[5])(C[6a]C[6a]2)	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]C[5]O[6])(B[5]C[5]Cl2)	B[5,6](O[5,6]B[5,6,6]B[5])(C[5]C[6a]C[5])(O[6]B[5,6]){2|Cl<1>,2|O<3>,5|C<3>}	C[5](B[5,6]O[5,6]O[6])(C[5]C[6a]B[5])(C[6a]C[6a]2){2|Cl<1>,1|B<3>,1|B<4>,2|H<1>,4|C<3>}	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]C[5]O[6])(B[5]C[5]Cl2){2|B<3>,2|B<4>,4|C<3>}	112.0850	0.000	1	112.0850	0.000	1	112.0850	0.000	1	112.0850	0.000	1	112.0850	0.000	1	111.1710	0.594	4
2	818	916	5:SP2_SP2_SP3	B[5]	C[5]	O[5,6]	3:3:1:	3:3:3:	4:4:3:	C[5]-3:O[5,6]-3:Cl-1:	C[5]-3:B[5]-3:C[6a]-3:	B[5,6]-4:B[5,6]-4:B[5]-3:	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl)	C[5](C[5]B[5,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2)	O[5,6](B[5,6]O[5,6,6]C[5]Cl)(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl)	B[5](C[5]C[6a]C[5])(O[5,6]B[5,6]2)(Cl){2|Cl<1>,2|O<3>,4|C<3>}	C[5](C[5]B[5,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2){1|Cl<1>,1|B<4>,1|O<3>,2|H<1>,4|C<3>}	O[5,6](B[5,6]O[5,6,6]C[5]Cl)(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl){1|B<4>,2|B<3>,4|C<3>}	110.8240	0.000	1	110.8240	0.000	1	110.8240	0.000	1	111.1440	0.205	2	111.1440	0.205	2	111.1710	0.594	4
2	818	916	5:SP2_SP2_SP3	B[5]	C[5]	O[5,6]	3:3:1:	3:3:3:	4:4:3:	O[5,6]-3:C[5]-3:Cl-1:	C[5]-3:B[5]-3:C[6a]-3:	B[5,6,6]-4:B[5,6]-4:B[5]-3:	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl)	C[5](C[5]B[5,6,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2)	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl)	B[5](O[5,6]B[5,6,6]B[5,6])(C[5]C[6a]C[5])(Cl){1|Cl<1>,3|O<3>,4|C<3>}	C[5](C[5]B[5,6,6]C[6a])(B[5]O[5,6]Cl)(C[6a]C[6a]2){1|B<4>,2|H<1>,2|O<3>,4|C<3>}	O[5,6](B[5,6,6]O[5,6,6]O[5,6]C[5])(B[5,6]O[5,6]C[5]Cl)(B[5]C[5]Cl){2|B<4>,3|B<3>,4|C<3>}	111.4640	0.000	1	111.4640	0.000	1	111.4640	0.000	1	111.1440	0.205	2	111.1440	0.205	2	111.1710	0.594	4
2	818	924	0:SP2_SP-NON_SP2	B[5]	C[5]	Br	3:3:1:	3:3:3:	3:	C[5,6a]-3:C[5]-3:Br-1:	C[5]-3:B[5]-3:C[6a]-3:	B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br)	C[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]2)	Br(B[5]C[5,6a]C[5])	B[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(Br){1|F<1>,5|C<3>}	C[5](C[5]C[5,6a]C[6a])(B[5]C[5,6a]Br)(C[6a]C[6a]2){2|F<1>,6|C<3>}	Br(B[5]C[5,6a]C[5])	127.0600	0.000	1	127.0600	0.000	1	127.0600	0.000	1	127.0600	0.000	1	127.0600	0.000	1	127.0600	0.000	1
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:2:3:	4:3:3:	3:4:4:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	B[5]-3:C-4:C-4:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Ni)	N(B[5]C[5]O[5])(CCCH)2	B[5](C[5]C[5]C)(O[5]C[5])(NCC){2|C<4>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Ni){2|C<4>}	N(B[5]C[5]O[5])(CCCH)2	134.0610	0.000	1	134.0610	0.000	1	134.6657	0.803	3	134.6657	0.803	3	129.9986	22.591	7	129.9986	22.591	7
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:2:3:	4:3:3:	3:4:4:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	B[5]-3:C-4:C-4:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Pd)	N(B[5]C[5]O[5])(CCCH)2	B[5](C[5]C[5]C)(O[5]C[5])(NCC){2|C<4>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Pd){2|C<4>}	N(B[5]C[5]O[5])(CCCH)2	135.6950	0.000	1	135.6950	0.000	1	134.6657	0.803	3	134.6657	0.803	3	129.9986	22.591	7	129.9986	22.591	7
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:2:3:	4:3:3:	3:4:4:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	B[5]-3:C-4:C-4:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CPdC)	N(B[5]C[5]O[5])(CCCH)2	B[5](C[5]C[5]C)(O[5]C[5])(NCC){4|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CPdC){2|H<1>}	N(B[5]C[5]O[5])(CCCH)2	134.2410	0.000	1	134.2410	0.000	1	134.6657	0.803	3	134.6657	0.803	3	129.9986	22.591	7	129.9986	22.591	7
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:3:3:	3:3:3:	3:4:4:	C[5]-3:C[5]-3:N-3:	C[5]-3:C[6a]-3:B[5]-3:	B[5]-3:Si-4:Si-4:	B[5](C[5]C[6a]C[5])2(NSi2)	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N)	N(B[5]C[5]2)(SiC3)2	B[5](C[5]C[6a]C[5])2(NSi2){6|C<3>}	C[5](C[5]C[6a]C[5])(C[6a]C[6a]2)(B[5]C[5]N){2|H<1>,6|C<3>}	N(B[5]C[5]2)(SiC3)2	128.1835	1.173	2	128.1835	1.376	2	128.1835	1.376	2	128.1835	1.376	2	129.9986	22.591	7	129.9986	22.591	7
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:3:3:	3:3:4:	3:3:3:	C[5]-3:C[5]-3:N-3:	C[5]-3:B[5]-3:Si-4:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[5]Si)2(NC[6a]2)	C[5](C[5]C[6a]C[5])(B[5]C[5]N)(SiC3)	N(C[6a]C[6a]2)2(B[5]C[5]2)	B[5](C[5]C[5]Si)2(NC[6a]2){1|B<4>,1|C<3>}	C[5](C[5]C[6a]C[5])(B[5]C[5]N)(SiC3){1|Si<4>,1|B<4>,2|C<3>}	N(C[6a]C[6a]2)2(B[5]C[5]2)	126.6640	0.000	1	126.6640	0.000	1	126.6640	0.000	1	126.6640	0.000	1	129.9986	22.591	7	129.9986	22.591	7
2	818	956	0:SP2_SP2_SP2	B[5]	C[5]	N	3:3:3:	4:3:3:	3:3:3:	C[5]-3:C[5]-3:N-3:	Si-4:B[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:B[5]-3:	B[5](C[5]C[5]Si)2(NC[6a]2)	C[5](SiC[6a]CC)(B[5]C[5]N)(C[5]C[5]B)	N(C[6a]C[6a]2)2(B[5]C[5]2)	B[5](C[5]C[5]Si)2(NC[6a]2){1|B<4>,1|C<3>}	C[5](SiC[6a]CC)(B[5]C[5]N)(C[5]C[5]B){1|Si<4>,1|C<3>}	N(C[6a]C[6a]2)2(B[5]C[5]2)	122.9620	0.000	1	122.9620	0.000	1	122.9620	0.000	1	122.9620	0.000	1	129.9986	22.591	7	129.9986	22.591	7
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:2:	3:3:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:Se[5]-2:	B[5]-3:C[5]-3:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5])	O[5](B[5]C[5]O[5])(C[5]C[5]C)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|H<1>,2|C<3>,3|C<4>}	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5]){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]C){1|Se<2>,1|C<3>,2|C<4>}	122.5560	0.000	1	122.5560	0.000	1	122.5560	0.000	1	122.5560	0.000	1	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:2:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:Se[5]-2:	B[5]-3:C[5]-4:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5])	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|H<1>,2|C<3>,3|C<4>}	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5]){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,1|C<4>}	125.0340	0.000	1	123.7623	5.726	3	123.7623	5.726	3	123.2309	3.661	11	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:2:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:Se[5]-2:	B[5]-3:C[5]-4:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5])	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	C[5](B[5]O[5]2)(C[5]C[5]H)(Se[5]C[5]){1|Si<4>,1|H<1>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	123.1265	3.004	2	123.7623	5.726	3	123.7623	5.726	3	123.2309	3.661	11	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:2:	3:4:	C[5]-3:O[5]-2:O[5]-2:	C[5,6]-3:B[5]-3:Se[5]-2:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6]Se[5])(O[5]C[5])2	C[5](C[5,6]C[5,6]C[6])(B[5]O[5]2)(Se[5]C[5])	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6]Se[5])(O[5]C[5])2{2|C<3>,5|C<4>}	C[5](C[5,6]C[5,6]C[6])(B[5]O[5]2)(Se[5]C[5]){1|B<3>,2|H<1>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	123.0950	2.444	4	123.0950	5.973	4	123.0950	5.973	4	123.2309	3.661	11	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:2:	3:4:	C[5]-3:O[5]-2:O[5]-2:	C[5]-3:B[5]-3:Se[5]-2:	B[5]-3:C[5]-4:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	C[5](C[5]B[5]C[5])(B[5]O[5]2)(Se[5]C[5])	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|B<3>,2|C<3>,4|C<4>}	C[5](C[5]B[5]C[5])(B[5]O[5]2)(Se[5]C[5]){2|B<3>,2|C<4>,2|O<2>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	122.9682	1.419	4	122.9682	2.014	4	122.9682	2.014	4	123.2309	3.661	11	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:3:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-3:C[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2)(O[5]C[5])2	C[5](B[5]O[5]2)(C[5]C[5]C)(C[5]C[5]H)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	C[5](B[5]O[5]2)(C[5]C[5]C)(C[5]C[5]H){1|C<3>,1|H<1>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.3975	2.039	2	123.3975	4.156	2	123.3975	4.156	2	123.4055	1.314	10	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:3:	3:4:	C[5]-3:O[5]-2:O[5]-2:	C[5,6]-3:C[5,6]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6]2)(O[5]C[5])2	C[5](C[5,6]C[5,6]C[6])2(B[5]O[5]2)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6]2)(O[5]C[5])2{4|C<3>,4|C<4>}	C[5](C[5,6]C[5,6]C[6])2(B[5]O[5]2){2|C<3>,2|C<4>,2|H<1>,2|N<3>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	124.0160	0.844	2	124.0160	0.713	2	124.0160	0.713	2	123.4055	1.314	10	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:3:	3:4:	C[5]-3:O[5]-2:O[5]-2:	C[5,6a]-3:C[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5])(O[5]C[5])2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(B[5]O[5]2)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5])(O[5]C[5])2{4|C<3>,4|C<4>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]C[5])(B[5]O[5]2){1|H<1>,2|C<4>,5|C<3>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2000	1.843	2	123.2000	3.396	2	123.2000	3.396	2	123.4055	1.314	10	123.2796	2.340	22	123.2796	2.340	22
2	818	976	0:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:3:	3:4:	C[5]-3:O[5]-2:O[5]-2:	C[5]-3:C[5]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2)(O[5]C[5])2	C[5](C[5]Se[5]B[5])(C[5]B[5]C[5])(B[5]O[5]2)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2)(O[5]C[5])2{1|Se<2>,1|C<3>,2|B<3>,4|C<4>}	C[5](C[5]Se[5]B[5])(C[5]B[5]C[5])(B[5]O[5]2){1|B<3>,2|C<4>,4|O<2>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	123.2070	0.926	4	123.2070	0.857	4	123.2070	0.857	4	123.4055	1.314	10	123.2796	2.340	22	123.2796	2.340	22
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	2:3:2:	4:3:3:	4:3:	O[5]-2:C[5]-3:O-2:	C[5,6]-4:B[5]-3:C-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH)	C[5](C[5,6]C[5,6,6]C[6]H)(B[5]O[5]O)(CHH)	O[5](C[5,6,6]C[5,6]C[6,6]C[6])(B[5]C[5]O)	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH){1|H<1>,3|C<4>}	C[5](C[5,6]C[5,6,6]C[6]H)(B[5]O[5]O)(CHH){2|H<1>,3|C<4>}	O[5](C[5,6,6]C[5,6]C[6,6]C[6])(B[5]C[5]O){2|C<3>,3|H<1>,4|C<4>}	109.0570	0.000	1	109.0570	0.000	1	109.0570	0.000	1	109.0570	0.000	1	108.3405	0.754	6	108.3405	0.754	6
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:2:	3:3:3:	4:3:	C[5]-3:O[5]-2:O-2:	C[6a]-3:B[5]-3:C[5]-3:	C[5]-4:B[5]-3:	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH)	C[5](C[6a]C[6a]2)(B[5]O[5]O)(C[5]C[5]C)	O[5](C[5]C[5]CC)(B[5]C[5]O)	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH){1|C<2>,2|C<3>,2|C<4>}	C[5](C[6a]C[6a]2)(B[5]O[5]O)(C[5]C[5]C){2|C<3>,2|C<4>,2|H<1>}	O[5](C[5]C[5]CC)(B[5]C[5]O){1|C<2>,1|C<3>}	109.7210	0.000	1	109.7210	0.000	1	109.7210	0.000	1	109.7210	0.000	1	108.3405	0.754	6	108.3405	0.754	6
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:3:	4:3:3:	4:3:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Ni)	O[5](C[5]C[5]CC)(B[5]C[5]N)	B[5](C[5]C[5]C)(O[5]C[5])(NCC){2|C<4>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Ni){2|C<4>}	O[5](C[5]C[5]CC)(B[5]C[5]N){1|C<3>,2|H<1>}	107.8190	0.000	1	107.8190	0.000	1	107.9513	0.015	3	107.9513	0.015	3	108.3405	0.754	6	108.3405	0.754	6
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:3:	4:3:3:	4:3:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Pd)	O[5](C[5]C[5]CC)(B[5]C[5]N)	B[5](C[5]C[5]C)(O[5]C[5])(NCC){2|C<4>,2|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CC[6a]Pd){2|C<4>}	O[5](C[5]C[5]CC)(B[5]C[5]N){1|C<3>,2|H<1>}	107.9740	0.000	1	107.9740	0.000	1	107.9513	0.015	3	107.9513	0.015	3	108.3405	0.754	6	108.3405	0.754	6
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:2:3:	4:3:3:	4:3:	C[5]-3:O[5]-2:N-3:	C[5]-4:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	C[5](C[5]C[5]HH)(B[5]O[5]N)(CPdC)	O[5](C[5]C[5]HH)(B[5]C[5]N)	B[5](C[5]C[5]C)(O[5]C[5])(NCC){4|H<1>}	C[5](C[5]C[5]HH)(B[5]O[5]N)(CPdC){2|H<1>}	O[5](C[5]C[5]HH)(B[5]C[5]N){1|C<3>,2|H<1>}	108.0610	0.000	1	108.0610	0.000	1	107.9513	0.015	3	107.9513	0.015	3	108.3405	0.754	6	108.3405	0.754	6
2	818	976	5:SP2_SP2_SP2	B[5]	C[5]	O[5]	3:3:2:	3:3:3:	4:3:	C[5]-3:C[6a]-3:O[5]-2:	N[5]-3:B[5]-3:C[6a]-3:	B[4,5]-4:B[5]-3:	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5])	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2)	O[5](B[4,5]C[4]N[5]O[4])(B[5]C[6a]C[5])	B[5](C[5]C[6a]N[5])(C[6a]C[6a]2)(O[5]B[4,5]){1|O<2>,3|C<4>,5|C<3>}	C[5](N[5]B[4,5]C[6a])(B[5]C[6a]O[5])(C[6a]C[6a]2){1|O<2>,3|C<4>,6|C<3>}	O[5](B[4,5]C[4]N[5]O[4])(B[5]C[6a]C[5]){3|C<4>,4|C<3>}	107.4110	0.000	1	107.4110	0.000	1	107.4110	0.000	1	107.4110	0.000	1	108.3405	0.754	6	108.3405	0.754	6
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[6]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](B[5]O[5]2)(C[6]C[6]H)2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	N[6](B[5]O[5]2)(C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.5235	0.037	2	122.5301	0.114	8	122.5301	0.114	8	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[6]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](B[5]O[5]2)(C[6]C[6]H)2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	N[6](B[5]O[5]2)(C[6]C[6]H)2{1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.6140	0.486	2	122.5301	0.114	8	122.5301	0.114	8	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[6]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](B[5]O[5]2)(C[6]C[6]H)2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	N[6](B[5]O[5]2)(C[6]C[6]H)2{2|Cl<1>,3|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.4915	0.425	4	122.5301	0.114	8	122.5301	0.114	8	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[6]-3:N[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]N[6])(O[5]C[5])2	N[6](B[5]O[5]2)(C[6]C[6]H)(N[6]C[6]B)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]N[6])(O[5]C[5])2{1|B<3>,1|H<1>,2|C<3>,4|C<4>}	N[6](B[5]O[5]2)(C[6]C[6]H)(N[6]C[6]B){1|C<3>,2|C<4>,2|H<1>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	122.6205	1.463	2	122.6205	2.140	2	122.6205	2.140	2	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	C[6]-3:B[5]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](C[6]C[6,6a]H)(B[5]O[5]2)(C[6]C[6]H)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	N[6](C[6]C[6,6a]H)(B[5]O[5]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.5900	0.197	2	122.5900	0.039	2	122.7475	3.128	4	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	C[6]-3:B[5]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](C[6]C[6a]C[6])(B[5]O[5]2)(C[6]C[6]H)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	N[6](C[6]C[6a]C[6])(B[5]O[5]2)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	122.9050	3.041	2	122.9050	9.245	2	122.7475	3.128	4	122.6051	0.958	14	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	3:4:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	C[6,6a]-3:C[6]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6,6a]C[6])(O[5]C[5])2	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]HH)(B[5]O[5]2)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6,6a]C[6])(O[5]C[5])2{2|H<1>,3|C<3>,4|C<4>}	N[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]HH)(B[5]O[5]2){1|H<1>,2|C<4>,4|C<3>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	123.0655	2.343	4	123.0655	5.491	4	123.0655	5.491	4	123.0655	5.491	4	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	4:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	C[6]-4:B[5]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](C[6]C[6,6a]C[6]H)(B[5]O[5]2)(C[6]C[6]H)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	N[6](C[6]C[6,6a]C[6]H)(B[5]O[5]2)(C[6]C[6]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	122.8905	0.539	4	122.8905	0.291	4	122.7683	0.287	6	122.7683	0.287	6	122.7227	1.349	24	122.7227	1.349	24
2	856	976	0:SP2_SP2_SP2	B[5]	N[6]	O[5]	3:2:2:	4:3:3:	3:4:	N[6]-3:O[5]-2:O[5]-2:	C[6]-4:B[5]-3:C[6]-3:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	N[6](C[6]C[6,6a]HH)(B[5]O[5]2)(C[6]C[6]H)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,3|H<1>,4|C<4>}	N[6](C[6]C[6,6a]HH)(B[5]O[5]2)(C[6]C[6]H){1|B<3>,2|C<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	122.5240	0.621	2	122.5240	0.385	2	122.7683	0.287	6	122.7683	0.287	6	122.7227	1.349	24	122.7227	1.349	24
2	863	976	0:SP2_SP2_SP2	B[5]	O	O[5]	4:2:1:	3:	4:3:	C[5]-4:O[5]-2:O-1:	B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O)	O(B[5]C[5]O[5])	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O)	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(O){1|H<1>,3|C<4>}	O(B[5]C[5]O[5])	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O){2|C<4>,5|H<1>}	121.6530	0.000	1	121.6530	0.000	1	121.6530	0.000	1	121.6530	0.000	1	121.6530	0.000	1	121.6530	0.000	1
2	880	976	0:SP2_SP2_SP3	B[5]	Si	O[5]	4:2:2:	3:3:3:3:	4:3:	Si-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](SiC[6a]2B[5])(O[5]C[5])2	Si(C[6a]C[6a]2)2(B[5]O[5]2)2	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2B[5])(O[5]C[5])2{4|C<4>}	Si(C[6a]C[6a]2)2(B[5]O[5]2)2	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	123.8033	7.967	4	123.8033	63.466	4	123.8033	63.466	4	123.8033	63.466	4	123.8572	47.222	10	123.8572	47.222	10
2	880	976	0:SP2_SP2_SP3	B[5]	Si	O[5]	4:2:2:	3:3:3:4:	4:3:	Si-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](SiC[6a]2C)(O[5]C[5])2	Si(C[6a]C[6a]2)2(B[5]O[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2C)(O[5]C[5])2{4|C<4>}	Si(C[6a]C[6a]2)2(B[5]O[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	124.3880	11.076	2	124.3880	122.680	2	124.3880	122.680	2	123.8932	46.917	6	123.8572	47.222	10	123.8572	47.222	10
2	880	976	0:SP2_SP2_SP3	B[5]	Si	O[5]	4:2:2:	3:3:3:4:	4:3:	Si-4:O[5]-2:O[5]-2:	C[6a]-3:C[6a]-3:B[5]-3:Si-4:	C[5]-4:B[5]-3:	B[5](SiC[6a]2Si)(O[5]C[5])2	Si(C[6a]C[6a]2)2(B[5]O[5]2)(SiC3)	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2Si)(O[5]C[5])2{4|C<4>}	Si(C[6a]C[6a]2)2(B[5]O[5]2)(SiC3)	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	123.6458	6.087	4	123.6458	37.056	4	123.6458	37.056	4	123.8932	46.917	6	123.8572	47.222	10	123.8572	47.222	10
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:3:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CCP)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CCP)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.5705	4.230	4	122.5705	17.896	4	122.5705	17.896	4	122.5705	17.896	4	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.0300	4.226	6	123.0300	17.863	6	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CC[6]RhC)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CC[6]RhC)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.1300	5.648	2	123.1300	31.904	2	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CC[6a]CH)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CC[6a]CH)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.3287	1.712	6	122.3287	2.932	6	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CC[6a]HH)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CC[6a]HH)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.8235	2.173	2	122.8235	4.722	2	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CC[6a]PP)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CC[6a]PP)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.6370	4.503	2	122.6370	20.276	2	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CHHN)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CHHN)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.8970	2.088	4	122.8970	4.359	4	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(B[5]O[5]2)(CSiCH)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(B[5]O[5]2)(CSiCH)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.3610	4.107	2	123.3610	16.866	2	122.8185	8.409	24	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:Si-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OSi)	O(B[5]O[5]2)(SiC[5]CC)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OSi){4|C<4>}	O(B[5]O[5]2)(SiC[5]CC)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.0050	1.438	2	123.0050	2.069	2	123.0565	2.318	4	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	3:4:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-3:Si-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OSi)	O(B[5]O[5]2)(SiC[6a]3)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OSi){4|C<4>}	O(B[5]O[5]2)(SiC[6a]3)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.1080	2.208	2	123.1080	4.873	2	123.0565	2.318	4	122.8525	7.428	28	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	B[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OB[5])	O(B[5]C[4]O[5]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OB[5]){4|C<4>}	O(B[5]C[4]O[5]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	124.4210	3.520	2	124.4210	12.390	2	124.4210	12.390	2	123.6762	6.800	6	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	B[6a]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OB[6a])	O(B[6a]C[5a,6a]N[5a,6a]C[6a])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OB[6a]){4|C<4>}	O(B[6a]C[5a,6a]N[5a,6a]C[6a])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	123.8345	3.638	2	123.8345	13.236	2	123.8345	13.236	2	123.6762	6.800	6	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O(CC[6a]B[5]H)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O(CC[6a]B[5]H)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	122.7730	2.363	2	122.7730	5.584	2	122.7730	5.584	2	123.6762	6.800	6	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	2:3:2:	3:1:	4:3:	O[5]-2:C[5]-3:O-2:	B[5]-3:H-1:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH)	O(B[5]C[5]O[5])(H)	O[5](C[5,6,6]C[5,6]C[6,6]C[6])(B[5]C[5]O)	B[5](O[5]C[5,6,6])(C[5]C[5,6]C)(OH){1|H<1>,3|C<4>}	O(B[5]C[5]O[5])(H)	O[5](C[5,6,6]C[5,6]C[6,6]C[6])(B[5]C[5]O){2|C<3>,3|H<1>,4|C<4>}	118.6810	0.000	1	118.6810	0.000	1	118.6810	0.000	1	118.6810	0.000	1	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	3:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	B[5]-3:I[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|F<1>,1|O<2>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O){2|C<3>}	121.8580	0.133	2	121.9480	0.033	3	121.9480	0.033	3	122.4080	1.945	5	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	3:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	B[5]-3:I[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|H<1>,1|O<2>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]O)(I[5]C[5,6a]O){2|C<3>}	122.1280	0.000	1	121.9480	0.033	3	121.9480	0.033	3	122.4080	1.945	5	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	3:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	I[5]-3:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](I[5]C[5,6a]Cl)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(OH){1|Cl<1>,1|F<1>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](I[5]C[5,6a]Cl)(B[5]C[5,6a]O){2|C<3>}	123.0980	2.475	2	123.0980	6.125	2	123.0980	6.125	2	122.4080	1.945	5	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	B[5,5a]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](B[5,5a]C[5,6a]N[5a,6]O[5a])(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,5a])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](B[5,5a]C[5,6a]N[5a,6]O[5a])(B[5]C[5,6a]O){5|C<3>}	122.7370	0.000	1	122.7370	0.000	1	122.7370	0.000	1	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	B[5,6]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](B[5,6]C[5,6a]N[5a,6]O[6])(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5,6])(OH){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](B[5,6]C[5,6a]N[5a,6]O[6])(B[5]C[5,6a]O){5|C<3>}	122.8345	1.081	2	122.8345	1.169	2	122.8345	1.169	2	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	B[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]OO)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]B[5])(OH){1|F<1>,1|O<2>,1|O<3>,2|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](B[5]C[5,6a]OO)(B[5]C[5,6a]O){2|C<3>}	124.2360	0.000	1	124.2360	0.000	1	124.2360	0.000	1	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]CH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]CH)(B[5]C[5,6a]O){2|C<3>}	118.8630	0.000	1	118.8630	0.000	1	121.6794	3.404	9	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|H<1>,3|C<3>}	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]C[6a]H)(B[5]C[5,6a]O){4|C<3>}	124.1720	0.000	1	124.1720	0.000	1	121.6794	3.404	9	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){1|C<4>,2|C<3>,2|H<1>}	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O){2|C<3>}	122.5530	0.000	1	121.7257	2.179	7	121.6794	3.404	9	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OH){2|C<3>,3|H<1>}	O(B[5]C[5,6a]O[5])(H)	O[5](C[5]C[5,6a]HH)(B[5]C[5,6a]O){2|C<3>}	121.5878	1.567	6	121.7257	2.179	7	121.6794	3.404	9	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5,6a]-3:O[5]-2:O-2:	B[5]-3:H-1:	Si[5]-4:B[5]-3:	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH)	O(B[5]C[5,6a]O[5])(H)	O[5](Si[5]C[5,6a]CC)(B[5]C[5,6a]O)	B[5](C[5,6a]C[5,6a]C[6a])(O[5]Si[5])(OH){1|F<1>,2|C<3>,2|C<4>}	O(B[5]C[5,6a]O[5])(H)	O[5](Si[5]C[5,6a]CC)(B[5]C[5,6a]O){2|C<3>}	123.9950	0.000	1	123.9950	0.000	1	123.9950	0.000	1	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	3:2:2:	3:1:	4:3:	C[5]-3:O[5]-2:O-2:	B[5]-3:H-1:	C[5]-4:B[5]-3:	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH)	O(B[5]C[5]O[5])(H)	O[5](C[5]C[5]CC)(B[5]C[5]O)	B[5](C[5]C[6a]C[5])(O[5]C[5])(OH){1|C<2>,2|C<3>,2|C<4>}	O(B[5]C[5]O[5])(H)	O[5](C[5]C[5]CC)(B[5]C[5]O){1|C<2>,1|C<3>}	122.1540	0.000	1	122.1540	0.000	1	122.1540	0.000	1	122.2604	2.803	15	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	4:2:2:	3:1:	4:3:	C[5]-4:O[5]-2:O-2:	B[5]-3:H-1:	C[4,5]-4:B[5]-3:	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH)	O(B[5]C[5]O[5])(H)	O[5](C[4,5]C[4,5]C[4,6]H)(B[5]C[5]O)	B[5](C[5]C[4,5]HH)(O[5]C[4,5])(OH){1|C<3>,1|H<1>,2|C<4>}	O(B[5]C[5]O[5])(H)	O[5](C[4,5]C[4,5]C[4,6]H)(B[5]C[5]O){1|C<3>,2|H<1>,3|C<4>}	121.3160	0.000	1	121.3160	0.000	1	121.3160	0.000	1	118.3553	6.630	3	122.4500	7.003	62	122.4500	7.003	62
2	893	976	0:SP2_SP2_SP2	B[5]	O	O[5]	4:2:2:	3:1:	4:3:	C[5]-4:O[5]-2:O-2:	B[5]-3:H-1:	C[5,6]-4:B[5]-3:	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH)	O(B[5]C[5]O[5])(H)	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O)	B[5](C[5]C[5,6]HH)(O[5]C[5,6])(OH){1|H<1>,3|C<4>}	O(B[5]C[5]O[5])(H)	O[5](C[5,6]C[5,6]C[6]C)(B[5]C[5]O){2|C<4>,5|H<1>}	116.8750	0.334	2	116.8750	0.111	2	116.8750	0.111	2	118.3553	6.630	3	122.4500	7.003	62	122.4500	7.003	62
2	909	976	0:SP2_SP2_SP2	B[5]	S	O[5]	2:2:2:	3:3:	4:3:	O[5]-2:O[5]-2:S-2:	C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(SC[6a])	S(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]S)	B[5](O[5]C[5])2(SC[6a]){4|C<4>}	S(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]S){2|C<4>}	122.2670	5.230	2	122.2670	27.350	2	122.2670	27.350	2	122.2670	27.350	2	122.2670	27.350	2	122.2670	27.350	2
2	921	976	0:SP2_SP2_SP3	B[5]	Se	O[5]	2:2:2:	3:3:	4:3:	O[5]-2:O[5]-2:Se-2:	C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(SeC[6a])	Se(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]Se)	B[5](O[5]C[5])2(SeC[6a]){4|C<4>}	Se(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]Se){2|C<4>}	122.4080	5.783	2	122.4080	33.440	2	122.4080	33.440	2	122.4080	33.440	2	122.4080	33.440	2	122.4080	33.440	2
2	927	976	0:SP2_SP2_SP2	B[5]	B[6a]	O[5]	3:2:2:	3:3:3:	3:4:	B[6a]-3:O[5]-2:O[5]-2:	N[6a]-3:N[6a]-3:B[5]-3:	B[5]-3:C[5]-4:	B[5](B[6a]N[6a]2)(O[5]C[5])2	B[6a](N[6a]C[6a,6a]H)2(B[5]O[5]2)	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	B[5](B[6a]N[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	B[6a](N[6a]C[6a,6a]H)2(B[5]O[5]2){2|C<4>,3|C<3>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	123.7575	2.818	2	123.7575	7.940	2	123.7575	7.940	2	123.7575	7.940	2	123.7575	7.940	2	123.7575	7.940	2
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:2:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:N-2:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CHN)	C(B[5]O[5]2)(NC[6a])(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CHN){4|C<4>}	C(B[5]O[5]2)(NC[6a])(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.6510	0.583	2	122.6510	0.339	2	122.6510	0.339	2	122.6510	0.339	2	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:Br-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CBrC)	C(B[5]O[5]2)(CCH)(Br)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CBrC){4|C<4>}	C(B[5]O[5]2)(CCH)(Br)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.7650	3.958	2	122.7650	15.669	2	122.7650	15.669	2	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CCC)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CCC)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5850	1.479	6	123.5850	2.187	6	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CCH)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2722	3.033	4	123.2722	9.200	4	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CC[3,6]H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CC[3,6]H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1335	0.093	2	123.1335	0.009	2	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CC[6a]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CC[6a]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4685	5.718	2	123.4685	32.700	2	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CC[6a]B)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CC[6a]B)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1893	2.350	8	123.1893	5.521	8	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	C(B[5]O[5]2)(CN[5a]H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	C(B[5]O[5]2)(CN[5a]H)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3850	0.815	6	123.3850	0.664	6	123.3438	4.219	28	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C[6]-3:H-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]H)	C(B[5]O[5]2)(C[6]C[6]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]H){4|C<4>}	C(B[5]O[5]2)(C[6]C[6]2)(H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6280	4.953	2	123.6280	24.528	2	123.6280	24.528	2	123.3254	4.997	32	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:2:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:C-2:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CC[6a]C)(CC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CC[6a]C)(CC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2680	2.380	2	123.2680	5.665	2	123.2680	5.665	2	123.1510	2.201	4	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:2:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:S-2:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCS)	C(B[5]O[5]2)(CC[6a]H)(SC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCS){4|C<4>}	C(B[5]O[5]2)(CC[6a]H)(SC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.0340	0.940	2	123.0340	0.884	2	123.0340	0.884	2	123.1510	2.201	4	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]C)	C(B[5]O[5]2)2(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]C){4|C<4>}	C(B[5]O[5]2)2(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2940	1.435	4	123.2940	2.059	4	123.5990	1.783	6	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]C)	C(B[5]O[5]2)2(CCoC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]C){4|C<4>}	C(B[5]O[5]2)2(CCoC)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	124.2090	1.273	2	124.2090	1.620	2	123.5990	1.783	6	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CC[6a]Te)(CC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CC[6a]Te)(CC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1660	3.435	2	123.1660	11.800	2	123.1660	11.800	2	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[6a]C)	C(B[6a]N[6a]2)(B[5]O[5]2)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[6a]C){4|C<4>}	C(B[6a]N[6a]2)(B[5]O[5]2)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4840	2.758	2	123.4840	7.605	2	123.4840	7.605	2	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(CB[5a]C[6a])(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(CB[5a]C[6a])(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5430	2.331	2	123.5430	5.432	2	123.5430	5.432	2	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CBH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CBH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3466	1.311	12	123.3466	1.720	12	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CCC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCC)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.7040	0.007	2	123.7040	0.000	2	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.0663	1.157	6	123.0663	1.339	6	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]Br)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]Br)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.7345	1.892	2	122.7345	3.578	2	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]H)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.2705	0.575	10	123.2705	0.331	10	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]Si)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]Si)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1280	1.687	6	123.1280	2.846	6	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(B[5]O[5]2)(CHS)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(CHS)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5310	0.949	2	123.5310	0.900	2	123.2492	1.251	40	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[6a]-3:C-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	C(C[6a]C[6a]2)(CC[6a]B[5])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	C(C[6a]C[6a]2)(CC[6a]B[5])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.1227	0.584	4	123.1227	0.341	4	123.1227	0.341	4	123.2936	1.537	56	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CC[3]H)(CCCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CC[3]H)(CCCH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5055	0.631	6	123.5055	0.398	6	123.5449	0.305	8	123.5605	3.038	16	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CC[6a]H)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CC[6a]H)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6630	0.328	2	123.6630	0.108	2	123.5449	0.305	8	123.5605	3.038	16	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-3:Si-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CSiC)	C(B[5]O[5]2)(CC[6a]H)(SiC3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CSiC){4|C<4>}	C(B[5]O[5]2)(CC[6a]H)(SiC3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3080	1.930	2	123.3080	3.726	2	123.3080	3.726	2	123.5605	3.038	16	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]C)	C(B[5]O[5]2)(C[5]C[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]C){4|C<4>}	C(B[5]O[5]2)(C[5]C[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6655	2.811	6	123.6655	7.904	6	123.6655	7.904	6	123.5605	3.038	16	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CB[6a]HH)(CC[6a]2)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CB[6a]HH)(CC[6a]2)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3410	2.638	2	123.3410	6.956	2	123.3430	3.926	10	123.3430	3.926	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CCHH)(CHO)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CCHH)(CHO)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.5040	0.283	2	123.5040	0.080	2	123.3430	3.926	10	123.3430	3.926	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CC[6a]CC)(CHH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CC[6a]CC)(CHH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3745	0.841	2	123.3745	0.707	2	123.3430	3.926	10	123.3430	3.926	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CH3)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CH3)(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.6045	5.129	2	123.6045	26.303	2	123.3430	3.926	10	123.3430	3.926	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:C-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(B[5]O[5]2)(CHHS)(CHH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(B[5]O[5]2)(CHHS)(CHH)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	122.8910	0.827	2	122.8910	0.684	2	123.3430	3.926	10	123.3430	3.926	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	2:2:3:	4:3:1:	4:3:	O[5]-2:O[5]-2:C-3:	C-4:B[5]-3:C-1:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	C(CC[6a]B[5]C)(B[5]O[5]2)(C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	C(CC[6a]B[5]C)(B[5]O[5]2)(C)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.3670	0.431	4	123.3670	0.185	4	123.3670	0.185	4	123.3670	0.185	4	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	3:2:2:	3:3:3:	4:3:	C-3:O[5]-2:O[5]-2:	C[5a]-3:C[5]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[5a]C[5])(O[5]C[5])2	C(C[5a]C[5a]N[5a])(C[5]C[5]N[5])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[5a]C[5])(O[5]C[5])2{4|C<4>}	C(C[5a]C[5a]N[5a])(C[5]C[5]N[5])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4045	0.919	2	123.4045	0.844	2	123.4045	0.844	2	123.4781	1.684	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	3:2:2:	3:3:3:	4:3:	C-3:O[5]-2:O[5]-2:	C[6a]-3:B[5]-3:C[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]C[5])(O[5]C[5])2	C(C[6a]C[6a]2)(B[5]O[5]2)(C[5]C[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]C[5])(O[5]C[5])2{4|C<4>}	C(C[6a]C[6a]2)(B[5]O[5]2)(C[5]C[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	123.4965	1.429	8	123.4965	2.043	8	123.4965	2.043	8	123.4781	1.684	10	123.3943	2.992	135	123.3943	2.992	135
2	930	976	0:SP2_SP2_SP2	B[5]	C	O[5]	3:2:3:	3:3:3:	4:3:	O[5]-3:O[5]-2:C-3:	B[5]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5]Co)(O[5]C[5])(CB[5]C)	C(B[5]O[5]2)2(CCoC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5]Co)(O[5]C[5])(CB[5]C){4|C<4>}	C(B[5]O[5]2)2(CCoC)	O[5](C[5]C[5]CC)(B[5]O[5]C){1|Co<5>,2|C<4>}	130.8250	0.000	1	130.8250	0.000	1	130.8250	0.000	1	130.8250	0.000	1	123.3943	2.992	135	123.3943	2.992	135
2	941	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:2:	3:3:	4:3:	O[5]-2:O[5]-2:N-2:	B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC)	N(B[5]O[5]2)(CC[6a]Rh)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC){4|C<4>}	N(B[5]O[5]2)(CC[6a]Rh)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	124.1407	0.220	3	124.1407	0.048	3	124.1407	0.048	3	124.1407	0.048	3	124.1407	0.048	3	124.1407	0.048	3
2	951	976	0:SP2_SP-NON_SP2	B[5]	H	O[5]	3:2:1:	3:	3:3:	O[5]-3:O[5]-2:H-1:	B[5]-3:	C[5,6a]-3:B[5]-3:	B[5](O[5]C[5,6a]Zr)(O[5]C[5,6a])(H)	H(B[5]O[5]2)	O[5](C[5,6a]C[5,6a]C[6a])(B[5]O[5]H)	B[5](O[5]C[5,6a]Zr)(O[5]C[5,6a])(H){2|C<3>}	H(B[5]O[5]2)	O[5](C[5,6a]C[5,6a]C[6a])(B[5]O[5]H){1|Zr<6>,1|H<1>,2|C<3>}	128.4710	0.000	1	128.4710	0.000	1	128.4710	0.000	1	128.4710	0.000	1	128.4710	0.000	1	128.4710	0.000	1
2	955	956	0:SP2_SP2_SP3	B[5]	P[5]	N	3:4:3:	3:3:3:3:	3:3:3:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a]-3:B[5]-3:C[6a]-3:C[6a]-3:	B[5]-3:C[6a]-3:C[6a]-3:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]2)2	N(B[5]C[5,6a]P[5])(C[6a]C[6a]2)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]C[6a]2)(NC[6a]2){1|H<1>,7|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(C[6a]C[6a]2)2{5|H<1>,7|C<3>}	N(B[5]C[5,6a]P[5])(C[6a]C[6a]2)2	122.9000	0.000	1	122.9000	0.000	1	122.9000	0.000	1	122.9000	0.000	1	122.2400	0.871	2	122.2400	0.871	2
2	955	956	0:SP2_SP2_SP3	B[5]	P[5]	N	3:4:3:	3:3:4:4:	3:4:4:	C[5,6a]-3:P[5]-4:N-3:	C[5,6a]-3:B[5]-3:C-4:C-4:	B[5]-3:C-4:C-4:	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC)	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(CCCH)2	N(B[5]C[5,6a]P[5])(CCCH)2	B[5](C[5,6a]C[5,6a,6a]C[6a])(P[5]C[5,6a]CC)(NCC){1|H<1>,3|C<3>}	P[5](C[5,6a]C[5,6a,6a]C[6a])(B[5]C[5,6a]N)(CCCH)2{1|H<1>,3|C<3>}	N(B[5]C[5,6a]P[5])(CCCH)2	121.5800	0.000	1	121.5800	0.000	1	121.5800	0.000	1	121.5800	0.000	1	122.2400	0.871	2	122.2400	0.871	2
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:2:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:P-3:N-2:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NNP)	N(B[5]O[5]2)(PC[6a]2)(NC)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NNP){4|C<4>}	N(B[5]O[5]2)(PC[6a]2)(NC)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.8115	0.067	2	122.8115	0.005	2	122.8115	0.005	2	122.8115	0.005	2	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6]H)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6]H)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.2625	0.749	2	123.2625	0.561	2	123.3634	4.164	16	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]B)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]B)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.8040	2.458	8	123.8040	6.044	8	123.3634	4.164	16	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.1800	3.709	2	123.1800	13.760	2	123.3634	4.164	16	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CHO)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CHO)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.3405	0.136	2	122.3405	0.019	2	123.3634	4.164	16	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CNP)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CNP)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.9085	1.290	2	122.9085	1.665	2	123.3634	4.164	16	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:C-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(CC[6a]C[6])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(CC[6a]C[6])(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.3260	2.694	2	123.3260	7.258	2	123.3260	7.258	2	123.3593	4.101	18	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NB[5]C)	N(B[5]O[5]2)2(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NB[5]C){4|C<4>}	N(B[5]O[5]2)2(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.4008	2.603	4	123.4008	6.777	4	123.3524	3.658	16	123.3072	2.930	22	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NB[5]C)	N(B[5]O[5]2)2(CCHH)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NB[5]C){4|C<4>}	N(B[5]O[5]2)2(CCHH)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.3363	1.772	12	123.3363	3.139	12	123.3524	3.658	16	123.3072	2.930	22	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CH3)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.3095	2.498	2	123.3095	6.241	2	123.1865	1.306	6	123.3072	2.930	22	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:3:4:	4:3:	O[5]-2:O[5]-2:N-3:	C[6a]-3:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	N(C[6a]C[6a]2)(B[5]O[5]2)(CHHO)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	N(C[6a]C[6a]2)(B[5]O[5]2)(CHHO)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.1250	0.285	4	123.1250	0.081	4	123.1865	1.306	6	123.3072	2.930	22	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	N(B[5]O[5]2)(CC3)(CBC)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	N(B[5]O[5]2)(CC3)(CBC)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.9830	0.334	2	123.9830	0.111	2	123.2163	3.012	10	123.2163	3.012	10	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	N(B[5]O[5]2)(CC3)(CHN)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	N(B[5]O[5]2)(CC3)(CHN)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.7430	3.984	2	123.7430	15.871	2	123.2163	3.012	10	123.2163	3.012	10	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	N(B[5]O[5]2)(CC3)(COP)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	N(B[5]O[5]2)(CC3)(COP)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.4140	0.810	2	122.4140	0.657	2	123.2163	3.012	10	123.2163	3.012	10	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	N(B[5]O[5]2)(CCCH)(CNP)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	N(B[5]O[5]2)(CCCH)(CNP)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.2430	0.822	2	123.2430	0.675	2	123.2163	3.012	10	123.2163	3.012	10	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	3:4:3:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:C-4:C-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	N(B[5]O[5]2)(CCHH)(COP)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	N(B[5]O[5]2)(CCHH)(COP)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.6985	2.497	2	122.6985	6.234	2	123.2163	3.012	10	123.2163	3.012	10	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	2:2:3:	5:3:4:	4:3:	O[5]-2:O[5]-2:N-3:	Nb[6]-5:B[5]-3:C-4:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NNb[6]C)	N(Nb[6]N[6]2NO)(B[5]O[5]2)(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NNb[6]C){4|C<4>}	N(Nb[6]N[6]2NO)(B[5]O[5]2)(CC3)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	124.1303	0.640	4	124.1303	0.410	4	124.1303	0.410	4	124.1303	0.410	4	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	3:2:2:	3:3:3:	4:3:	N-3:O[5]-2:O[5]-2:	C[5]-3:C[6a]-3:B[5]-3:	C[5]-4:B[5]-3:	B[5](NC[6a]C[5])(O[5]C[5])2	N(C[5]C[5,6a]C[5,6])(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](NC[6a]C[5])(O[5]C[5])2{4|C<4>}	N(C[5]C[5,6a]C[5,6])(C[6a]C[6a]2)(B[5]O[5]2)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	123.4955	1.585	2	123.4955	2.511	2	123.4955	2.511	2	123.4955	2.511	2	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	3:2:3:	3:4:4:	4:3:	C[5]-3:O[5]-2:N-3:	B[5]-3:C-4:C-4:	C[5]-4:B[5]-3:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	N(B[5]C[5]O[5])(CCCH)2	O[5](C[5]C[5]CC)(B[5]C[5]N)	B[5](C[5]C[5]C)(O[5]C[5])(NCC){2|C<4>,2|H<1>}	N(B[5]C[5]O[5])(CCCH)2	O[5](C[5]C[5]CC)(B[5]C[5]N){1|C<3>,2|H<1>}	116.9855	0.982	2	116.9855	0.965	2	117.1950	0.614	3	117.1950	0.614	3	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP2	B[5]	N	O[5]	3:2:3:	3:4:4:	4:3:	C[5]-3:O[5]-2:N-3:	B[5]-3:C-4:C-4:	C[5]-4:B[5]-3:	B[5](C[5]C[5]C)(O[5]C[5])(NCC)	N(B[5]C[5]O[5])(CCCH)2	O[5](C[5]C[5]HH)(B[5]C[5]N)	B[5](C[5]C[5]C)(O[5]C[5])(NCC){4|H<1>}	N(B[5]C[5]O[5])(CCCH)2	O[5](C[5]C[5]HH)(B[5]C[5]N){1|C<3>,2|H<1>}	117.6140	0.000	1	117.6140	0.000	1	117.1950	0.614	3	117.1950	0.614	3	123.0510	4.580	61	123.0510	4.580	61
2	956	976	0:SP2_SP2_SP3	B[5]	N	O[5]	2:2:3:	3:3:2:	4:3:	O[5]-2:O[5]-2:N-3:	B[5]-3:P-3:N-2:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NNP)	N(B[5]O[5]2)(PC[6a]2)(NC)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NNP){4|C<4>}	N(B[5]O[5]2)(PC[6a]2)(NC)	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	122.8795	0.831	2	122.8795	0.690	2	122.8795	0.690	2	122.8795	0.690	2	122.8795	0.690	2	122.8795	0.690	2
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:C-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	115.1285	0.320	4	115.1285	0.102	4	115.1285	0.102	4	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:N-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	111.2080	0.457	2	111.2080	0.209	2	111.2080	0.209	2	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OB[5])	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OB[5]){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	111.1580	0.000	1	111.1580	0.000	1	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OB[6a])	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OB[6a]){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	112.3300	0.000	1	112.3300	0.000	1	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OC)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	114.4194	0.718	15	114.4194	0.515	15	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OCu)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OCu){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	110.5190	0.000	1	110.5190	0.000	1	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OMg)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OMg){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	109.3685	0.037	2	109.3685	0.001	2	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(ORe)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(ORe){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	113.5740	0.000	1	113.5740	0.000	1	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(ORh)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(ORh){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	109.4950	0.724	2	109.4950	0.524	2	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:O-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OSi)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OSi){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	113.8860	0.144	2	113.8860	0.021	2	113.1748	4.169	25	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:S-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(SC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]S)	O[5](C[5]C[5]CC)(B[5]O[5]S)	B[5](O[5]C[5])2(SC[6a]){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]S){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]S){2|C<4>}	115.4370	0.000	1	115.4370	0.000	1	113.7130	5.944	2	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:S-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(SOs)	O[5](C[5]C[5]CC)(B[5]O[5]S)	O[5](C[5]C[5]CC)(B[5]O[5]S)	B[5](O[5]C[5])2(SOs){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]S){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]S){2|C<4>}	111.9890	0.000	1	111.9890	0.000	1	113.7130	5.944	2	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:2:	4:3:	4:3:	O[5]-2:O[5]-2:Se-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(SeC[6a])	O[5](C[5]C[5]CC)(B[5]O[5]Se)	O[5](C[5]C[5]CC)(B[5]O[5]Se)	B[5](O[5]C[5])2(SeC[6a]){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Se){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Se){2|C<4>}	115.1740	0.000	1	115.1740	0.000	1	115.1740	0.000	1	113.3794	4.020	34	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.7347	1.007	3	112.7347	1.013	3	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[6a]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.6250	0.000	1	112.6250	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CBrC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CBrC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	114.4610	0.000	1	114.4610	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.1474	0.499	13	113.1474	0.249	13	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.1986	0.443	14	113.1986	0.196	14	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCS)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCS){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.8520	0.000	1	113.8520	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.5007	0.291	3	112.5007	0.085	3	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]H)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]H){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.6800	0.000	1	112.6800	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]Te)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]Te){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.7630	1.059	2	113.7630	1.122	2	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6a]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.3719	0.502	23	113.3719	0.252	23	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CHN)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CHN){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	114.6680	0.000	1	114.6680	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CRhC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CRhC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	111.7710	0.000	1	111.7710	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CSiC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CSiC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.5490	0.000	1	112.5490	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CTeC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CTeC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.2430	0.365	2	113.2430	0.133	2	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CZrC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CZrC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.6560	0.000	1	112.6560	0.000	1	113.2093	0.381	68	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[5,6,6]-4:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5])	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,2|H<1>,4|C<4>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	113.0720	0.000	1	113.6600	0.691	2	113.6600	0.691	2	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:C[6a]-3:	C[5,6,6]-4:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5])	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5])	B[5](O[5]C[5,6,6])2(C[6a]C[6a]2){2|C<3>,3|C<4>,3|H<1>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[6a]O[5]){2|C<3>,2|H<1>,3|C<4>}	114.2480	0.000	1	113.6600	0.691	2	113.6600	0.691	2	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NB[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NB[5]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	113.2726	0.222	8	113.2726	0.049	8	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NCC)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NCC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	113.5122	1.269	5	113.5122	1.609	5	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NC[6a]C)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NC[6a]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	113.3603	0.940	12	113.3603	0.883	12	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NNP)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NNP){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	114.2345	0.134	2	114.2345	0.018	2	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NNb[6]C)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NNb[6]C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	111.6530	0.443	2	111.6530	0.196	2	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:N-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(NTiN)	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](O[5]C[5])2(NTiN){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	112.1330	0.000	1	112.1330	0.000	1	113.2658	0.879	30	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:O-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(OMg2)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(OMg2){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	111.8760	0.000	1	111.8760	0.000	1	111.9755	0.020	2	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:3:	4:3:	4:3:	O[5]-2:O[5]-2:O-3:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(ORh2)	O[5](C[5]C[5]CC)(B[5]O[5]O)	O[5](C[5]C[5]CC)(B[5]O[5]O)	B[5](O[5]C[5])2(ORh2){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]O){2|C<4>}	112.0750	0.000	1	112.0750	0.000	1	111.9755	0.020	2	113.2105	0.547	102	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	3:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	B[5]-3:C[5]-3:	B[5](O[5]C[5])2(CCHH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](B[5]O[5]C)(C[5]C[5]C)	B[5](O[5]C[5])2(CCHH){3|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){1|C<4>}	O[5](B[5]O[5]C)(C[5]C[5]C){2|C<4>}	112.9630	0.000	1	112.9630	0.000	1	112.9630	0.000	1	112.9630	0.000	1	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	B[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]B[5])(O[5]C[5])(CCHH)	O[5](B[5]C[6a]2C[5])(B[5]O[5]C)	O[5](C[5]C[6a]B[5]H)(B[5]O[5]C)	B[5](O[5]B[5])(O[5]C[5])(CCHH){1|H<1>,3|C<3>}	O[5](B[5]C[6a]2C[5])(B[5]O[5]C){1|H<1>,5|C<3>}	O[5](C[5]C[6a]B[5]H)(B[5]O[5]C){4|C<3>}	117.0470	0.000	1	117.0470	0.000	1	117.0470	0.000	1	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[3x5]-4:B[5]-3:	C[3x5]-4:B[5]-3:	B[5](O[5]C[3x5])2(CH3)	O[5](C[3x5]C[3x5]C[5,6]C[5])(B[5]O[5]C)	O[5](C[3x5]C[5,6,6]C[3x5]C[5])(B[5]O[5]C)	B[5](O[5]C[3x5])2(CH3){1|C<3>,3|C<4>}	O[5](C[3x5]C[3x5]C[5,6]C[5])(B[5]O[5]C){1|H<1>,1|O<2>,2|C<3>,4|C<4>}	O[5](C[3x5]C[5,6,6]C[3x5]C[5])(B[5]O[5]C){1|C<3>,1|O<2>,5|C<4>}	113.6240	0.000	1	113.6240	0.000	1	113.6240	0.000	1	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](O[5]C[5,5])2(CC[6a]CH)	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C)	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C)	B[5](O[5]C[5,5])2(CC[6a]CH){2|C<3>,2|C<4>}	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C){1|C<4>,3|C<3>}	O[5](C[5,5]C[5,6a]C[5,5]C)(B[5]O[5]C){1|C<4>,3|C<3>}	114.7805	0.179	2	114.7805	0.032	2	114.7805	0.032	2	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5,6,6]-4:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(CCHN)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]O[5]C)	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]O[5]C)	B[5](O[5]C[5,6,6])2(CCHN){1|H<1>,3|C<4>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]O[5]C){2|H<1>,3|C<4>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]O[5]C){2|H<1>,3|C<4>}	114.0850	0.000	1	114.0850	0.000	1	114.0850	0.000	1	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CBCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CBCH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.1740	0.000	1	112.1740	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]2C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]2C){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.8800	0.395	3	112.8800	0.156	3	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CB[5]CH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CB[5]CH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.6070	0.111	4	112.6070	0.012	4	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.1296	0.757	11	113.1296	0.573	11	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCCH)	O[5](C[5]C[5]CH)(B[5]O[5]C)	O[5](C[5]C[5]CH)(B[5]O[5]C)	B[5](O[5]C[5])2(CCCH){2|C<4>,2|H<1>}	O[5](C[5]C[5]CH)(B[5]O[5]C){1|C<4>,1|H<1>}	O[5](C[5]C[5]CH)(B[5]O[5]C){1|C<4>,1|H<1>}	113.4747	0.588	3	113.4747	0.346	3	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.0043	0.734	13	113.0043	0.539	13	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CCHH)	O[5](C[5]C[5]HH)(B[5]O[5]C)	O[5](C[5]C[5]HH)(B[5]O[5]C)	B[5](O[5]C[5])2(CCHH){4|H<1>}	O[5](C[5]C[5]HH)(B[5]O[5]C){2|H<1>}	O[5](C[5]C[5]HH)(B[5]O[5]C){2|H<1>}	113.5040	0.000	1	113.5040	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[4]HH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[4]HH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.8560	0.000	1	112.8560	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]CH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]CH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.4218	0.245	4	113.4218	0.060	4	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[5]HH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[5]HH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.5835	0.735	2	112.5835	0.540	2	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]CH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]CH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.5772	1.017	4	112.5772	1.034	4	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CC[6]HH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CC[6]HH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.0800	0.000	1	113.0800	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CHII)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CHII){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	114.3410	0.000	1	114.3410	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C-4:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](O[5]C[5])2(CN[5]CH)	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](O[5]C[5])2(CN[5]CH){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.5390	0.000	1	113.5390	0.000	1	113.0326	0.477	50	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C[5]-4:	C[5,6,6]-4:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[5]C[5]2Fe)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[5]O[5])	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[5]O[5])	B[5](O[5]C[5,6,6])2(C[5]C[5]2Fe){2|H<1>,6|C<4>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[5]O[5]){1|Fe<10>,2|H<1>,5|C<4>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[5]O[5]){1|Fe<10>,2|H<1>,5|C<4>}	113.4010	0.000	1	114.6487	1.033	6	114.6487	1.033	6	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	2:2:4:	4:3:	4:3:	O[5]-2:O[5]-2:C[5]-4:	C[5,6,6]-4:B[5]-3:	C[5,6,6]-4:B[5]-3:	B[5](O[5]C[5,6,6])2(C[5]C[5]2Fe)	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[5]O[5])	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[5]O[5])	B[5](O[5]C[5,6,6])2(C[5]C[5]2Fe){3|H<1>,5|C<4>}	O[5](C[5,6,6]C[4,6,6]C[5,6,6]C)(B[5]C[5]O[5]){1|Fe<10>,2|H<1>,5|C<4>}	O[5](C[5,6,6]C[5,6,6]C[6,6]H)(B[5]C[5]O[5]){1|Fe<10>,2|H<1>,5|C<4>}	114.8982	0.908	5	114.6487	1.033	6	114.6487	1.033	6	113.3416	1.035	61	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:3:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-3:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]C)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|H<1>,2|C<3>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,1|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]C){1|Se<2>,1|C<3>,2|C<4>}	112.3910	0.000	1	112.3910	0.000	1	112.3910	0.000	1	112.3910	0.000	1	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]N[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]N[5]2)(O[5]C[5])2{8|C<4>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	111.6945	0.032	2	111.6945	0.001	2	112.7836	0.626	8	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]O[5]2)(O[5]C[5])2{6|C<4>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){2|C<4>,2|O<2>}	113.3420	0.000	1	113.3420	0.000	1	112.7836	0.626	8	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CH)	O[5](B[5]B[5]O[5])(C[5]C[5]CH)	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]CH){1|C<3>,1|H<1>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]CH){1|C<3>,1|H<1>,2|O<2>}	113.0195	0.583	4	113.0195	0.340	4	112.7836	0.626	8	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	B[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<4>,4|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){2|H<1>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){2|H<1>,2|O<2>}	113.4600	0.000	1	113.4600	0.000	1	112.7836	0.626	8	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	B[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[6a]N[6a]2)(O[5]C[5])2	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	B[5](B[6a]N[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){2|C<4>,2|N<3>}	112.4620	0.000	1	112.4620	0.000	1	112.4620	0.000	1	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6]2)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6]2)(O[5]C[5])2{4|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	111.9400	0.000	1	111.9400	0.000	1	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6]Se[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6]Se[5])(O[5]C[5])2{2|C<3>,5|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	113.8065	0.086	2	113.8065	0.007	2	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5])(O[5]C[5])2{4|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.5180	0.000	1	113.5180	0.000	1	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.1640	0.000	1	113.4330	0.078	3	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2)(O[5]C[5])2{1|Se<2>,1|C<3>,2|B<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.5675	0.218	2	113.4330	0.078	3	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|B<3>,2|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	114.0425	0.260	2	113.9420	0.064	3	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]Se[5]C[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]Se[5]C[5])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Se<2>,1|C<3>,2|C<4>}	113.7410	0.000	1	113.9420	0.064	3	113.5196	0.390	10	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2{1|O<2>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	114.1890	0.000	1	114.1107	0.019	3	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6]S[5a])(O[5]C[5])2{2|C<3>,5|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	114.0715	0.170	2	114.1107	0.019	3	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6a]C[5,5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6a]C[5,5a])(O[5]C[5])2{4|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.8420	0.000	1	113.8420	0.000	1	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a,6a]C[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a,6a]C[5a])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.3025	1.179	2	114.3025	1.389	2	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]2)(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.6680	0.000	2	113.6680	0.000	2	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|Br<1>,1|C<3>,1|N<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	113.8270	0.000	1	114.3102	0.265	4	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|Cl<1>,1|C<3>,1|N<2>,5|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	114.4840	0.000	1	114.3102	0.265	4	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|H<1>,1|N<2>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	114.9560	0.000	1	114.3102	0.265	4	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]N[5a])(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	113.9740	0.000	1	114.3102	0.265	4	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]O[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]O[5a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|O<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|O<2>,2|C<4>}	114.7960	0.000	1	114.7960	0.000	1	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	114.0475	0.084	2	113.9262	0.044	8	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{2|C<3>,5|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	114.0180	0.342	2	113.9262	0.044	8	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	O[5](B[5]C[5a]O[5])(C[5]C[5]CC)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{3|C<3>,4|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CC){1|C<3>,1|S<2>,2|C<4>}	113.8197	0.174	4	113.9262	0.044	8	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[5a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2	O[5](B[5]C[5a]O[5])(C[5]C[5]CH)	O[5](B[5]C[5a]O[5])(C[5]C[5]CH)	B[5](C[5a]C[5a]S[5a])(O[5]C[5])2{2|C<3>,2|C<4>,3|H<1>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CH){1|C<3>,1|C<4>,1|H<1>,1|S<2>}	O[5](B[5]C[5a]O[5])(C[5]C[5]CH){1|C<3>,1|C<4>,1|H<1>,1|S<2>}	114.0680	0.000	1	114.0680	0.000	1	114.0741	0.188	22	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6,6])(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6,6])(O[5]C[5])2{9|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	112.9790	0.000	1	112.9790	0.000	1	114.0090	1.142	6	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]C[6])(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]C[6])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	112.9230	0.000	1	112.9230	0.000	1	114.0090	1.142	6	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.5380	0.885	4	114.5380	0.783	4	114.0090	1.142	6	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[5,6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5,6a]2)(O[5]C[5])2{1|Se<2>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	111.8930	0.000	1	111.8930	0.000	1	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[5a,6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5a,6a]2)(O[5]C[5])2{1|S<2>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	112.5555	0.047	2	112.5555	0.002	2	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.1633	0.591	3	113.1633	0.349	3	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.9893	0.122	3	113.9893	0.015	3	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|B<3>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.6820	0.483	4	113.2499	0.795	14	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.2780	0.000	1	113.2499	0.795	14	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	112.8633	1.110	7	113.2499	0.795	14	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a,6a]C[6a])(O[5]C[5])2{1|O<2>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.7245	0.012	2	113.2499	0.795	14	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Bi<5>,1|F<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.9860	0.221	3	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Br<1>,1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	112.1990	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<2>,1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.8783	0.846	3	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<3>,1|H<1>,1|N<2>,1|O<2>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.2950	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<3>,1|N<2>,2|H<1>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.5180	0.000	2	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|Cl<1>,1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	112.3130	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|F<1>,1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.9784	0.205	5	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.2746	0.591	10	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|O<2>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.2510	0.086	2	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,1|P<4>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.1260	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,2|C<3>,5|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.2923	0.620	20	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.1360	0.553	12	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|N<3>,1|O<2>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.7545	0.013	2	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|Br<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.0390	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.7240	0.535	83	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,6|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	113.6790	0.000	1	113.6047	0.370	148	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]HH)	O[5](B[5]C[6a]O[5])(C[5]C[5]HH)	B[5](C[6a]C[6a]2)(O[5]C[5])2{2|C<3>,6|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>}	O[5](B[5]C[6a]O[5])(C[5]C[5]HH){2|C<3>,2|H<1>}	114.0593	0.535	3	114.0593	0.286	3	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	C[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6a]C[6a]N[6a])(O[5]C[5])2	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	O[5](B[5]C[6a]O[5])(C[5]C[5]CC)	B[5](C[6a]C[6a]N[6a])(O[5]C[5])2{1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	O[5](B[5]C[6a]O[5])(C[5]C[5]CC){1|C<3>,1|N<2>,2|C<4>}	113.9460	0.000	1	113.9460	0.000	1	113.5633	0.427	175	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6,6a]C[6])(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6,6a]C[6])(O[5]C[5])2{2|H<1>,3|C<3>,4|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	113.8680	0.199	2	113.8680	0.040	2	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{1|H<1>,3|C<3>,4|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.1390	0.000	1	114.6535	0.174	8	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.9357	0.211	4	114.6535	0.174	8	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	114.1975	0.016	2	114.6535	0.174	8	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6]2)(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]2)(O[5]C[5])2{2|C<3>,3|H<1>,4|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,3|C<4>}	114.9510	0.000	1	114.6535	0.174	8	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6]C[6]N[6])(O[5]C[5])2	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	O[5](B[5]N[6]O[5])(C[5]C[5]CC)	B[5](N[6]C[6]N[6])(O[5]C[5])2{1|B<3>,1|H<1>,2|C<3>,4|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	O[5](B[5]N[6]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,2|C<4>}	114.7580	0.000	1	114.7580	0.000	1	114.5202	0.231	11	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	3:4:	3:4:	N[6a]-3:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](N[6a]C[6a]2)(O[5]C[5])2	O[5](B[5]N[6a]O[5])(C[5]C[5]CC)	O[5](B[5]N[6a]O[5])(C[5]C[5]CC)	B[5](N[6a]C[6a]2)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]N[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	O[5](B[5]N[6a]O[5])(C[5]C[5]CC){2|C<3>,2|C<4>}	114.8020	0.000	1	114.8020	0.000	1	114.8020	0.000	1	113.6398	0.504	234	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	3:4:	B[5]-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	B[5]-3:C[5]-4:	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5])	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]O[5]2)(O[5]C[5])2{1|C<3>,2|C<4>,3|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5]){2|C<3>,2|H<1>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){1|C<3>,1|H<1>,2|O<2>}	113.1620	0.128	4	113.1620	0.016	4	113.1620	0.016	4	113.1620	0.016	4	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	B[5]-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](B[5]O[5]2)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5])	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5])	B[5](B[5]O[5]2)(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5]){1|H<1>,2|O<2>,3|C<3>}	O[5](C[5]C[6a]C[5]H)(B[5]B[5]O[5]){1|H<1>,2|O<2>,3|C<3>}	113.5790	0.400	4	113.5790	0.160	4	113.5790	0.160	4	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[5a]C[5])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[5a]C[5])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.1530	0.000	1	113.1530	0.000	1	113.0166	0.281	5	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]C[5])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]C[5])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.9825	0.606	4	112.9825	0.367	4	113.0166	0.281	5	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[5a,6a]C[6a])(O[5]C[5,5])2{1|C<4>,1|N<2>,3|C<3>,3|H<1>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	113.8500	0.054	2	113.8500	0.003	2	113.5952	0.696	18	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	O[5](C[5,5]C[5,5]C[5,6]H)(B[5]C[6a]O[5])	O[5](C[5,5]C[5,5]O[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,2|C<3>,4|H<1>}	O[5](C[5,5]C[5,5]C[5,6]H)(B[5]C[6a]O[5]){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	O[5](C[5,5]C[5,5]O[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>}	113.1246	1.104	7	113.1246	1.220	7	113.5952	0.696	18	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5])	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{2|C<3>,2|N<3>,4|H<1>}	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5]){1|H<1>,1|N<3>,4|C<3>}	O[5](C[5,5]C[5,5]N[5]H)(B[5]C[6a]O[5]){1|H<1>,1|N<3>,4|C<3>}	113.0420	0.000	1	113.0420	0.000	1	113.5952	0.696	18	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,1|O<2>,3|C<3>,3|H<1>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	113.8663	0.545	4	114.0124	0.162	8	113.5952	0.696	18	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,5])2	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5])	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,5])2{1|C<4>,3|C<3>,4|H<1>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[6a]O[5]){1|H<1>,2|C<4>,4|C<3>}	114.1585	0.157	4	114.0124	0.162	8	113.5952	0.696	18	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,6]-4:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|C<4>,1|N<3>,1|S<2>,2|C<3>,2|H<1>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	113.8310	0.000	1	113.8310	0.000	1	113.5727	0.049	4	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,6]-4:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	O[5](C[5,6]C[5,6]O[6]C)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|O<2>,2|C<3>,2|C<4>,3|H<1>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>,2|O<2>}	O[5](C[5,6]C[5,6]O[6]C)(B[5]C[6a]O[5]){1|H<1>,2|C<3>,2|C<4>}	113.3540	0.000	1	113.3540	0.000	1	113.5727	0.049	4	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,6]-4:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{2|C<3>,2|C<4>,4|H<1>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	O[5](C[5,6]C[5,6]2H)(B[5]C[6a]O[5]){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	113.6800	0.000	1	113.6800	0.000	1	113.5727	0.049	4	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5,6]-4:B[5]-3:	C[5,6]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5,6])2	O[5](C[5,6]C[6,6a]C[5,6]H)(B[5]C[6a]O[5])	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5,6])2{1|C<4>,3|C<3>,4|H<1>}	O[5](C[5,6]C[6,6a]C[5,6]H)(B[5]C[6a]O[5]){1|C<4>,1|H<1>,4|C<3>}	O[5](C[5,6]C[5,6]C[6]H)(B[5]C[6a]O[5]){3|H<1>,4|C<3>}	113.4260	0.000	1	113.4260	0.000	1	113.5727	0.049	4	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	C[6a]-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[6a]C[6a]2)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5])	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5])	B[5](C[6a]C[6a]2)(O[5]C[5])2{1|C<4>,3|H<1>,4|C<3>}	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5]){1|H<1>,5|C<3>}	O[5](C[5]C[6a]C[5]H)(B[5]C[6a]O[5]){1|H<1>,5|C<3>}	113.2270	0.000	1	113.2270	0.000	1	113.2270	0.000	1	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	N-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](NC[6a]C[5])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](NC[6a]C[5])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	113.0020	0.000	1	113.0020	0.000	1	110.9157	3.266	3	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	3:2:2:	4:3:	4:3:	N-3:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](NC[6a]Rh)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]N)	O[5](C[5]C[5]CC)(B[5]O[5]N)	B[5](NC[6a]Rh)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]N){2|C<4>}	109.8725	0.049	2	109.8725	0.002	2	110.9157	3.266	3	113.2679	1.168	35	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	B[5,5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5,5]N[5,5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC)	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC)	B[5](B[5,5]N[5,5]O[5]2)(O[5]C[5])2{1|H<1>,8|C<4>}	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC){1|N<4>,2|C<4>,2|O<2>}	O[5](B[5]B[5,5]O[5])(C[5]C[5]CC){1|N<4>,2|C<4>,2|O<2>}	111.0790	0.000	1	111.0790	0.000	1	111.0790	0.000	1	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	B[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]C[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	O[5](B[5]B[5]O[5])(C[5]C[5]CC)	B[5](B[5]C[5]O[5]2)(O[5]C[5])2{2|N<3>,6|C<4>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){1|C<3>,2|C<4>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]CC){1|C<3>,2|C<4>,2|O<2>}	110.5960	0.000	1	110.5960	0.000	1	110.8260	0.106	2	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	B[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5]C[5]O[5]2)(O[5]C[5])2	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	O[5](B[5]B[5]O[5])(C[5]C[5]HH)	B[5](B[5]C[5]O[5]2)(O[5]C[5])2{2|C<4>,2|N<3>,4|H<1>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){1|C<3>,2|H<1>,2|O<2>}	O[5](B[5]B[5]O[5])(C[5]C[5]HH){1|C<3>,2|H<1>,2|O<2>}	111.0560	0.000	1	111.0560	0.000	1	110.8260	0.106	2	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	B[6a]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[6a]C[5a,6a]N[5a,6a]C[6a])(O[5]C[5])2	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	O[5](B[5]B[6a]O[5])(C[5]C[5]CC)	B[5](B[6a]C[5a,6a]N[5a,6a]C[6a])(O[5]C[5])2{2|N<3>,4|C<3>,4|C<4>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){1|N<3>,2|C<3>,2|C<4>}	O[5](B[5]B[6a]O[5])(C[5]C[5]CC){1|N<3>,2|C<3>,2|C<4>}	110.3960	0.000	1	110.3960	0.000	1	110.3960	0.000	1	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3,6]2H)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3,6]2H)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.8560	0.000	1	113.8560	0.000	1	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2C)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2C)(O[5]C[5])2{1|C<3>,3|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	113.6380	0.000	1	113.1735	0.432	2	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2C)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2C)(O[5]C[5])2{4|C<4>,4|H<1>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){5|C<4>}	112.7090	0.000	1	113.1735	0.432	2	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2H)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2H)(O[5]C[5])2{1|C<3>,2|H<1>,5|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.5900	0.000	1	113.1980	0.341	3	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]2H)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]2H)(O[5]C[5])2{2|C<3>,2|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.0020	0.672	2	113.1980	0.341	3	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[3]N[3]C)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[3]N[3]C)(O[5]C[5])2{1|C<3>,1|H<1>,1|N<3>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	113.8730	0.000	1	113.8730	0.000	1	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2{1|Se<2>,2|C<3>,2|H<1>,5|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	112.3260	0.000	1	113.1545	1.373	2	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[3]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	O[5](B[5]C[3]O[5])(C[5]C[5]CC)	B[5](C[3]C[6a]C[3]2)(O[5]C[5])2{2|H<1>,4|C<3>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	O[5](B[5]C[3]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	113.9830	0.000	1	113.1545	1.373	2	113.3310	0.403	9	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[4]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2C)(O[5]C[5])2	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2C)(O[5]C[5])2{4|H<1>,5|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	112.8800	0.000	1	112.8800	0.000	1	113.1665	0.067	8	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[4]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2C[6])(O[5]C[5])2	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2C[6])(O[5]C[5])2{5|H<1>,7|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){5|C<4>}	113.1318	0.163	6	113.1318	0.027	6	113.1665	0.067	8	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[4]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[4]C[4]2H)(O[5]C[5])2	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	O[5](B[5]C[4]O[5])(C[5]C[5]CC)	B[5](C[4]C[4]2H)(O[5]C[5])2{1|C<3>,2|H<1>,6|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[4]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.6610	0.000	1	113.6610	0.000	1	113.1665	0.067	8	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5,6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5,6]C[5,6]C[5]C[6])(O[5]C[5])2	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC)	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC)	B[5](C[5,6]C[5,6]C[5]C[6])(O[5]C[5])2{2|C<3>,4|H<1>,7|C<4>}	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC){5|C<4>}	O[5](B[5]C[5,6]O[5])(C[5]C[5]CC){5|C<4>}	113.9010	0.000	1	113.9010	0.000	1	113.9010	0.000	1	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]B[5,5]B[5]C[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]B[5,5]B[5]C[5])(O[5]C[5])2{1|C<3>,1|N<3>,2|H<1>,4|C<4>,4|O<2>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|B<4>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|B<4>,3|C<4>}	111.9910	0.151	2	111.9910	0.023	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2{1|C<3>,2|O<2>,8|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|N<3>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|B<3>,1|N<3>,3|C<4>}	112.4995	0.486	2	112.4995	0.236	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]HH)	O[5](B[5]C[5]O[5])(C[5]C[5]HH)	B[5](C[5]B[5]C[5]N[5])(O[5]C[5])2{1|C<3>,2|O<2>,4|C<4>,4|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]HH){1|B<3>,1|C<4>,1|N<3>,2|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]HH){1|B<3>,1|C<4>,1|N<3>,2|H<1>}	112.9725	0.434	4	112.9725	0.189	4	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2{1|H<1>,1|N<3>,2|C<3>,5|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	114.5500	0.000	1	113.9123	0.326	3	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5,6a]C[5]H)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	113.5935	0.203	2	113.9123	0.326	3	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2Co)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2Co)(O[5]C[5])2{1|C<3>,1|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Co<9>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Co<9>,4|C<4>}	113.5850	0.000	1	113.5850	0.000	1	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2Fe)(O[5]C[5])2{1|F<1>,1|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Fe<10>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Fe<10>,4|C<4>}	113.2000	0.000	1	113.3275	0.033	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2Fe)(O[5]C[5])2{2|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Fe<10>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|Fe<10>,4|C<4>}	113.4550	0.000	1	113.3275	0.033	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CH)	O[5](B[5]C[5]O[5])(C[5]C[5]CH)	B[5](C[5]C[5]2Fe)(O[5]C[5])2{4|C<4>,4|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]CH){1|Fe<10>,1|H<1>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CH){1|Fe<10>,1|H<1>,3|C<4>}	113.1280	0.572	4	113.1280	0.327	4	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]HH)	O[5](B[5]C[5]O[5])(C[5]C[5]HH)	B[5](C[5]C[5]2Fe)(O[5]C[5])2{2|C<4>,6|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]HH){1|Fe<10>,2|C<4>,2|H<1>}	O[5](B[5]C[5]O[5])(C[5]C[5]HH){1|Fe<10>,2|C<4>,2|H<1>}	113.7346	0.171	5	113.7346	0.029	5	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]2H)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]2H)(O[5]C[5])2{1|C<3>,3|H<1>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.1230	0.000	1	113.1230	0.000	1	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]N[5]C)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]N[5]C)(O[5]C[5])2{2|C<3>,7|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|N<3>,4|C<4>}	113.6150	0.000	1	113.6150	0.000	1	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[5]N[5]H)(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[5]N[5]H)(O[5]C[5])2{1|H<1>,4|C<3>,4|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,1|N<3>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|H<1>,1|N<3>,3|C<4>}	114.1510	0.000	1	114.1510	0.000	1	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2{1|H<1>,4|C<3>,6|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	113.8100	0.000	1	113.7450	0.008	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[5]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	O[5](B[5]C[5]O[5])(C[5]C[5]CC)	B[5](C[5]C[6a]C[5]N[5])(O[5]C[5])2{4|C<3>,7|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	O[5](B[5]C[5]O[5])(C[5]C[5]CC){1|C<3>,1|N<3>,3|C<4>}	113.6800	0.000	1	113.7450	0.008	2	113.3004	0.418	28	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]B[5]N[6]2)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]B[5]N[6]2)(O[5]C[5])2{2|O<2>,4|C<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,2|C<4>,2|N<3>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,2|C<4>,2|N<3>}	114.4615	0.446	2	114.4615	0.199	2	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6]C)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6]C)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,4|C<4>}	113.7005	0.240	2	113.7005	0.057	2	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[5,6]C[6]H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[5,6]C[6]H)(O[5]C[5])2{2|C<3>,2|H<1>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	113.5990	0.000	1	113.5990	0.000	1	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6]B[6a]C[6])(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6]B[6a]C[6])(O[5]C[5])2{2|N<3>,3|H<1>,7|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,4|C<4>}	111.6330	0.000	1	111.6330	0.000	1	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6]C[6]H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6]C[6]H)(O[5]C[5])2{3|H<1>,7|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.1380	0.000	1	113.1380	0.000	1	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]B[5]C[6])(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]B[5]C[6])(O[5]C[5])2{2|C<3>,2|H<1>,2|O<2>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,1|C<3>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|B<3>,1|C<3>,3|C<4>}	112.8470	0.004	2	112.8470	0.000	2	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6,6a]C[6]H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6,6a]C[6]H)(O[5]C[5])2{1|H<1>,3|C<3>,5|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|C<3>,1|H<1>,3|C<4>}	111.8830	0.000	1	111.8830	0.000	1	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|B<3>,3|H<1>,6|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	112.2795	1.003	2	113.1014	0.423	11	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|C<3>,1|O<2>,2|H<1>,6|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	112.7360	0.000	1	113.1014	0.423	11	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|C<3>,3|H<1>,6|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.1873	0.319	6	113.1014	0.423	11	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]C[6]2H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]C[6]2H)(O[5]C[5])2{1|N<3>,2|C<3>,3|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,4|C<4>}	113.8480	0.256	2	113.1014	0.423	11	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	3:4:	3:4:	C[6]-4:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](C[6]N[6]2H)(O[5]C[5])2	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	O[5](B[5]C[6]O[5])(C[5]C[5]CC)	B[5](C[6]N[6]2H)(O[5]C[5])2{4|C<3>,4|C<4>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,2|C<4>,2|N<3>}	O[5](B[5]C[6]O[5])(C[5]C[5]CC){1|H<1>,2|C<4>,2|N<3>}	115.0290	0.000	1	115.0290	0.000	1	113.2461	0.770	22	113.1412	0.783	72	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	B-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](BC[6a]2N[6])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]B)	O[5](C[5]C[5]CC)(B[5]O[5]B)	B[5](BC[6a]2N[6])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]B){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]B){2|C<4>}	110.0510	0.000	1	110.0510	0.000	1	110.0510	0.000	1	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CB[5]C[6]Ru)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CB[5]C[6]Ru)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.6145	0.066	2	112.6145	0.004	2	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CB[6a]CH)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CB[6a]CH)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	112.8780	0.507	8	112.8780	0.257	8	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[5a]B[5]H)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[5a]B[5]H)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.5010	0.109	2	113.5010	0.012	2	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]2B[5])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]2B[5])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.4460	0.000	1	113.4460	0.000	1	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]2H)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]2H)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.4420	0.000	1	113.4420	0.000	1	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]2)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]2)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.0410	0.619	3	113.0410	0.383	3	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]C)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]C)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.1175	0.293	4	113.1175	0.086	4	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]B[5]H)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]B[5]H)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.2350	0.421	2	113.2350	0.178	2	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]CC)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CC)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.7107	0.395	3	113.7107	0.156	3	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]CH)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]CH)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	113.4021	0.440	9	113.4021	0.194	9	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](CC[6a]HO)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]C)	O[5](C[5]C[5]CC)(B[5]O[5]C)	B[5](CC[6a]HO)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	114.7370	0.000	1	114.7370	0.000	1	113.2415	0.293	36	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C[5]-4:O[5]-2:O[5]-2:	C[5,5]-4:B[5]-3:	C[5,5]-4:B[5]-3:	B[5](C[5]C[5]2Fe)(O[5]C[5,5])2	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[5]O[5])	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[5]O[5])	B[5](C[5]C[5]2Fe)(O[5]C[5,5])2{1|C<3>,3|C<4>,4|H<1>}	O[5](C[5,5]C[5,6a]C[5,5]H)(B[5]C[5]O[5]){1|Fe<10>,1|H<1>,2|C<3>,3|C<4>}	O[5](C[5,5]C[5,5]C[5]H)(B[5]C[5]O[5]){1|Fe<10>,1|H<1>,2|C<3>,4|C<4>}	113.1368	0.733	4	113.1368	0.537	4	113.1368	0.537	4	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](C[5]C[6a]2C[5])(B[5]C[5]O[5])	O[5](C[5]C[6a]2C[5])(B[5]C[5]O[5])	B[5](C[5]C[5]2Fe)(O[5]C[5])2{1|H<1>,3|C<4>,4|C<3>}	O[5](C[5]C[6a]2C[5])(B[5]C[5]O[5]){1|Fe<10>,2|C<4>,6|C<3>}	O[5](C[5]C[6a]2C[5])(B[5]C[5]O[5]){1|Fe<10>,2|C<4>,6|C<3>}	112.3030	0.000	1	112.3030	0.000	1	113.5425	0.572	8	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]2Fe)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5])	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5])	B[5](C[5]C[5]2Fe)(O[5]C[5])2{2|C<3>,2|C<4>,4|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5]){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>}	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5]){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>}	113.6355	0.624	6	113.6355	0.390	6	113.5425	0.572	8	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	C[5]-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](C[5]C[5]N[5]H)(O[5]C[5])2	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5])	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5])	B[5](C[5]C[5]N[5]H)(O[5]C[5])2{2|C<4>,3|C<3>,4|H<1>}	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5]){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	O[5](C[5]C[6a]C[5]H)(B[5]C[5]O[5]){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	114.2240	0.000	1	114.2240	0.000	1	113.5425	0.572	8	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	Ge-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](GeC[6a]3)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]Ge)	O[5](C[5]C[5]CC)(B[5]O[5]Ge)	B[5](GeC[6a]3)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Ge){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Ge){2|C<4>}	112.4900	0.320	2	112.4900	0.102	2	112.4900	0.102	2	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	Si-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](SiC[6a]2B[5])(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]Si)	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2B[5])(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	112.1970	0.789	2	112.1970	0.623	2	112.0132	0.737	4	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	Si-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](SiC[6a]2C)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]Si)	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2C)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	110.9770	0.000	1	110.9770	0.000	1	112.0132	0.737	4	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	4:2:2:	4:3:	4:3:	Si-4:O[5]-2:O[5]-2:	C[5]-4:B[5]-3:	C[5]-4:B[5]-3:	B[5](SiC[6a]2Si)(O[5]C[5])2	O[5](C[5]C[5]CC)(B[5]O[5]Si)	O[5](C[5]C[5]CC)(B[5]O[5]Si)	B[5](SiC[6a]2Si)(O[5]C[5])2{4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]Si){2|C<4>}	112.6820	0.000	1	112.6820	0.000	1	112.0132	0.737	4	113.1030	0.652	55	113.3829	0.881	600	113.3829	0.881	600
2	976	976	5:SP2_SP2_SP2	B[5]	O[5]	O[5]	6:2:2:	3:4:	3:4:	B[5x3,5x5,20x6]-6:O[5]-2:O[5]-2:	B[5]-3:C[5]-4:	B[5]-3:C[5]-4:	B[5](B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(O[5]C[5])2	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC)	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC)	B[5](B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(O[5]C[5])2{2|C<6>,3|B<6>,4|C<4>,5|H<1>}	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC){2|C<4>,5|B<6>}	O[5](B[5]B[5x3,5x5,20x6]O[5])(C[5]C[5]CC){2|C<4>,5|B<6>}	112.6080	0.000	1	112.6080	0.000	1	112.6080	0.000	1	112.6080	0.000	1	113.3829	0.881	600	113.3829	0.881	600
2	976	983	0:SP2_SP1_SP2	B[5]	O[5]	C	2:2:2:	4:3:	3:2:	O[5]-2:O[5]-2:C-2:	C[5]-4:B[5]-3:	B[5]-3:C-2:	B[5](O[5]C[5])2(CC)	O[5](C[5]C[5]CC)(B[5]O[5]C)	C(B[5]O[5]2)(CB[5])	B[5](O[5]C[5])2(CC){4|C<4>}	O[5](C[5]C[5]CC)(B[5]O[5]C){2|C<4>}	C(B[5]O[5]2)(CB[5])	122.4294	0.390	8	122.4294	0.152	8	122.4294	0.152	8	122.4294	0.152	8	122.4294	0.152	8	122.4294	0.152	8
3	2	537	0:SP2_SP2_SP2	B[5a]	B[5]	O[5a]	2:2:3:	3:3:3:	3:3:	O[5a]-2:O[5a]-2:B[5]-3:	B[5a]-3:N[5]-3:N[5]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2)	B[5](B[5a]O[5a]2)(N[5]C[5]C)2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5])	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2){2|C<3>,4|C<4>}	B[5](B[5a]O[5a]2)(N[5]C[5]C)2{2|C<3>,4|H<1>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5]){1|H<1>,2|C<3>,2|N<3>}	125.0520	0.000	1	125.0520	0.000	1	125.0520	0.000	1	125.0520	0.000	1	125.0520	0.000	1	125.0520	0.000	1
3	3	181	5:SP2_SP2_SP2	B[5a]	B[5a]	S[5a]	2:2:3:	2:2:3:	3:3:	S[5a]-2:S[5a]-2:B[5a]-3:	S[5a]-2:S[5a]-2:B[5a]-3:	C[5a,5a]-3:B[5a]-3:	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2)	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2)	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a])	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2){4|C<3>}	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2){4|C<3>}	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a]){1|C<3>,1|H<1>,3|S<2>}	122.9400	0.017	2	122.9400	0.000	2	122.9400	0.000	2	123.4983	0.286	6	123.4983	0.286	6	123.4983	0.286	6
3	3	181	5:SP2_SP2_SP2	B[5a]	B[5a]	S[5a]	2:2:3:	2:2:3:	3:3:	S[5a]-2:S[5a]-2:B[5a]-3:	S[5a]-2:S[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2)	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a])	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2){4|C<3>}	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2){4|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a]){1|H<1>,2|C<3>,2|S<2>}	123.7775	0.406	4	123.7775	0.165	4	123.7775	0.165	4	123.4983	0.286	6	123.4983	0.286	6	123.4983	0.286	6
3	3	537	0:SP2_SP2_SP2	B[5a]	B[5a]	O[5a]	2:2:3:	3:3:3:	3:3:	O[5a]-2:O[5a]-2:B[5a]-3:	N[5a]-3:N[5a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2)	B[5a](N[5a]C[5a,6a]C)2(B[5a]O[5a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2){2|C<4>,4|C<3>}	B[5a](N[5a]C[5a,6a]C)2(B[5a]O[5a]2){4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|N<3>}	124.9715	0.951	2	124.9715	0.905	2	124.9715	0.905	2	124.9715	0.905	2	124.9715	0.905	2	124.9715	0.905	2
3	3	537	5:SP2_SP2_SP2	B[5a]	B[5a]	O[5a]	2:2:3:	2:2:3:	3:3:	O[5a]-2:O[5a]-2:B[5a]-3:	O[5a]-2:O[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2)	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2){4|C<3>}	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2){4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|O<2>}	124.4345	0.334	2	124.4345	0.112	2	124.4345	0.112	2	124.4345	0.112	2	123.9040	0.550	4	123.9040	0.550	4
3	3	537	5:SP2_SP2_SP2	B[5a]	B[5a]	O[5a]	3:3:2:	3:3:2:	3:3:	B[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a]){1|C<4>,4|C<3>}	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a]){1|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a]){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	123.8280	0.000	1	123.8280	0.000	1	123.3735	0.413	2	123.3735	0.413	2	123.9040	0.550	4	123.9040	0.550	4
3	3	537	5:SP2_SP2_SP2	B[5a]	B[5a]	O[5a]	3:3:2:	3:3:2:	3:3:	B[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a]){1|H<1>,4|C<3>}	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a]){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	122.9190	0.000	1	122.9190	0.000	1	123.3735	0.413	2	123.3735	0.413	2	123.9040	0.550	4	123.9040	0.550	4
3	3	813	0:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:3:	2:2:3:	3:3:4:	N[5a]-3:N[5a]-3:B[5a]-3:	O[5a]-2:O[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:C-4:	B[5a](N[5a]C[5a,6a]C)2(B[5a]O[5a]2)	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2)	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(CH3)	B[5a](N[5a]C[5a,6a]C)2(B[5a]O[5a]2){4|C<3>}	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2){2|C<4>,4|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(CH3){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	127.1795	1.258	2	127.1795	1.582	2	127.1795	1.582	2	127.1795	1.582	2	126.9997	32.617	9	126.9997	32.617	9
3	3	813	0:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:3:	3:3:3:	3:3:1:	N[5a]-3:N[5a]-3:B[5a]-3:	N[5a]-3:N[5a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:H-1:	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H)	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2){1|H<1>,1|N<2>,6|C<3>}	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2){1|H<1>,1|N<2>,6|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H){1|H<1>,2|N<3>,3|C<3>}	121.7515	1.067	4	121.7515	1.139	4	121.7515	1.139	4	121.7515	1.139	4	126.9997	32.617	9	126.9997	32.617	9
3	3	813	0:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:3:	3:3:3:	3:3:3:	N[5a]-3:N[5a]-3:B[5a]-3:	N[5a]-3:N[5a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(C[6a]C[6a]N[6a])	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2){1|H<1>,1|N<2>,6|C<3>}	B[5a](N[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]H)(B[5a]N[5a]2){1|H<1>,1|N<2>,6|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(C[6a]C[6a]N[6a]){2|N<3>,3|H<1>,4|C<3>}	133.8773	1.378	3	133.8773	1.898	3	133.8773	1.898	3	133.8773	1.898	3	126.9997	32.617	9	126.9997	32.617	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a,6a]	3:3:3:	3:3:3:	3:3:3:	N[5a,6a]-3:B[5a]-3:N[5a]-3:	N[5a,6a]-3:B[5a]-3:N[5a]-3:	C[5a,6a]-3:B[5a]-3:C[6a]-3:	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C)	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C)	N[5a,6a](C[5a,6a]C[5a]C[6a])(B[5a]B[5a]N[5a])(C[6a]C[6a]H)	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C){1|C<4>,2|H<1>,5|C<3>}	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C){1|C<4>,2|H<1>,5|C<3>}	N[5a,6a](C[5a,6a]C[5a]C[6a])(B[5a]B[5a]N[5a])(C[6a]C[6a]H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	123.7840	0.000	1	123.7840	0.000	1	123.7840	0.000	1	123.7840	0.000	1	123.7840	0.000	1	127.8378	8.575	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:2:	3:3:2:	3:3:1:	B[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:H-1:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a])	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(H)	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a]){1|H<1>,4|C<3>}	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a]){1|H<1>,4|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	129.4440	0.000	1	129.4440	0.000	1	129.4440	0.000	1	129.4440	0.000	1	128.3445	7.159	8	127.8378	8.575	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:2:	3:3:2:	3:3:4:	B[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:C-4:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a])	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a])	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(CH3)	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a]){1|C<4>,4|C<3>}	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a]){1|C<4>,4|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(CH3){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	128.8170	0.000	1	128.8170	0.000	1	128.8170	0.000	1	128.8170	0.000	1	128.3445	7.159	8	127.8378	8.575	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:3:	3:3:3:	3:3:1:	N[5a]-3:N[5a]-3:B[5a]-3:	N[5a]-3:N[5a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:H-1:	B[5a](N[5a]C[5a,6a]H)2(B[5a]N[5a]2)	B[5a](N[5a]C[5a,6a]H)2(B[5a]N[5a]2)	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H)	B[5a](N[5a]C[5a,6a]H)2(B[5a]N[5a]2){2|H<1>,4|C<3>}	B[5a](N[5a]C[5a,6a]H)2(B[5a]N[5a]2){2|H<1>,4|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H){2|C<3>,2|H<1>,2|N<3>}	127.9663	0.275	4	127.9663	0.076	4	127.9663	0.076	4	127.9663	0.076	4	128.3445	7.159	8	127.8378	8.575	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	3:3:3:	3:3:3:	3:3:4:	N[5a,6a]-3:B[5a]-3:N[5a]-3:	N[5a,6a]-3:B[5a]-3:N[5a]-3:	B[5a]-3:C[5a]-3:C-4:	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C)	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C)	N[5a](B[5a]N[5a,6a]B[5a])(C[5a]C[5a,6a]H)(CC3)	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C){1|C<4>,2|H<1>,5|C<3>}	B[5a](N[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a,6a]N[5a])(N[5a]C[5a]C){1|C<4>,2|H<1>,5|C<3>}	N[5a](B[5a]N[5a,6a]B[5a])(C[5a]C[5a,6a]H)(CC3){2|C<3>,2|N<3>}	133.2080	0.000	1	133.2080	0.000	1	133.2080	0.000	1	133.2080	0.000	1	128.3445	7.159	8	127.8378	8.575	9
3	3	813	5:SP2_SP2_SP2	B[5a]	B[5a]	N[5a]	4:3:3:	4:3:3:	3:3:1:	N[5a]-4:N[5a]-3:B[5a]-3:	N[5a]-4:N[5a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:H-1:	B[5a](N[5a]C[5a,6a]Li2)(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	B[5a](N[5a]C[5a,6a]Li2)(N[5a]C[5a,6a]H)(B[5a]N[5a]2)	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H)	B[5a](N[5a]C[5a,6a]Li2)(N[5a]C[5a,6a]H)(B[5a]N[5a]2){2|Li<4>,1|H<1>,4|C<3>}	B[5a](N[5a]C[5a,6a]Li2)(N[5a]C[5a,6a]H)(B[5a]N[5a]2){2|Li<4>,1|H<1>,4|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])(H){2|Li<4>,1|H<1>,1|N<3>,1|N<4>,2|C<3>}	123.4220	0.000	1	123.4220	0.000	1	123.4220	0.000	1	123.4220	0.000	1	128.3445	7.159	8	127.8378	8.575	9
3	18	813	0:SP2_SP2_SPD6	B[5a]	B[5x3,5x5,20x6]	N[5a,6a]	6:3:3:	6:6:6:6:6:3:	3:3:3:	B[5x3,5x5,20x6]-6:N[5a,6a]-3:N[5a,6a]-3:	C[5x3,6x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5a]-3:	B[5a]-3:C[5a,6a]-3:C[6a]-3:	B[5a](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5a,6a]C[5a,6a]C[6a])2	B[5x3,5x5,20x6](C[5x3,6x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]2C[5x3,6x5,20x6]2H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5a]N[5a,6a]2)	N[5a,6a](B[5a]B[5x3,5x5,20x6]N[5a,6a])(C[5a,6a]C[5a,6a]C[6a])(C[6a]C[6a]H)	B[5a](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5a,6a]C[5a,6a]C[6a])2{1|C<4>,1|C<6>,4|B<6>,4|C<3>,6|H<1>}	B[5x3,5x5,20x6](C[5x3,6x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]C[5])(B[5x3,5x5,20x6]B[5x3,5x5,20x6]2C[5x3,6x5,20x6]2H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,6x5,20x6]H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(B[5a]N[5a,6a]2){1|B<6>,2|C<4>,4|C<3>,6|H<1>}	N[5a,6a](B[5a]B[5x3,5x5,20x6]N[5a,6a])(C[5a,6a]C[5a,6a]C[6a])(C[6a]C[6a]H){1|C<6>,2|H<1>,3|C<3>,4|B<6>}	128.1940	3.280	2	128.1940	10.756	2	128.1940	10.756	2	128.1940	10.756	2	128.1940	10.756	2	128.1940	10.756	2
3	74	813	0:SP2_SP2_SP2	B[5a]	N[4]	N[5a]	3:3:3:	4:3:3:	3:3:3:	N[4]-3:N[5a]-3:N[5a]-3:	Si[4,5]-4:B[5a]-3:C[4]-3:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[4]Si[4,5]C[4])(N[5a]C[5a]C[6a])2	N[4](Si[4,5]N[5]2O[4])(B[5a]N[5a]2)(C[4]O[4]O)	N[5a](B[5a]N[5a]N[4])(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[4]Si[4,5]C[4])(N[5a]C[5a]C[6a])2{1|O<1>,1|O<2>,2|H<1>,2|N<3>,4|C<3>}	N[4](Si[4,5]N[5]2O[4])(B[5a]N[5a]2)(C[4]O[4]O){8|C<3>}	N[5a](B[5a]N[5a]N[4])(C[5a]C[5a]H)(C[6a]C[6a]2){1|Si<4>,1|H<1>,2|C<4>,4|C<3>}	127.6505	1.681	2	127.6505	2.825	2	127.6505	2.825	2	127.6505	2.825	2	127.6505	2.825	2	127.6505	2.825	2
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:1:	3:3:	3:3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[5,6a])(B[5a]S[5a]Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[5,6a])(B[5a]S[5a]Br){1|S<2>,2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|H<1>,2|C<3>}	115.2910	0.000	1	115.2910	0.000	1	115.1942	0.072	4	115.1942	0.072	4	114.2524	1.764	7	114.2524	1.764	7
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:1:	3:3:	3:3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|H<1>,2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|H<1>,2|C<3>}	114.8530	0.000	1	115.1620	0.102	3	115.1942	0.072	4	115.1942	0.072	4	114.2524	1.764	7	114.2524	1.764	7
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:1:	3:3:	3:3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|H<1>,2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|S<3>,2|C<3>}	115.1410	0.000	1	115.1620	0.102	3	115.1942	0.072	4	115.1942	0.072	4	114.2524	1.764	7	114.2524	1.764	7
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:1:	3:3:	3:3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|S<3>,2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|S<3>,2|C<3>}	115.4920	0.000	1	115.1620	0.102	3	115.1942	0.072	4	115.1942	0.072	4	114.2524	1.764	7	114.2524	1.764	7
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:3:	3:3:	3:3:	S[5a]-2:S[5a]-2:B[5a]-3:	C[5a,5a]-3:B[5a]-3:	C[5a,5a]-3:B[5a]-3:	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2)	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a])	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a])	B[5a](S[5a]C[5a,5a])2(B[5a]S[5a]2){4|C<3>}	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a]){1|C<3>,1|H<1>,3|S<2>}	S[5a](C[5a,5a]C[5a,5a]C[5a])(B[5a]B[5a]S[5a]){1|C<3>,1|H<1>,3|S<2>}	114.1140	0.000	1	114.1140	0.000	1	114.1140	0.000	1	112.9967	1.044	3	114.2524	1.764	7	114.2524	1.764	7
3	181	181	5:SP2_SP2_SP2	B[5a]	S[5a]	S[5a]	2:2:3:	3:3:	3:3:	S[5a]-2:S[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a])	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a])	B[5a](S[5a]C[5a,6a])2(B[5a]S[5a]2){4|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a]){1|H<1>,2|C<3>,2|S<2>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]S[5a]){1|H<1>,2|C<3>,2|S<2>}	112.4380	0.464	2	112.4380	0.215	2	112.4380	0.215	2	112.9967	1.044	3	114.2524	1.764	7	114.2524	1.764	7
3	181	924	0:SP2_SP-NON_SP2	B[5a]	S[5a]	Br	2:2:1:	3:3:	3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[5,6a])(B[5a]S[5a]Br)	Br(B[5a]S[5a]2)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[5,6a])(B[5a]S[5a]Br){1|S<2>,2|C<3>}	Br(B[5a]S[5a]2)	122.1920	0.000	1	122.1920	0.000	1	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8
3	181	924	0:SP2_SP-NON_SP2	B[5a]	S[5a]	Br	2:2:1:	3:3:	3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	Br(B[5a]S[5a]2)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|H<1>,2|C<3>}	Br(B[5a]S[5a]2)	122.5935	0.569	4	122.4266	0.298	7	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8
3	181	924	0:SP2_SP-NON_SP2	B[5a]	S[5a]	Br	2:2:1:	3:3:	3:	S[5a]-2:S[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:	B[5a](S[5a]C[5a,6a])2(Br)	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br)	Br(B[5a]S[5a]2)	B[5a](S[5a]C[5a,6a])2(Br){2|C<3>}	S[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]S[5a]Br){1|S<3>,2|C<3>}	Br(B[5a]S[5a]2)	122.2040	0.528	3	122.4266	0.298	7	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8	122.3972	0.262	8
3	210	813	0:SP2_SP1_SP2	B[5a]	Ge	N[5a]	3:3:2:	3:3:	3:3:3:	N[5a]-3:N[5a]-3:Ge-2:	B[5a]-3:Ge-3:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(GeGe)	Ge(B[5a]N[5a]2)(GeB[5a]C[5])	N[5a](B[5a]N[5a]Ge)(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(GeGe){2|H<1>,4|C<3>}	Ge(B[5a]N[5a]2)(GeB[5a]C[5])	N[5a](B[5a]N[5a]Ge)(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	127.5510	13.408	2	127.5510	179.779	2	127.5510	179.779	2	127.5510	179.779	2	127.5510	179.779	2	127.5510	179.779	2
3	217	813	0:SP2_SP2_SP2	B[5a,6a]	N[6a]	N[5a]	3:3:3:	3:3:3:	3:3:2:	N[5a,6a]-3:N[6a]-3:N[5a]-3:	B[5a,6a]-3:B[6,6a]-3:C[6a]-3:	B[5a,6a]-3:C[6a]-3:N[5a]-2:	B[5a,6a](N[5a,6a]B[6,6a]C[5a])(N[6a]B[6,6a]C[6a])(N[5a]C[6a]N[5a])	N[6a](B[5a,6a]N[5a,6a]N[5a])(B[6,6a]N[6,6a]N[6])(C[6a]C[6a]2)	N[5a](B[5a,6a]N[5a,6a]N[6a])(C[6a]C[6a]2)(N[5a]C[5a])	B[5a,6a](N[5a,6a]B[6,6a]C[5a])(N[6a]B[6,6a]C[6a])(N[5a]C[6a]N[5a]){4|N<3>,5|C<3>}	N[6a](B[5a,6a]N[5a,6a]N[5a])(B[6,6a]N[6,6a]N[6])(C[6a]C[6a]2){1|B<4>,1|N<2>,1|N<3>,2|H<1>,6|C<3>}	N[5a](B[5a,6a]N[5a,6a]N[6a])(C[6a]C[6a]2)(N[5a]C[5a]){1|B<3>,1|B<4>,2|H<1>,4|C<3>}	132.4020	0.000	1	132.4020	0.000	1	132.4020	0.000	1	132.4020	0.000	1	132.4020	0.000	1	132.4020	0.000	1
3	217	813	6:SP2_SP2_SP3	B[5a,6a]	N[6a]	N[5a,6a]	3:3:3:	3:3:3:	4:3:3:	N[5a,6a]-3:N[6a]-3:N[5a]-3:	B[5a,6a]-3:B[6,6a]-3:C[6a]-3:	B[6,6a]-4:B[5a,6a]-3:C[5a]-3:	B[5a,6a](N[5a,6a]B[6,6a]C[5a])(N[6a]B[6,6a]C[6a])(N[5a]C[6a]N[5a])	N[6a](B[5a,6a]N[5a,6a]N[5a])(B[6,6a]N[6,6a]N[6])(C[6a]C[6a]2)	N[5a,6a](B[6,6a]N[6,6a]N[6]2)(B[5a,6a]N[5a]N[6a])(C[5a]C[6a]N[5a])	B[5a,6a](N[5a,6a]B[6,6a]C[5a])(N[6a]B[6,6a]C[6a])(N[5a]C[6a]N[5a]){4|N<3>,5|C<3>}	N[6a](B[5a,6a]N[5a,6a]N[5a])(B[6,6a]N[6,6a]N[6])(C[6a]C[6a]2){1|B<4>,1|N<2>,1|N<3>,2|H<1>,6|C<3>}	N[5a,6a](B[6,6a]N[6,6a]N[6]2)(B[5a,6a]N[5a]N[6a])(C[5a]C[6a]N[5a]){1|B<3>,2|N<2>,7|C<3>}	121.8290	0.000	1	121.8290	0.000	1	121.8290	0.000	1	121.8290	0.000	1	121.8290	0.000	1	121.8290	0.000	1
3	246	813	0:SP2_SP2_SP3	B[5a]	P[5]	N[5a]	3:3:3:	3:3:3:	3:3:3:	N[5a]-3:N[5a]-3:P[5]-3:	B[5a]-3:N[5]-3:N[5]-3:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(P[5]N[5]2)	P[5](B[5a]N[5a]2)(N[5]C[5]C)2	N[5a](B[5a]N[5a]P[5])(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(P[5]N[5]2){2|C<4>,2|H<1>,6|C<3>}	P[5](B[5a]N[5a]2)(N[5]C[5]C)2{2|H<1>,4|C<3>}	N[5a](B[5a]N[5a]P[5])(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,2|N<3>,3|C<3>}	127.5420	0.707	2	127.5420	0.500	2	127.5420	0.500	2	127.7078	62.124	4	127.7078	62.124	4	127.7078	62.124	4
3	246	813	0:SP2_SP2_SP3	B[5a]	P[5]	N[5a]	3:3:3:	3:3:3:	3:3:3:	N[5a]-3:N[5a]-3:P[5]-3:	N[5]-3:N[5]-3:B[5a]-3:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(P[5]N[5]2)	P[5](N[5]C[6a]C[5])2(B[5a]N[5a]2)	N[5a](B[5a]N[5a]P[5])(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(P[5]N[5]2){2|H<1>,8|C<3>}	P[5](N[5]C[6a]C[5])2(B[5a]N[5a]2){2|H<1>,8|C<3>}	N[5a](B[5a]N[5a]P[5])(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,2|N<3>,3|C<3>}	127.8735	13.629	2	127.8735	185.763	2	127.8735	185.763	2	127.7078	62.124	4	127.7078	62.124	4	127.7078	62.124	4
3	310	813	0:SP2_SP2_SP3	B[5a]	Ge	N[5a]	3:3:4:	3:4:1:1:	3:3:3:	N[5a]-3:N[5a]-3:Ge-4:	B[5a]-3:Ge-4:H-1:H-1:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(GeGeHH)	Ge(B[5a]N[5a]2)(GeB[5a]HH)(H)2	N[5a](B[5a]N[5a]Ge)(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(GeGeHH){2|H<1>,4|C<3>}	Ge(B[5a]N[5a]2)(GeB[5a]HH)(H)2	N[5a](B[5a]N[5a]Ge)(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	127.5995	1.575	2	127.5995	2.480	2	127.5995	2.480	2	127.5995	2.480	2	127.5995	2.480	2	127.5995	2.480	2
3	362	813	0:SP2_SP2_SPD6	B[5a]	C[5x3,5x5,20x6]	N[5a]	6:3:3:	6:6:6:6:6:3:	3:3:3:	C[5x3,5x5,20x6]-6:N[5a]-3:N[5a]-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:B[5a]-3:	B[5a]-3:C[5a,6a]-3:C[6a]-3:	B[5a](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5a]C[5a,6a]C[6a])2	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)(B[5a]N[5a]2)	N[5a](B[5a]C[5x3,5x5,20x6]N[5a])(C[5a,6a]C[5a,6a]C[6a])(C[6a]C[6a]2)	B[5a](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[5a]C[5a,6a]C[6a])2{5|B<6>,5|H<1>,6|C<3>}	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)(B[5a]N[5a]2){1|B<6>,4|C<3>,5|H<1>}	N[5a](B[5a]C[5x3,5x5,20x6]N[5a])(C[5a,6a]C[5a,6a]C[6a])(C[6a]C[6a]2){1|C<6>,3|H<1>,4|B<6>,5|C<3>}	126.5530	0.549	2	126.5530	0.301	2	126.5530	0.301	2	126.5530	0.301	2	126.5558	0.147	4	126.5558	0.147	4
3	362	813	0:SP2_SP2_SPD6	B[5a]	C[5x3,5x5,20x6]	N[5a]	6:3:3:	6:6:6:6:6:3:	3:3:4:	C[5x3,5x5,20x6]-6:N[5a]-3:N[5a]-3:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5a]-3:	B[5a]-3:C[5a,6a]-3:C-4:	B[5a](C[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N[5a]C[5a,6a]C)2	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)3(B[5a]N[5a]2)	N[5a](B[5a]C[5x3,5x5,20x6]N[5a])(C[5a,6a]C[5a,6a]C[6a])(CCHH)	B[5a](C[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N[5a]C[5a,6a]C)2{1|C<6>,2|C<3>,4|B<6>,5|H<1>}	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)3(B[5a]N[5a]2){1|B<3>,1|B<6>,2|C<3>,2|C<4>,4|H<1>}	N[5a](B[5a]C[5x3,5x5,20x6]N[5a])(C[5a,6a]C[5a,6a]C[6a])(CCHH){1|C<4>,1|H<1>,2|C<3>,5|B<6>}	126.5585	0.373	2	126.5585	0.139	2	126.5585	0.139	2	126.5585	0.139	2	126.5558	0.147	4	126.5558	0.147	4
3	466	537	0:SP2_SP2_SP3	B[5a]	C[6,6]	O[5a]	4:2:2:	3:4:3:1:	3:3:	C[6,6]-4:O[5a]-2:O[5a]-2:	N[6,6]-3:C[3x6]-4:B[5a]-3:H-1:	C[5a,6a]-3:B[5a]-3:	B[5a](C[6,6]C[3x6]N[6,6]H)(O[5a]C[5a,6a])2	C[6,6](N[6,6]C[3x6]C[6a])(C[3x6]C[6,6]2C)(B[5a]O[5a]2)(H)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a])	B[5a](C[6,6]C[3x6]N[6,6]H)(O[5a]C[5a,6a])2{3|C<3>,4|C<4>}	C[6,6](N[6,6]C[3x6]C[6a])(C[3x6]C[6,6]2C)(B[5a]O[5a]2)(H){3|H<1>,4|C<3>,4|C<4>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a]){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	124.3538	2.197	4	124.3538	4.827	4	124.3538	4.827	4	124.3538	4.827	4	124.3538	4.827	4	124.3670	3.401	6
3	466	537	0:SP2_SP2_SP3	B[5a]	C[6]	O[5a]	4:2:2:	4:3:3:3:	3:3:	C[6]-4:O[5a]-2:O[5a]-2:	C[6]-4:B[5a]-3:C[6a]-3:P[6]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](C[6]C[6a]C[6]P[6])(O[5a]C[5a,6a])2	C[6](C[6]C[6]FeH)(B[5a]O[5a]2)(C[6a]C[6a]2)(P[6]C[6]Fe)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6])	B[5a](C[6]C[6a]C[6]P[6])(O[5a]C[5a,6a])2{1|Fe<10>,1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6]FeH)(B[5a]O[5a]2)(C[6a]C[6a]2)(P[6]C[6]Fe){1|C<4>,2|H<1>,6|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6]){1|C<4>,1|H<1>,1|P<3>,3|C<3>}	124.3935	1.587	2	124.3935	2.520	2	124.3935	2.520	2	124.3935	2.520	2	124.3935	2.520	2	124.3670	3.401	6
3	474	537	0:SP2_SP2_SP3	B[5a]	C[5]	O[5a]	4:2:2:	3:3:3:4:	3:3:	C[5]-4:O[5a]-2:O[5a]-2:	N[5]-3:B[5a]-3:B[5a]-3:C[5]-4:	C[5a,6a]-3:B[5a]-3:	B[5a](C[5]B[5a]C[5]N[5])(O[5a]C[5a,6a])2	C[5](N[5]C[6a]C[5])(B[5a]O[5a]2)2(C[5]C[5]CC)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	B[5a](C[5]B[5a]C[5]N[5])(O[5a]C[5a,6a])2{2|O<2>,3|C<3>,4|C<4>}	C[5](N[5]C[6a]C[5])(B[5a]O[5a]2)2(C[5]C[5]CC){2|C<4>,2|H<1>,6|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|B<3>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	124.4385	2.232	4	124.4385	4.981	4	124.4385	4.981	4	124.4385	4.981	4	124.4385	4.981	4	124.4385	4.981	4
3	490	813	0:SP2_SP2_SP3	B[5a]	C	N[5a]	3:3:4:	3:1:1:1:	3:3:3:	N[5a]-3:N[5a]-3:C-4:	B[5a]-3:H-1:H-1:H-1:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(CH3)	C(B[5a]N[5a]2)(H)3	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(CH3){2|H<1>,4|C<3>}	C(B[5a]N[5a]2)(H)3	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	128.0360	0.013	4	128.0360	0.000	4	128.0360	0.000	4	128.0360	0.000	4	127.8627	0.527	12	127.8627	0.527	12
3	490	813	0:SP2_SP2_SP3	B[5a]	C	N[5a]	3:3:4:	3:3:1:1:	3:3:3:	N[5a]-3:N[5a]-3:C-4:	B[5a]-3:C-3:H-1:H-1:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(CCHH)	C(B[5a]N[5a]2)(CCC)(H)2	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(CCHH){2|H<1>,4|C<3>}	C(B[5a]N[5a]2)(CCC)(H)2	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	127.6330	2.203	2	127.6330	4.855	2	127.6330	4.855	2	127.8163	1.093	6	127.8627	0.527	12	127.8627	0.527	12
3	490	813	0:SP2_SP2_SP3	B[5a]	C	N[5a]	3:3:4:	3:3:1:1:	3:3:3:	N[5a]-3:N[5a]-3:C-4:	B[5a]-3:C[6a]-3:H-1:H-1:	B[5a]-3:C[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a]C[6a])2(CC[6a]HH)	C(B[5a]N[5a]2)(C[6a]C[6a]2)(H)2	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2)	B[5a](N[5a]C[5a]C[6a])2(CC[6a]HH){2|H<1>,4|C<3>}	C(B[5a]N[5a]2)(C[6a]C[6a]2)(H)2	N[5a](B[5a]N[5a]C)(C[5a]C[5a]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	127.9080	0.411	4	127.9080	0.169	4	127.9080	0.169	4	127.8163	1.093	6	127.8627	0.527	12	127.8627	0.527	12
3	490	813	0:SP2_SP2_SP3	B[5a]	C	N[5a]	3:3:4:	3:4:4:4:	3:3:3:	N[5a]-3:N[5a]-3:C-4:	B[5a]-3:C-4:C-4:C-4:	C[5a,6a]-3:B[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a,6a]C[6a])2(CC3)	C(B[5a]N[5a]2)(CH3)3	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a]C)(C[6a]C[6a]2)	B[5a](N[5a]C[5a,6a]C[6a])2(CC3){6|C<3>}	C(B[5a]N[5a]2)(CH3)3	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]N[5a]C)(C[6a]C[6a]2){3|H<1>,5|C<3>}	127.6550	0.332	2	127.6550	0.110	2	127.6550	0.110	2	127.6550	0.110	2	127.8627	0.527	12	127.8627	0.527	12
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:1:	3:3:	3:3:	O[5a]-2:O[5a]-2:Br-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(Br)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Br)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Br)	B[5a](O[5a]C[5a,6a])2(Br){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Br){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Br){1|H<1>,2|C<3>}	113.8800	0.000	1	113.8800	0.000	1	113.8800	0.000	1	113.2940	0.980	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:1:	3:3:	3:3:	O[5a]-2:O[5a]-2:Cl-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(Cl)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl)	B[5a](O[5a]C[5a,6a])2(Cl){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl){1|H<1>,2|C<3>}	113.7200	0.409	2	113.7200	0.167	2	113.7200	0.167	2	113.2940	0.980	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:1:	3:3:	3:3:	O[5a]-2:O[5a]-2:H-1:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(H)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]H)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]H)	B[5a](O[5a]C[5a,6a])2(H){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]H){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]H){1|H<1>,2|C<3>}	111.8560	0.000	1	111.8560	0.000	1	111.8560	0.000	1	113.2940	0.980	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:2:	3:3:	3:3:	O[5a]-2:O[5a]-2:C-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(CMo)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	B[5a](O[5a]C[5a,6a])2(CMo){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	111.1900	0.000	1	111.1900	0.000	1	111.1900	0.000	1	112.2256	0.816	5	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:2:	3:3:	3:3:	O[5a]-2:O[5a]-2:N-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(NN)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	B[5a](O[5a]C[5a,6a])2(NN){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	113.2550	0.000	1	113.2550	0.000	1	113.2550	0.000	1	112.2256	0.816	5	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:2:	3:3:	3:3:	O[5a]-2:O[5a]-2:O-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(OC)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	B[5a](O[5a]C[5a,6a])2(OC){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	112.5290	0.000	1	112.5290	0.000	1	112.2277	0.565	3	112.2256	0.816	5	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:2:	3:3:	3:3:	O[5a]-2:O[5a]-2:O-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(OP)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	B[5a](O[5a]C[5a,6a])2(OP){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	112.7820	0.000	1	112.7820	0.000	1	112.2277	0.565	3	112.2256	0.816	5	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:2:	3:3:	3:3:	O[5a]-2:O[5a]-2:O-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(ORe)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O)	B[5a](O[5a]C[5a,6a])2(ORe){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]O){1|H<1>,2|C<3>}	111.3720	0.000	1	111.3720	0.000	1	112.2277	0.565	3	112.2256	0.816	5	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:B-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(BC[5]B)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	B[5a](O[5a]C[5a,6a])2(BC[5]B){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	107.2585	0.878	2	107.2585	0.770	2	107.2585	0.770	2	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:B[5]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5])	B[5a](O[5a]C[5a,6a])2(B[5]N[5]2){2|C<3>,4|C<4>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5]){1|H<1>,2|C<3>,2|N<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B[5]){1|H<1>,2|C<3>,2|N<3>}	109.8950	0.000	1	109.8950	0.000	1	109.8950	0.000	1	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](O[5a]C[5a,6a])2(B[5a]N[5a]2){2|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|N<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|N<3>}	110.0520	0.000	1	110.0520	0.000	1	110.5865	0.571	2	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2){4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|O<2>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|C<3>,2|O<2>}	111.1210	0.000	1	111.1210	0.000	1	110.5865	0.571	2	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(CCH)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	B[5a](O[5a]C[5a,6a])2(CCH){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	111.3795	0.221	2	111.3795	0.049	2	110.9341	0.825	12	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(CC[6]P)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	B[5a](O[5a]C[5a,6a])2(CC[6]P){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	108.3720	0.000	1	108.3720	0.000	1	110.9341	0.825	12	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(CC[6]Te)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	B[5a](O[5a]C[5a,6a])2(CC[6]Te){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	111.1580	0.329	4	111.1580	0.108	4	110.9341	0.825	12	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(CC[6a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C)	B[5a](O[5a]C[5a,6a])2(CC[6a]C){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C){1|H<1>,2|C<3>}	111.0892	0.595	5	111.0892	0.354	5	110.9341	0.825	12	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C[5]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2){2|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|H<1>,2|C<3>,2|N<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|H<1>,2|C<3>,2|N<3>}	113.1947	0.941	3	113.1947	0.885	3	113.1947	0.885	3	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a])	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|F<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a]){5|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a]){5|C<3>}	111.9420	0.000	1	111.9420	0.000	1	111.4793	0.251	7	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){1|Br<1>,1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	110.8280	0.000	1	111.4022	0.251	6	111.4793	0.251	7	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|F<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	112.0950	0.000	1	111.4022	0.251	6	111.4793	0.251	7	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	111.3725	0.384	4	111.4022	0.251	6	111.4793	0.251	7	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:N-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(NC[6a]C)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	B[5a](O[5a]C[5a,6a])2(NC[6a]C){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	111.4810	0.518	2	111.4810	0.268	2	111.1753	0.414	3	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:N-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(NSiB)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	B[5a](O[5a]C[5a,6a])2(NSiB){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	110.5640	0.000	1	110.5640	0.000	1	111.1753	0.414	3	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:N[6]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(N[6]C[6]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N[6])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N[6])	B[5a](O[5a]C[5a,6a])2(N[6]C[6]2){6|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N[6]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N[6]){1|H<1>,4|C<3>}	114.6630	0.000	1	114.6630	0.000	1	114.6630	0.000	1	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:3:	3:3:	3:3:	O[5a]-2:O[5a]-2:Si-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(SiSi2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Si)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Si)	B[5a](O[5a]C[5a,6a])2(SiSi2){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Si){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Si){1|H<1>,2|C<3>}	110.1870	0.000	1	110.1870	0.000	1	110.1870	0.000	1	111.0972	2.389	32	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:4:	3:3:	3:3:	O[5a]-2:O[5a]-2:B-4:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(BC[5]BH)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	B[5a](O[5a]C[5a,6a])2(BC[5]BH){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	107.1460	0.000	1	107.1460	0.000	1	107.1460	0.000	1	112.4108	12.370	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:4:	3:3:	3:3:	O[5a]-2:O[5a]-2:N-4:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(NC3)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N)	B[5a](O[5a]C[5a,6a])2(NC3){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]N){1|H<1>,2|C<3>}	114.3025	0.200	2	114.3025	0.040	2	114.3025	0.040	2	112.4108	12.370	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	2:2:4:	3:3:	3:3:	O[5a]-2:O[5a]-2:P-4:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](O[5a]C[5a,6a])2(PC3)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]P)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]P)	B[5a](O[5a]C[5a,6a])2(PC3){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]P){1|H<1>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]P){1|H<1>,2|C<3>}	113.8920	0.000	1	113.8920	0.000	1	113.8920	0.000	1	112.4108	12.370	4	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	3:2:2:	3:3:	3:3:	C[5a]-3:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](C[5a]C[5a,6a]C[5a])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a])	B[5a](C[5a]C[5a,6a]C[5a])(O[5a]C[5a,6a])2{1|H<1>,1|N<3>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a]){1|H<1>,4|C<3>}	111.1780	0.334	2	111.1780	0.111	2	111.1780	0.111	2	111.1780	0.111	2	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	4:2:2:	3:3:	3:3:	B[5a]-4:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](B[5a]O[5a]2C[5])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](B[5a]O[5a]2C[5])(O[5a]C[5a,6a])2{2|N<3>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|O<2>,3|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|O<2>,3|C<3>}	109.5650	0.304	2	109.5650	0.092	2	109.5650	0.092	2	110.6453	0.568	7	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	4:2:2:	3:3:	3:3:	C[5]-4:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](C[5]B[5a]C[5]N[5])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	B[5a](C[5]B[5a]C[5]N[5])(O[5a]C[5a,6a])2{2|O<2>,3|C<3>,4|C<4>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|B<3>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|B<3>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	111.0025	0.125	2	111.0025	0.016	2	111.0025	0.016	2	110.6453	0.568	7	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	4:2:2:	3:3:	3:3:	C[6,6]-4:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](C[6,6]C[3x6]N[6,6]H)(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a])	B[5a](C[6,6]C[3x6]N[6,6]H)(O[5a]C[5a,6a])2{3|C<3>,4|C<4>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a]){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6,6]O[5a]){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	111.0855	0.063	2	111.0855	0.004	2	111.0855	0.004	2	110.6453	0.568	7	111.4061	2.825	54	111.4061	2.825	54
3	537	537	5:SP2_SP2_SP2	B[5a]	O[5a]	O[5a]	4:2:2:	3:3:	3:3:	C[6]-4:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a](C[6]C[6a]C[6]P[6])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6])	B[5a](C[6]C[6a]C[6]P[6])(O[5a]C[5a,6a])2{1|Fe<10>,1|H<1>,2|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6]){1|C<4>,1|H<1>,1|P<3>,3|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[6]){1|C<4>,1|H<1>,1|P<3>,3|C<3>}	111.2110	0.000	1	111.2110	0.000	1	111.2110	0.000	1	110.6453	0.568	7	111.4061	2.825	54	111.4061	2.825	54
3	537	610	0:SP2_SP2_SP3	B[5a]	O[5a]	B	2:2:4:	3:3:	4:3:3:1:	O[5a]-2:O[5a]-2:B-4:	C[5a,6a]-3:B[5a]-3:	B-4:B[5a]-3:C[5]-3:H-1:	B[5a](O[5a]C[5a,6a])2(BC[5]BH)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	B(BB[5a]C[5]H)(B[5a]O[5a]2)(C[5]N[5]2)(H)	B[5a](O[5a]C[5a,6a])2(BC[5]BH){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	B(BB[5a]C[5]H)(B[5a]O[5a]2)(C[5]N[5]2)(H)	126.2930	6.167	2	126.2930	38.037	2	126.2930	38.037	2	126.2930	38.037	2	126.2930	38.037	2	126.2930	38.037	2
3	537	643	0:SP2_SP2_SP2	B[5a,6]	O[5a]	C[6,6a]	3:3:2:	3:3:	3:3:3:	N[5,5a,6]-3:C[6,6a]-3:O[5a]-2:	B[5a,6]-3:C[5a]-3:	B[5a,6]-3:C[6,6a]-3:C[6a]-3:	B[5a,6](N[5,5a,6]C[5,6,6]N[5,5a])(C[6,6a]C[6,6a]C[6a])(O[5a]C[5a])	O[5a](B[5a,6]N[5,5a,6]C[6,6a])(C[5a]N[5,5a]O)	C[6,6a](B[5a,6]N[5,5a,6]O[5a])(C[6,6a]C[6,6]C[6a])(C[6a]C[6a]2)	B[5a,6](N[5,5a,6]C[5,6,6]N[5,5a])(C[6,6a]C[6,6a]C[6a])(O[5a]C[5a]){1|B<3>,1|O<1>,2|C<4>,4|C<3>}	O[5a](B[5a,6]N[5,5a,6]C[6,6a])(C[5a]N[5,5a]O){1|B<3>,1|C<4>,2|C<3>}	C[6,6a](B[5a,6]N[5,5a,6]O[5a])(C[6,6a]C[6,6]C[6a])(C[6a]C[6a]2){1|C<4>,1|N<3>,2|H<1>,5|C<3>}	132.1960	0.000	1	132.1960	0.000	1	132.1960	0.000	1	132.1960	0.000	1	132.1960	0.000	1	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:C[6a]-3:C[6a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a])	C[6a](B[5a]O[5a]2)(C[6a]C[6a]F)2	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|F<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a]){5|C<3>}	C[6a](B[5a]O[5a]2)(C[6a]C[6a]F)2{2|F<1>,3|C<3>}	124.0295	0.093	2	124.0295	0.009	2	124.1835	0.692	10	124.2553	3.033	14	124.2364	2.822	15	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:C[6a]-3:C[6a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	C[6a](B[5a]O[5a]2)(C[6a]C[6a]F)2	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|F<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	C[6a](B[5a]O[5a]2)(C[6a]C[6a]F)2{2|F<1>,3|C<3>}	123.9515	0.585	2	123.9515	0.342	2	124.1835	0.692	10	124.2553	3.033	14	124.2364	2.822	15	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:C[6a]-3:C[6a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	C[6a](B[5a]O[5a]2)(C[6a]C[6a]H)2	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	C[6a](B[5a]O[5a]2)(C[6a]C[6a]H)2{2|H<1>,3|C<3>}	124.3122	1.060	6	124.3122	1.124	6	124.1835	0.692	10	124.2553	3.033	14	124.2364	2.822	15	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[6a]-3:B[5a]-3:C[6a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	C[6a](C[6a]C[5,6a]H)(B[5a]O[5a]2)(C[6a]C[6a]H)	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){2|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	C[6a](C[6a]C[5,6a]H)(B[5a]O[5a]2)(C[6a]C[6a]H){1|C<4>,1|H<1>,3|C<3>}	124.2890	1.288	2	124.2890	1.660	2	124.4348	11.007	4	124.2553	3.033	14	124.2364	2.822	15	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[6a]-3:B[5a]-3:C[6a]-3:	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a])	C[6a](C[6a]C[6a]Br)(B[5a]O[5a]2)(C[6a]C[6a]H)	B[5a](O[5a]C[5a,6a])2(C[6a]C[6a]2){1|Br<1>,1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[6a]O[5a]){1|H<1>,4|C<3>}	C[6a](C[6a]C[6a]Br)(B[5a]O[5a]2)(C[6a]C[6a]H){2|H<1>,3|C<3>}	124.5805	5.593	2	124.5805	31.276	2	124.4348	11.007	4	124.2553	3.033	14	124.2364	2.822	15	124.7339	6.593	16
3	537	643	0:SP2_SP2_SP2	B[5a]	O[5a]	C[6a]	3:2:3:	3:3:	3:3:3:	N[5a]-3:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:C[6a]-3:C[6a]-3:	B[5a](N[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]N[5a])	C[6a](B[5a]N[5a]O[5a])(C[6a]C[6a]F)2	B[5a](N[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(C[6a]C[6a]2){2|F<1>,6|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]N[5a]){6|C<3>}	C[6a](B[5a]N[5a]O[5a])(C[6a]C[6a]F)2{2|F<1>,4|C<3>}	123.9720	0.000	1	123.9720	0.000	1	123.9720	0.000	1	123.9720	0.000	1	124.2364	2.822	15	124.7339	6.593	16
3	537	679	0:SP2_SP2_SP3	B[5a]	O[5a]	B[5a]	4:2:2:	3:3:	2:2:3:3:	B[5a]-4:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	O[5a]-2:O[5a]-2:B[5a]-3:C[5]-3:	B[5a](B[5a]O[5a]2C[5])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2)(C[5]N[5]2)	B[5a](B[5a]O[5a]2C[5])(O[5a]C[5a,6a])2{2|N<3>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a]){1|H<1>,2|O<2>,3|C<3>}	B[5a](O[5a]C[5a,6a])2(B[5a]O[5a]2)(C[5]N[5]2){2|C<4>,6|C<3>}	124.6438	2.413	4	124.6438	5.825	4	124.6438	5.825	4	124.6438	5.825	4	124.6438	5.825	4	124.6438	5.825	4
3	537	727	0:SP2_SP2_SP2	B[5a]	O[5a]	C[5a]	3:2:2:	3:3:	3:3:3:	C[5a]-3:O[5a]-2:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:C[5a]-3:	B[5a](C[5a]C[5a,6a]C[5a])(O[5a]C[5a,6a])2	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a])	C[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]2)(C[5a]N[5a]H)	B[5a](C[5a]C[5a,6a]C[5a])(O[5a]C[5a,6a])2{1|H<1>,1|N<3>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]C[5a]O[5a]){1|H<1>,4|C<3>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]2)(C[5a]N[5a]H){1|C<4>,1|H<1>,4|C<3>}	124.3965	0.895	4	124.3965	0.801	4	124.3965	0.801	4	124.3965	0.801	4	123.7964	2.401	5	123.7964	2.401	5
3	537	727	0:SP2_SP2_SP2	B[5a]	O[5a]	C[5a]	3:3:2:	3:2:	3:3:3:	C[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-2:	B[5a]-3:C[5a]-3:C[5a]-3:	B[5a](C[5a]C[5a]2)(N[5a]C[5a]H)(O[5a]N[5a])	O[5a](B[5a]C[5a]N[5a])(N[5a]C[5a])	C[5a](B[5a]N[5a]O[5a])(C[5a]C[5a,6a]H)(C[5a]N[5a,6a]H)	B[5a](C[5a]C[5a]2)(N[5a]C[5a]H)(O[5a]N[5a]){1|N<3>,2|C<3>,2|H<1>}	O[5a](B[5a]C[5a]N[5a])(N[5a]C[5a]){1|H<1>,3|C<3>}	C[5a](B[5a]N[5a]O[5a])(C[5a]C[5a,6a]H)(C[5a]N[5a,6a]H){1|H<1>,1|N<2>,3|C<3>}	121.3960	0.000	1	121.3960	0.000	1	121.3960	0.000	1	121.3960	0.000	1	123.7964	2.401	5	123.7964	2.401	5
3	537	770	0:SP2_SP2_SP2	B[5a]	O[5a]	B	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:B-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:B-3:C[5]-3:	B[5a](O[5a]C[5a,6a])2(BC[5]B)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	B(B[5a]O[5a]2)(BB[5a]C[5])(C[5]N[5]2)	B[5a](O[5a]C[5a,6a])2(BC[5]B){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	B(B[5a]O[5a]2)(BB[5a]C[5])(C[5]N[5]2)	126.6130	2.181	2	126.6130	4.756	2	126.6130	4.756	2	126.2732	10.186	4	126.2732	10.186	4	126.2732	10.186	4
3	537	770	0:SP2_SP2_SP2	B[5a]	O[5a]	B	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:B-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:C[5]-3:B-3:	B[5a](O[5a]C[5a,6a])2(BC[5]B)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B)	B(B[5a]O[5a]2)(C[5]N[5]2)(BC[5]H)	B[5a](O[5a]C[5a,6a])2(BC[5]B){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]B){1|H<1>,2|C<3>}	B(B[5a]O[5a]2)(C[5]N[5]2)(BC[5]H)	125.9335	5.034	2	125.9335	25.340	2	125.9335	25.340	2	126.2732	10.186	4	126.2732	10.186	4	126.2732	10.186	4
3	537	790	0:SP2_SP-NON_SP2	B[5a]	O[5a]	Cl	2:2:1:	3:3:	3:	O[5a]-2:O[5a]-2:Cl-1:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:	B[5a](O[5a]C[5a,6a])2(Cl)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl)	Cl(B[5a]O[5a]2)	B[5a](O[5a]C[5a,6a])2(Cl){2|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]Cl){1|H<1>,2|C<3>}	Cl(B[5a]O[5a]2)	123.1830	0.335	3	123.1830	0.112	3	123.1830	0.112	3	123.1830	0.112	3	123.1830	0.112	3	123.1830	0.112	3
3	537	813	5:SP2_SP2_SP2	B[5a]	O[5a]	N[5a]	3:2:3:	3:3:	3:3:3:	N[5a]-3:O[5a]-2:C[6a]-3:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:C[6a]-3:	B[5a](N[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(C[6a]C[6a]2)	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]N[5a])	N[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a])(C[6a]C[6a]2)	B[5a](N[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(C[6a]C[6a]2){2|F<1>,6|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]N[5a]){6|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a,6a])(B[5a]C[6a]O[5a])(C[6a]C[6a]2){2|C<4>,7|C<3>}	109.4950	0.000	1	109.4950	0.000	1	109.4950	0.000	1	109.4950	0.000	1	107.6110	2.110	4	107.6110	2.110	4
3	537	813	5:SP2_SP2_SP2	B[5a]	O[5a]	N[5a]	3:3:2:	3:2:	3:3:1:	C[5a]-3:N[5a]-3:O[5a]-2:	B[5a]-3:N[5a]-2:	B[5a]-3:C[5a]-3:H-1:	B[5a](C[5a]C[5a]2)(N[5a]C[5a]H)(O[5a]N[5a])	O[5a](B[5a]C[5a]N[5a])(N[5a]C[5a])	N[5a](B[5a]C[5a]O[5a])(C[5a]C[6a]N[5a])(H)	B[5a](C[5a]C[5a]2)(N[5a]C[5a]H)(O[5a]N[5a]){1|N<3>,2|C<3>,2|H<1>}	O[5a](B[5a]C[5a]N[5a])(N[5a]C[5a]){1|H<1>,3|C<3>}	N[5a](B[5a]C[5a]O[5a])(C[5a]C[6a]N[5a])(H){4|C<3>}	105.9640	0.000	1	105.9640	0.000	1	105.9640	0.000	1	105.9640	0.000	1	107.6110	2.110	4	107.6110	2.110	4
3	537	813	5:SP2_SP2_SP2	B[5a]	O[5a]	N[5a]	3:3:2:	3:3:	3:3:1:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:H-1:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(H)	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]H)(O[5a]C[5a,6a]){1|H<1>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a]){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	107.6310	0.000	1	107.6310	0.000	1	107.6310	0.000	1	107.6310	0.000	1	107.6110	2.110	4	107.6110	2.110	4
3	537	813	5:SP2_SP2_SP2	B[5a]	O[5a]	N[5a]	3:3:2:	3:3:	3:3:4:	B[5a]-3:N[5a]-3:O[5a]-2:	C[5a,6a]-3:B[5a]-3:	C[5a,6a]-3:B[5a]-3:C-4:	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a])	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a])	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(CH3)	B[5a](B[5a]N[5a]O[5a])(N[5a]C[5a,6a]C)(O[5a]C[5a,6a]){1|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]N[5a]){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]B[5a]O[5a])(CH3){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	107.3540	0.000	1	107.3540	0.000	1	107.3540	0.000	1	107.3540	0.000	1	107.6110	2.110	4	107.6110	2.110	4
3	537	813	5:SP2_SP2_SP3	B[5a,6]	O[5a]	N[5,5a,6]	3:3:2:	3:3:	4:3:3:	N[5,5a,6]-3:C[6,6a]-3:O[5a]-2:	B[5a,6]-3:C[5a]-3:	C[5,6,6]-4:B[5a,6]-3:N[5,5a]-3:	B[5a,6](N[5,5a,6]C[5,6,6]N[5,5a])(C[6,6a]C[6,6a]C[6a])(O[5a]C[5a])	O[5a](B[5a,6]N[5,5a,6]C[6,6a])(C[5a]N[5,5a]O)	N[5,5a,6](C[5,6,6]C[5,6]C[6,6]C)(B[5a,6]C[6,6a]O[5a])(N[5,5a]C[5a]B[5])	B[5a,6](N[5,5a,6]C[5,6,6]N[5,5a])(C[6,6a]C[6,6a]C[6a])(O[5a]C[5a]){1|B<3>,1|O<1>,2|C<4>,4|C<3>}	O[5a](B[5a,6]N[5,5a,6]C[6,6a])(C[5a]N[5,5a]O){1|B<3>,1|C<4>,2|C<3>}	N[5,5a,6](C[5,6,6]C[5,6]C[6,6]C)(B[5a,6]C[6,6a]O[5a])(N[5,5a]C[5a]B[5]){1|H<1>,1|O<1>,5|C<3>}	107.6730	0.000	1	107.6730	0.000	1	107.6730	0.000	1	107.6730	0.000	1	107.6730	0.000	1	107.6730	0.000	1
3	537	818	0:SP2_SP2_SP2	B[5a]	O[5a]	C[5]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[5]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:N[5]-3:N[5]-3:	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	C[5](B[5a]O[5a]2)(N[5]C[5]C)2	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2){2|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|H<1>,2|C<3>,2|N<3>}	C[5](B[5a]O[5a]2)(N[5]C[5]C)2{2|C<3>,2|C<4>}	123.8235	0.586	2	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6
3	537	818	0:SP2_SP2_SP2	B[5a]	O[5a]	C[5]	2:2:3:	3:3:	3:3:3:	O[5a]-2:O[5a]-2:C[5]-3:	C[5a,6a]-3:B[5a]-3:	B[5a]-3:N[5]-3:N[5]-3:	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2)	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5])	C[5](B[5a]O[5a]2)(N[5]C[5]C)2	B[5a](O[5a]C[5a,6a])2(C[5]N[5]2){2|C<4>,4|C<3>}	O[5a](C[5a,6a]C[5a,6a]C[6a])(B[5a]O[5a]C[5]){1|H<1>,2|C<3>,2|N<3>}	C[5](B[5a]O[5a]2)(N[5]C[5]C)2{2|C<3>,2|H<1>}	123.1875	0.977	4	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6	123.3995	0.750	6