542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:2:4:	3:	C[5]-3:N[5]-3:O-1:	N[5]-3:O[5]-2:C-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]O[5]C)(O)	N[5](N[5]C[5]O)(O[5]C[5])(CH3)	O(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]O[5]C)(O){1|O<1>}	N[5](N[5]C[5]O)(O[5]C[5])(CH3){1|C<3>,1|O<1>}	O(N[5]C[5]N[5])	115.7170	0.000	1	115.7170	0.000	1	115.7170	0.000	1	115.7170	0.000	1	121.8281	4.227	12	121.8281	4.227	12
542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:3:2:	3:	C[5,6a]-3:N[5]-3:O-1:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O)	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a])	O(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O){1|H<1>,4|C<3>}	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a]){1|H<1>,1|O<2>,4|C<3>}	O(N[5]C[5,6a]N[5])	123.4790	0.000	1	123.5950	0.027	2	123.5950	0.027	2	123.5950	0.027	2	121.8281	4.227	12	121.8281	4.227	12
542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:3:2:	3:	C[5,6a]-3:N[5]-3:O-1:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O)	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a])	O(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O){1|H<1>,4|C<3>}	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a]){1|H<1>,5|C<3>}	O(N[5]C[5,6a]N[5])	123.7110	0.000	1	123.5950	0.027	2	123.5950	0.027	2	123.5950	0.027	2	121.8281	4.227	12	121.8281	4.227	12
542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:3:3:	3:	C[5]-3:N[5]-3:O-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[6a]C[5])(O)	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]O)	O(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[6a]C[5])(O){2|H<1>,4|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]O){3|C<3>,3|H<1>}	O(N[5]C[5]N[5])	122.7600	0.000	2	122.7600	0.000	2	122.7600	0.000	2	122.7600	0.000	2	121.8281	4.227	12	121.8281	4.227	12
542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:3:4:	3:	C[5,6a]-3:N[5]-3:O-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(O)	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]O)(CCCH)	O(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(O){2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]O)(CCCH){2|C<3>}	O(N[5]C[5,6a]N[5])	121.9710	0.000	1	121.9710	0.000	1	121.9710	0.000	1	121.9300	0.179	7	121.8281	4.227	12	121.8281	4.227	12
542	542	863	0:SP2_SP2_SP2	N[5]	N[5]	O	3:3:1:	3:3:4:	3:	C[5,6a]-3:N[5]-3:O-1:	C[5]-3:N[5]-3:C[6]-4:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O)	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]O)(C[6]C[6]2H)	O(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]C[6])(O){2|C<3>,2|C<4>,3|H<1>}	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]O)(C[6]C[6]2H){2|C<3>,2|C<4>,4|H<1>}	O(N[5]C[5,6a]N[5])	121.9232	0.463	6	121.9232	0.214	6	121.9232	0.214	6	121.9300	0.179	7	121.8281	4.227	12	121.8281	4.227	12
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:3:4:	7:3:3:	3:3:3:1:	N[5,6,6]-3:C[5,6a]-3:B[3x6]-4:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(C[5,6a]C[5,6a]C[6a])(B[3x6]N[5,6,6]2H)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]2Cl2)(N[5,6,6]C[5,6a]B[3x6])(C[5]C[5,6a]C)	B[3x6](N[5,6,6]N[5,6,6]C[5,6a])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(C[5,6a]C[5,6a]C[6a])(B[3x6]N[5,6,6]2H){2|Cl<1>,1|C<4>,1|H<1>,2|N<3>,6|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]2Cl2)(N[5,6,6]C[5,6a]B[3x6])(C[5]C[5,6a]C){1|C<4>,1|H<1>,2|N<3>,5|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5,6a])3(H){1|Nb<7>,9|C<3>}	120.9703	0.366	3	120.9703	0.134	3	120.9703	0.134	3	120.9703	0.134	3	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	4:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	B[3x6]-4:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]B[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]H)	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]B[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]H){2|H<1>,2|N<3>,3|C<3>}	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H){2|N<3>,3|H<1>,4|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|B<4>,3|H<1>,6|C<3>}	114.7800	1.014	2	114.7800	1.028	2	114.7800	1.028	2	114.7800	1.028	2	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	6:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Ge[3x6]-6:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Ge[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Ge[3x6]N[5,6,6]2N3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Ge[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|C<4>,1|H<1>,2|C<3>,2|N<3>,3|N<2>}	N[5,6,6](Ge[3x6]N[5,6,6]2N3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Ge<6>,3|C<4>,6|C<3>}	119.0983	0.625	3	119.0983	0.391	3	119.0983	0.391	3	120.4042	0.858	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	6:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	In[4x6]-6:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]In[4x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](In[4x6]N[5,6,6]2O[6]2Cl)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]In[4x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|Cl<1>,1|C<4>,1|H<1>,2|C<3>,2|N<3>,2|O<2>}	N[5,6,6](In[4x6]N[5,6,6]2O[6]2Cl)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){1|C<4>,2|H<1>,2|N<3>,4|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|In<6>,3|C<4>,6|C<3>}	121.2127	0.795	3	121.2127	0.633	3	121.2127	0.633	3	120.4042	0.858	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	6:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3x6]-6:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3x6]N[5,6,6]2ClCN)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|Cl<1>,1|H<1>,1|N<2>,2|C<3>,2|C<4>,2|N<3>}	N[5,6,6](Nb[3x6]N[5,6,6]2ClCN)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<6>,3|C<4>,6|C<3>}	120.7903	0.377	6	120.7903	0.142	6	120.7903	0.142	6	120.4042	0.858	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	6:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[4x6]-6:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[4x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[4x6]N[5,6,6]2C[6]O[6]O)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[4x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|N<3>,3|C<3>}	N[5,6,6](Nb[4x6]N[5,6,6]2C[6]O[6]O)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|H<1>,2|N<3>,3|C<3>,3|C<4>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<6>,3|C<4>,6|C<3>}	120.1293	0.725	3	120.1293	0.525	3	120.1293	0.525	3	120.4042	0.858	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	7:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]3C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|C<2>,1|H<1>,2|C<4>,2|N<3>,4|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]3C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|C<3>,2|N<3>,3|H<1>,5|C<4>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<7>,3|C<4>,6|C<3>}	120.7467	0.315	3	120.8595	0.081	6	120.7531	0.291	15	120.7531	0.291	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	7:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]3C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|H<1>,2|N<3>,3|C<4>,4|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[3]3C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|C<3>,2|N<3>,3|H<1>,5|C<4>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<7>,3|C<4>,6|C<3>}	120.9723	0.256	3	120.8595	0.081	6	120.7531	0.291	15	120.7531	0.291	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	7:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[5a]C[3]3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|H<1>,2|C<4>,2|N<3>,5|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[5a]C[3]3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){1|O<2>,2|N<3>,3|C<3>,3|H<1>,5|C<4>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<7>,3|C<4>,6|C<3>}	120.5210	0.714	3	120.5210	0.510	3	120.7531	0.291	15	120.7531	0.291	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	7:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[6a]2C[3]2)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|C<4>,1|H<1>,2|N<3>,6|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[6a]2C[3]2)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|H<1>,2|N<3>,3|C<4>,6|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<7>,3|C<4>,6|C<3>}	120.4800	0.946	3	120.4800	0.895	3	120.7531	0.291	15	120.7531	0.291	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	7:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3x6]-7:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[6a]C[3]3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|H<1>,2|C<4>,2|N<3>,5|C<3>}	N[5,6,6](Nb[3,3x6]N[5,6,6]2C[6a]C[3]3)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|N<3>,3|H<1>,4|C<3>,5|C<4>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<7>,3|C<4>,6|C<3>}	121.0453	0.276	3	121.0453	0.076	3	120.7531	0.291	15	120.7531	0.291	15	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	8:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3,3x6]-8:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3,3x6]N[5,6,6]2C[3,3]2C[3]2N[6])(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|H<1>,3|C<4>,3|N<3>,4|C<3>}	N[5,6,6](Nb[3,3,3x6]N[5,6,6]2C[3,3]2C[3]2N[6])(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|N<3>,4|C<3>,4|C<4>,4|H<1>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<8>,3|C<4>,6|C<3>}	120.8877	0.460	3	120.8877	0.212	3	120.8522	0.315	6	120.8522	0.315	6	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	3:4:3:	8:3:3:	3:3:3:1:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	Nb[3,3,3x6]-8:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:H-1:	N[5,6,6](N[5,6,6]Nb[3,3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C)	N[5,6,6](Nb[3,3,3x6]N[5,6,6]2C[3,6a]2C[3]2C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H)	N[5,6,6](N[5,6,6]Nb[3,3,3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]C){1|C<2>,1|C<4>,1|H<1>,2|N<3>,6|C<3>}	N[5,6,6](Nb[3,3,3x6]N[5,6,6]2C[3,6a]2C[3]2C)(N[5,6,6]B[3x6]C[5])(C[5]C[5]C){2|H<1>,2|N<3>,3|C<4>,4|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(H){1|Nb<8>,3|C<4>,6|C<3>}	120.8167	0.757	3	120.8167	0.573	3	120.8522	0.315	6	120.8522	0.315	6	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	4:3:3:	3:4:3:	3:3:3:3:	B[3x6]-4:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:B[3x6]-4:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:C[6a]-3:	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H)	N[5,6,6](N[5,6,6]B[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]H)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(C[6a]C[6a]2)	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H){2|N<3>,3|H<1>,4|C<3>}	N[5,6,6](N[5,6,6]B[3x6]C[5])(B[3x6]N[5,6,6]2H)(C[5]C[5]H){2|H<1>,2|N<3>,3|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(C[6a]C[6a]2){1|B<4>,5|H<1>,8|C<3>}	114.8060	1.469	2	114.8060	2.159	2	114.8060	2.159	2	114.8060	2.159	2	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6,6]	N[5,6,6]	B[3x6]	4:3:3:	4:3:3:	3:3:3:3:	B[3x6]-4:N[5,6,6]-3:C[5]-3:	B[3x6]-4:N[5,6,6]-3:C[5]-3:	N[5,6,6]-3:N[5,6,6]-3:N[5,6,6]-3:C[6a]-3:	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H)	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H)	B[3x6](N[5,6,6]N[5,6,6]C[5])3(C[6a]C[6a]2)	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H){2|H<1>,2|N<3>,5|C<3>}	N[5,6,6](B[3x6]N[5,6,6]2C[6a])(N[5,6,6]B[3x6]C[5])(C[5]C[5]H){2|H<1>,2|N<3>,5|C<3>}	B[3x6](N[5,6,6]N[5,6,6]C[5])3(C[6a]C[6a]2){1|B<4>,5|H<1>,8|C<3>}	115.1372	1.796	6	115.1372	3.226	6	115.1372	3.226	6	115.1372	3.226	6	119.4975	6.111	49	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:3:4:	3:4:3:	3:3:4:4:	C[5,6a]-3:N[5,6]-3:B[6]-4:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[6]C[5])(B[6]N[5,6]CC)	N[5,6](N[5,6]C[5,6a]B[6])(B[6]N[5,6]CC)(C[5]C[5,6a]H)	B[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CCHH)2	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[6]C[5])(B[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	N[5,6](N[5,6]C[5,6a]B[6])(B[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	B[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CCHH)2{1|B<4>,1|H<1>,5|C<3>}	126.0435	0.326	2	126.0435	0.106	2	126.0435	0.106	2	126.0435	0.106	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:2:	3:4:3:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-2:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5])	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(F)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]){1|C<3>,1|H<1>,1|I<1>,1|N<3>,2|F<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H){1|C<2>,1|I<1>,1|N<3>,2|F<1>}	B[6](N[5,6]N[5,6]C[5])2(F)2{1|B<4>,1|C<2>,1|H<1>,3|C<3>}	120.4000	0.000	1	120.4000	0.000	1	120.4000	0.000	1	120.0325	0.270	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:2:	3:4:3:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-2:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:H-1:H-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5])	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(H)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]){1|C<3>,1|I<1>,1|N<3>,3|H<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H){1|C<2>,1|I<1>,1|N<3>,2|H<1>}	B[6](N[5,6]N[5,6]C[5])2(H)2{1|B<4>,1|C<2>,1|H<1>,3|C<3>}	119.6650	0.000	1	119.6650	0.000	1	119.6650	0.000	1	120.0325	0.270	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:3:3:	3:3:3:3:	N[5,6]-3:B[6]-4:C[5]-3:	C[6,6a]-3:N[5,6]-3:C[5]-3:	N[5,6]-3:N[6]-3:C[6a]-3:C[6a]-3:	N[5,6](N[5,6]C[6,6a]C[5])(B[6]C[6a]2N[6])(C[5]C[5]H)	N[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])(N[6]C[6,6a]H)(C[6a]C[6a]2)2	N[5,6](N[5,6]C[6,6a]C[5])(B[6]C[6a]2N[6])(C[5]C[5]H){3|H<1>,6|C<3>}	N[5,6](C[6,6a]C[6,6a]C[6a])(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<3>,3|H<1>,4|C<3>}	B[6](N[5,6]N[5,6]C[5])(N[6]C[6,6a]H)(C[6a]C[6a]2)2{5|H<1>,8|C<3>}	120.2412	0.751	5	120.2412	0.563	5	120.2412	0.563	5	120.2412	0.563	5	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:3:4:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]C[5a]O[5])	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]C[5a]O[5]){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|N<3>,2|C<3>,2|F<1>}	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2{1|B<4>,1|C<4>,1|O<2>,4|C<3>}	123.3585	0.904	2	123.4593	0.439	3	123.8750	0.984	4	123.8750	0.984	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:3:4:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]C[5a]O[5])	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]C[5a]O[5]){1|H<1>,1|O<2>,2|F<1>,3|C<3>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|N<3>,2|C<3>,2|F<1>}	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2{1|B<4>,1|C<4>,1|O<2>,4|C<3>}	123.6610	0.000	1	123.4593	0.439	3	123.8750	0.984	4	123.8750	0.984	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:3:4:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:C[6]-3:B[5]-4:	N[5a,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]O[5]C)	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF)	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2	N[5,6](N[5,6]B[5]C[6])(B[6]N[5a,6]FF)(C[5]O[5]C){1|H<1>,2|C<3>,2|F<1>}	N[5,6](N[5,6]B[6]C[5])(C[6]C[5a,6]H)(B[5]O[5]FF){1|C<3>,1|C<4>,1|N<3>,2|F<1>}	B[6](N[5a,6]C[5a,6]C[5a])(N[5,6]N[5,6]C[5])(F)2{1|B<4>,1|O<2>,2|C<4>,3|C<3>}	125.1220	0.000	1	125.1220	0.000	1	123.8750	0.984	4	123.8750	0.984	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:3:4:	3:3:4:4:	N[5,6]-3:B[6]-4:C[5]-3:	C[5,6a]-3:N[5,6]-3:B[6]-4:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](N[5,6]C[5,6a]B[6])(B[6]N[5,6]CC)(C[5]C[5,6a]H)	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[6]C[5])(B[6]N[5,6]CC)	B[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CCHH)2	N[5,6](N[5,6]C[5,6a]B[6])(B[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]B[6]C[5])(B[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	B[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CCHH)2{1|B<4>,1|H<1>,5|C<3>}	126.5615	0.479	2	126.5615	0.229	2	126.5615	0.229	2	126.5615	0.229	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:2:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-2:	N[5,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5])	B[6](N[5,6]N[5,6]C[5])2(F)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H){1|C<2>,1|I<1>,1|N<3>,2|F<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]){1|C<3>,1|H<1>,1|I<1>,1|N<3>,2|F<1>}	B[6](N[5,6]N[5,6]C[5])2(F)2{1|B<4>,1|C<2>,1|H<1>,3|C<3>}	121.8670	0.000	1	121.8670	0.000	1	121.8670	0.000	1	121.3040	0.634	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:2:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-2:	N[5,6]-3:N[5,6]-3:H-1:H-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5])	B[6](N[5,6]N[5,6]C[5])2(H)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H){1|C<2>,1|I<1>,1|N<3>,2|H<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]){1|C<3>,1|I<1>,1|N<3>,3|H<1>}	B[6](N[5,6]N[5,6]C[5])2(H)2{1|B<4>,1|C<2>,1|H<1>,3|C<3>}	120.7410	0.000	1	120.7410	0.000	1	120.7410	0.000	1	121.3040	0.634	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:3:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:F-1:F-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(F)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H){1|C<2>,1|C<3>,1|H<1>,1|N<3>,2|F<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]FF)(C[5]C[5]H){1|C<2>,1|C<3>,1|H<1>,1|N<3>,2|F<1>}	B[6](N[5,6]N[5,6]C[5])2(F)2{1|B<4>,2|H<1>,4|C<3>}	126.1235	0.074	2	126.1235	0.006	2	126.1235	0.006	2	123.3372	10.375	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:3:	3:3:1:1:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:H-1:H-1:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(H)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H){1|C<2>,1|C<3>,1|N<3>,3|H<1>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]HH)(C[5]C[5]H){1|C<2>,1|C<3>,1|N<3>,3|H<1>}	B[6](N[5,6]N[5,6]C[5])2(H)2{1|B<4>,2|H<1>,4|C<3>}	120.5510	0.256	2	120.5510	0.066	2	120.5510	0.066	2	123.3372	10.375	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:3:	3:3:4:4:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(CCHH)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H){1|C<2>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H){1|C<2>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	B[6](N[5,6]N[5,6]C[5])2(CCHH)2{1|B<4>,2|H<1>,4|C<3>}	125.5987	1.544	10	125.7166	2.347	14	125.7166	2.347	14	125.7166	2.347	14	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	3:4:3:	3:4:3:	3:3:4:4:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:B[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H)	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(CCHH)2	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	N[5,6](N[5,6]B[6]C[5])(B[6]N[5,6]CC)(C[5]C[5]H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	B[6](N[5,6]N[5,6]C[5])2(CCHH)2{1|B<4>,2|H<1>,4|C<3>}	126.0115	1.690	4	125.7166	2.347	14	125.7166	2.347	14	125.7166	2.347	14	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:2:	4:3:3:	3:3:3:3:	B[6]-4:N[5,6]-3:N[5]-2:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5])	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C)	B[6](N[5,6]N[5,6]N[5])2(C[6a]C[6a]2)2	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5]){1|N<2>,1|N<3>,8|C<3>}	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C){1|N<3>,8|C<3>}	B[6](N[5,6]N[5,6]N[5])2(C[6a]C[6a]2)2{1|B<4>,4|F<1>,8|C<3>}	124.2765	0.228	2	124.2765	0.052	2	124.2765	0.052	2	124.2765	0.052	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:2:	3:3:3:3:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:C[6a]-3:C[6a]-3:	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C)	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5])	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)2	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C){1|N<3>,8|C<3>}	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5]){1|N<2>,1|N<3>,8|C<3>}	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)2{1|B<4>,2|N<2>,4|F<1>,8|C<3>}	121.5745	0.261	2	121.5745	0.068	2	121.5745	0.068	2	121.5745	0.068	2	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:1:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:N[5a]-3:H-1:	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H)	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,2|C<3>,2|N<3>,3|H<1>}	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,2|C<3>,2|N<3>,3|H<1>}	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H){1|B<4>,3|H<1>,6|C<3>}	121.6702	0.674	4	121.6702	0.454	4	121.5679	3.253	8	121.5679	3.253	8	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:1:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:N[5a]-3:H-1:	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[6a]C[5])	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H)	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,2|H<1>,2|N<3>,3|C<3>}	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[6a]C[5]){1|N<2>,2|N<3>,3|H<1>,4|C<3>}	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H){1|B<4>,2|H<1>,7|C<3>}	123.5730	1.735	2	123.5730	3.011	2	121.5679	3.253	8	121.5679	3.253	8	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:1:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:N[5a]-3:H-1:	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[6a]C[5])	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H)	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[6a]C[5]){1|N<2>,2|N<3>,3|H<1>,4|C<3>}	N[5,6](B[6]N[5,6]N[5a]H)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,2|H<1>,2|N<3>,3|C<3>}	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(H){1|B<4>,2|H<1>,7|C<3>}	119.3580	0.740	2	119.3580	0.547	2	121.5679	3.253	8	121.5679	3.253	8	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:2:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:C[6a]-3:O-2:	N[5,6](B[6]N[5,6]C[6a]O)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]C[6a]O)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)(OC)	N[5,6](B[6]N[5,6]C[6a]O)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<3>,1|O<2>,2|H<1>,4|C<3>}	N[5,6](B[6]N[5,6]C[6a]O)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<3>,1|O<2>,2|H<1>,4|C<3>}	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)(OC){1|B<4>,4|H<1>,6|C<3>}	124.7885	1.741	14	124.7885	3.030	14	124.7885	3.030	14	124.8834	2.415	18	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:2:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:N[5a]-3:O-2:	N[5,6](B[6]N[5,6]N[5a]O)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]N[5a]O)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(OB[6])	N[5,6](B[6]N[5,6]N[5a]O)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,1|O<2>,2|C<3>,2|H<1>,2|N<3>}	N[5,6](B[6]N[5,6]N[5a]O)(N[5,6]B[6]C[5])(C[5]C[5]H){1|N<2>,1|O<2>,2|C<3>,2|H<1>,2|N<3>}	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])(OB[6]){1|B<4>,3|H<1>,6|C<3>}	125.2157	0.604	4	125.2157	0.365	4	125.2157	0.365	4	124.8834	2.415	18	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:3:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:N[5a]-3:N[5a]-3:	N[5,6](B[6]N[5,6]N[5a]2)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]N[5a]2)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])2	N[5,6](B[6]N[5,6]N[5a]2)(N[5,6]B[6]C[5])(C[5]C[5]H){2|H<1>,2|N<2>,3|C<3>,3|N<3>}	N[5,6](B[6]N[5,6]N[5a]2)(N[5,6]B[6]C[5])(C[5]C[5]H){2|H<1>,2|N<2>,3|C<3>,3|N<3>}	B[6](N[5,6]N[5,6]C[5])2(N[5a]C[5a]N[5a])2{1|B<4>,4|H<1>,8|C<3>}	123.2990	1.327	4	123.2990	1.760	4	123.2990	1.760	4	123.2990	1.760	4	123.8682	5.552	73	122.1128	10.357	122
542	542	874	6:SP2_SP2_SP3	N[5,6]	N[5,6]	B[6]	4:3:3:	4:3:3:	3:3:3:4:	B[6]-4:N[5,6]-3:C[5]-3:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:N[5,6]-3:C[6a]-3:C-4:	N[5,6](B[6]N[5,6]C[6a]C)(N[5,6]B[6]C[5])(C[5]C[5]H)	N[5,6](B[6]N[5,6]C[6a]C)(N[5,6]B[6]C[5])(C[5]C[5]H)	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)(CC3)	N[5,6](B[6]N[5,6]C[6a]C)(N[5,6]B[6]C[5])(C[5]C[5]H){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N[5,6](B[6]N[5,6]C[6a]C)(N[5,6]B[6]C[5])(C[5]C[5]H){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	B[6](N[5,6]N[5,6]C[5])2(C[6a]C[6a]2)(CC3){1|B<4>,4|H<1>,6|C<3>}	124.7665	1.273	4	124.7665	1.621	4	124.7665	1.621	4	124.7665	1.621	4	123.8682	5.552	73	122.1128	10.357	122
542	542	891	5:SP2_SP2_SP2	N[5]	N[5]	S[5]	3:2:3:	4:3:3:	3:3:	N[5]-3:S[5]-2:C-3:	C[5,6]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	S[5](C[5]C[5,6]N)(N[5]N[5]C)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	S[5](C[5]C[5,6]N)(N[5]N[5]C){1|C<4>,2|C<3>}	109.8850	0.000	1	109.8850	0.000	1	109.8850	0.000	1	109.8850	0.000	1	109.8850	0.000	1	109.8850	0.000	1
542	542	891	5:SP3_SP2_SP2	N[5]	N[5]	S[5]	3:2:3:	4:3:3:	3:3:	N[5]-3:S[5]-2:C-3:	C[5,6]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	S[5](C[5]C[5,6]N)(N[5]N[5]C)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	S[5](C[5]C[5,6]N)(N[5]N[5]C){1|C<4>,2|C<3>}	108.8380	0.000	1	108.8380	0.000	1	108.8380	0.000	1	108.8380	0.000	1	108.8380	0.000	1	108.8380	0.000	1
542	542	928	5:SP2_SP2_SPD6	N[5]	N[5]	Si[5,5]	6:3:3:	3:3:1:	3:3:2:2:1:1:	Si[5,5]-6:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:O[5]-2:O[5]-2:Br-1:Br-1:	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC)	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H)	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(Br)2	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC){1|N<3>,3|C<3>}	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H){2|Br<1>,1|N<3>,1|O<2>,2|C<3>}	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(Br)2{2|C<3>,2|H<1>}	109.0400	0.000	1	109.0400	0.000	1	109.0400	0.000	1	109.0400	0.000	1	109.0400	0.000	1	109.0400	0.000	1
542	542	930	0:SP2_SP2_SP2	N[5,6]	N[5,6]	C	4:3:3:	4:3:3:	3:2:1:	C[5,5,6]-4:N[5,6]-3:C-3:	C[5,5,6]-4:N[5,6]-3:C-3:	N[5,6]-3:O-2:O-1:	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO)	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO)	C(N[5,6]C[5,5,6]N[5,6])(OC)(O)	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO){1|C<3>,2|H<1>,3|C<4>}	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO){3|C<4>,3|H<1>}	C(N[5,6]C[5,5,6]N[5,6])(OC)(O)	118.7220	0.000	1	117.2120	4.560	2	117.2120	4.560	2	117.2120	4.560	2	117.2120	4.560	2	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5,6]	N[5,6]	C	4:3:3:	4:3:3:	3:2:1:	C[5,5,6]-4:N[5,6]-3:C-3:	C[5,5,6]-4:N[5,6]-3:C-3:	N[5,6]-3:O-2:O-1:	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO)	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO)	C(N[5,6]C[5,5,6]N[5,6])(OC)(O)	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO){3|C<4>,3|H<1>}	N[5,6](C[5,5,6]C[3,5,5]C[5,6]H)(N[5,6]C[5,5,6]C)(COO){1|C<3>,2|H<1>,3|C<4>}	C(N[5,6]C[5,5,6]N[5,6])(OC)(O)	115.7020	0.000	1	117.2120	4.560	2	117.2120	4.560	2	117.2120	4.560	2	117.2120	4.560	2	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5,6]	C	3:3:3:	3:4:3:	3:3:1:	C[5,6a]-3:N[5,6]-3:C-3:	C[6,6a]-3:C[5,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CC[6a]O)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6]H)(N[5]C[5,6a]C)	C(N[5]C[5,6a]N[5,6])(C[6a]C[6a]2)(O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5,6]C[6,6a]C[5,6])(CC[6a]O){2|H<1>,5|C<3>}	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6a]C[6]H)(N[5]C[5,6a]C){2|H<1>,5|C<3>}	C(N[5]C[5,6a]N[5,6])(C[6a]C[6a]2)(O)	119.0270	0.000	1	119.0270	0.000	1	119.0270	0.000	1	119.0270	0.000	1	119.4327	0.142	3	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5,6]	C	3:4:3:	3:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[6,6a]-3:C[5,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[6,6a]C[5,6])(C[5]C[5]HH)(CC[6a]O)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]H)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[6,6a]C[5,6])(C[5]C[5]HH)(CC[6a]O){2|H<1>,4|C<3>}	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]H)(N[5]C[5]C){4|C<3>,5|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	119.6355	0.190	2	119.6355	0.036	2	119.6355	0.036	2	119.6355	0.036	2	119.4327	0.142	3	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:2:3:	4:3:3:	3:2:1:	N[5]-3:S[5]-2:C-3:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	C(N[5]N[5]S[5])(OC)(O)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	C(N[5]N[5]S[5])(OC)(O)	117.8370	0.000	1	117.8370	0.000	1	117.8370	0.000	1	117.8370	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:3:3:	3:3:3:	3:2:1:	N[5]-3:N[5]-3:C-3:	N[5,6]-3:C[6a]-3:N[5]-3:	N[5]-3:O-2:O-1:	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO)	N[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]N[5]C)	C(N[5]N[5]2)(OC)(O)	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO){1|H<1>,4|C<3>}	N[5](N[5,6]C[5,6]C[6])(C[6a]C[6a]2)(N[5]N[5]C){4|H<1>,5|C<3>}	C(N[5]N[5]2)(OC)(O)	115.4660	0.000	1	115.4660	0.000	1	115.4660	0.000	1	115.4660	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO)	N[5](C[5]N[5]CC)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO){1|C<4>,3|C<3>}	N[5](C[5]N[5]CC)(N[5]C[5]C)(COO){1|C<3>}	C(N[5]C[5]N[5])(OC)(O)	117.4730	0.000	1	117.4730	0.000	1	118.5280	2.052	3	117.3290	7.119	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]N[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]N[5]H)(N[5]C[5]C)(COO){2|C<3>}	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){1|H<1>,2|C<3>}	C(N[5]C[5]N[5])(OC)(O)	117.9520	0.000	1	117.9520	0.000	1	118.5280	2.052	3	117.3290	7.119	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]N[5]S)(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]N[5]S)(N[5]C[5]C)(COO){2|C<3>}	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){1|S<2>,2|C<3>}	C(N[5]C[5]N[5])(OC)(O)	120.1590	0.000	1	120.1590	0.000	1	118.5280	2.052	3	117.3290	7.119	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	N[5]-3:N[5]-3:C-3:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO)	N[5](C[5,6]C[6,6a]N[5,6]H)(N[5]N[5]C)(COO)	C(N[5]N[5]2)(OC)(O)	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO){1|H<1>,4|C<3>}	N[5](C[5,6]C[6,6a]N[5,6]H)(N[5]N[5]C)(COO){4|C<3>}	C(N[5]N[5]2)(OC)(O)	113.7320	0.000	1	113.7320	0.000	1	113.7320	0.000	1	117.3290	7.119	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:2:3:	3:2:1:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:S[5]-2:C-3:	N[5]-3:O-2:O-1:	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	C(N[5]C[5,6]N[5])(OC)(O)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	C(N[5]C[5,6]N[5])(OC)(O)	115.2360	0.000	1	115.2360	0.000	1	115.2360	0.000	1	115.2360	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:1:	3:3:3:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5]-3:C-3:C-3:	N[5](C[5]C[5]HH)(N[5]C[5]H)(CCC)	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CCH)(CCO)	N[5](C[5]C[5]HH)(N[5]C[5]H)(CCC){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]C)(H){4|H<1>}	C(N[5]C[5]N[5])(CCH)(CCO)	123.4520	0.000	1	123.4520	0.000	1	123.4520	0.000	1	123.4520	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:1:	3:4:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CH3)(O)	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCO){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]C)(H){1|C<3>,3|H<1>}	C(N[5]C[5]N[5])(CH3)(O)	120.8240	0.000	1	120.8240	0.000	1	120.8240	0.000	1	120.8240	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5,6]C[6,6a]N[5,6]H)(N[5]N[5]C)(COO)	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO)	C(N[5]C[5,6]N[5])(OC)(O)	N[5](C[5,6]C[6,6a]N[5,6]H)(N[5]N[5]C)(COO){4|C<3>}	N[5](N[5]N[5,6]C[6a])(N[5]C[5,6]C)(COO){1|H<1>,4|C<3>}	C(N[5]C[5,6]N[5])(OC)(O)	116.2180	0.000	1	116.2180	0.000	1	116.2180	0.000	1	116.7638	3.028	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	N[5](C[5]N[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){1|H<1>,2|C<3>}	N[5](C[5]N[5]H)(N[5]C[5]C)(COO){2|C<3>}	C(N[5]C[5]N[5])(OC)(O)	115.4890	0.000	1	115.4890	0.000	1	116.9457	4.344	3	116.7638	3.028	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	N[5](C[5]N[5]S)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){1|S<2>,2|C<3>}	N[5](C[5]N[5]S)(N[5]C[5]C)(COO){2|C<3>}	C(N[5]C[5]N[5])(OC)(O)	116.0150	0.000	1	116.0150	0.000	1	116.9457	4.344	3	116.7638	3.028	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]N[5]CC)(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]N[5]CC)(N[5]C[5]C)(COO){1|C<3>}	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO){1|C<4>,3|C<3>}	C(N[5]C[5]N[5])(OC)(O)	119.3330	0.000	1	119.3330	0.000	1	116.9457	4.344	3	116.7638	3.028	4	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	3:3:3:	3:4:1:	C[5,5,6]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C[6a]-3:	N[5]-3:C[3]-4:O-1:	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(N[5]C[6a]C[5])(CC[3]O)	N[5](C[5]C[3x5,6]O)(N[5]C[5,5,6]C)(C[6a]C[6a]2)	C(N[5]C[5,5,6]N[5])(C[3]C[3]O[3]C)(O)	N[5](C[5,5,6]C[3x5,6]C[5,6]H)(N[5]C[6a]C[5])(CC[3]O){1|O<1>,2|C<3>,2|H<1>,3|C<4>}	N[5](C[5]C[3x5,6]O)(N[5]C[5,5,6]C)(C[6a]C[6a]2){2|C<3>,3|C<4>,3|H<1>}	C(N[5]C[5,5,6]N[5])(C[3]C[3]O[3]C)(O)	114.6690	0.000	1	114.6690	0.000	1	114.6690	0.000	1	114.6690	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5,5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5,5]C[5,5]C[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[5,5]C[5]H)(N[5]C[5,5]C)(COO)	C(N[5]C[5,5]N[5])(OC)(O)	N[5](C[5,5]C[5,5]C[5]H)(N[5]C[5]C)(COO){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	N[5](C[5]C[5,5]C[5]H)(N[5]C[5,5]C)(COO){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C(N[5]C[5,5]N[5])(OC)(O)	119.8290	0.000	1	119.8290	0.000	1	119.8290	0.000	1	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5,5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5,5]CH)(N[5]C[5,5]C)(COO)	N[5](C[5,5]C[5,5]C[5]C)(N[5]C[5]C)(CNS)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5,5]CH)(N[5]C[5,5]C)(COO){1|C<3>,1|H<1>,2|C<4>}	N[5](C[5,5]C[5,5]C[5]C)(N[5]C[5]C)(CNS){1|C<3>,2|C<4>,4|H<1>}	C(N[5]C[5]N[5])(OC)(O)	118.7320	0.000	1	118.7320	0.000	1	115.5060	20.814	2	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5,5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5,5]C[5]H)(N[5]C[5,5]C)(COO)	N[5](C[5,5]C[5,5]C[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5,5]C[5]H)(N[5]C[5,5]C)(COO){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	N[5](C[5,5]C[5,5]C[5]H)(N[5]C[5]C)(COO){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	112.2800	0.000	1	112.2800	0.000	1	115.5060	20.814	2	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]CC)(N[5]C[5]C)(COO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]CC)(N[5]C[5]C)(COO){1|C<3>,3|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){2|C<3>,2|H<1>}	C(N[5]C[5]N[5])(OC)(O)	121.8040	0.000	1	121.8040	0.000	1	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]CC)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){2|C<3>,2|H<1>}	N[5](C[5]C[5]CC)(N[5]C[5]C)(COO){1|C<3>,3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	117.0930	0.000	1	117.0930	0.000	1	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){1|C<4>,3|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){2|C<4>,2|H<1>}	C(N[5]C[5]N[5])(OC)(O)	117.3520	0.000	1	117.6610	0.191	2	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){1|O<2>,3|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){1|C<4>,1|O<2>,2|H<1>}	C(N[5]C[5]N[5])(OC)(O)	117.9700	0.000	1	117.6610	0.191	2	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){1|C<4>,1|O<2>,2|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){1|O<2>,3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	118.9810	0.000	1	120.7060	5.951	2	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){2|C<4>,2|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){1|C<4>,3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	122.4310	0.000	1	120.7060	5.951	2	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){4|H<1>}	C(N[5]C[5]N[5])(OC)(O)	118.6660	0.000	1	118.6660	0.000	1	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5a]C[6a]N[5])(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5a]C[6a]N[5])(N[5]C[5]C)(COO){1|H<1>,1|O<2>,5|C<3>}	N[5](C[5]C[6a]N[5]H)(N[5]C[5]C)(COO){5|C<3>}	C(N[5]C[5]N[5])(OC)(O)	124.2790	0.000	1	124.2790	0.000	1	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[5a]C[6a]N[5])(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5]H)(N[5]C[5]C)(COO){5|C<3>}	N[5](C[5]C[5a]C[6a]N[5])(N[5]C[5]C)(COO){1|H<1>,1|O<2>,5|C<3>}	C(N[5]C[5]N[5])(OC)(O)	120.0990	0.000	1	120.0990	0.000	1	119.8528	6.211	9	119.1263	9.269	12	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:3:1:	C[5,5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:N-3:S-1:	N[5](C[5,5]C[5,5]C[5]C)(N[5]C[5]C)(CNS)	N[5](C[5]C[5,5]CH)(N[5]C[5,5]C)(COO)	C(N[5]C[5,5]N[5])(NCH)(S)	N[5](C[5,5]C[5,5]C[5]C)(N[5]C[5]C)(CNS){1|C<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5,5]CH)(N[5]C[5,5]C)(COO){1|C<3>,1|H<1>,2|C<4>}	C(N[5]C[5,5]N[5])(NCH)(S)	121.2020	0.000	1	121.2020	0.000	1	121.2020	0.000	1	118.3810	15.916	2	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	4:3:3:	4:3:3:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:N[5]-3:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])2(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){4|H<1>}	C(N[5]C[5]N[5])2(O)	115.5600	0.000	1	115.5600	0.000	1	115.5600	0.000	1	118.3810	15.916	2	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP2	N[5]	N[5]	C	6:3:3:	3:3:1:	3:4:4:	Si[5,5]-6:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5]-3:C-4:C-4:	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC)	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H)	C(N[5]Si[5,5]N[5])(CH3)2	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC){1|N<3>,3|C<3>}	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H){2|Br<1>,1|N<3>,1|O<2>,2|C<3>}	C(N[5]Si[5,5]N[5])(CH3)2	114.3290	0.000	1	114.3290	0.000	1	114.3290	0.000	1	114.3290	0.000	1	118.0849	8.853	29	118.1525	7.865	34
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,5]	C	3:4:3:	4:3:3:	3:2:1:	N[5,5]-3:C[5]-4:C-3:	C[5,5]-4:C[5]-3:N[5]-3:	N[5]-3:O-2:O-1:	N[5](N[5,5]C[5,5]C[5])(C[5]C[5]HO)(COO)	N[5,5](C[5,5]C[6a]C[5]2)(C[5]C[5]C)(N[5]C[5]C)	C(N[5]N[5,5]C[5])(OC)(O)	N[5](N[5,5]C[5,5]C[5])(C[5]C[5]HO)(COO){2|C<3>,2|C<4>,2|H<1>}	N[5,5](C[5,5]C[6a]C[5]2)(C[5]C[5]C)(N[5]C[5]C){1|O<2>,3|C<3>,5|H<1>}	C(N[5]N[5,5]C[5])(OC)(O)	123.1380	0.000	1	123.1380	0.000	1	123.1380	0.000	1	123.1380	0.000	1	123.1380	0.000	1	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:3:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-3:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]C)(CC[6a]O){1|C<4>,2|C<3>,3|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){2|H<1>,4|C<3>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	115.2020	0.000	1	115.2020	0.000	1	116.8080	0.774	6	116.8080	0.774	6	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:3:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-3:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	117.0250	0.000	2	117.1292	0.194	5	116.8080	0.774	6	116.8080	0.774	6	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:3:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-3:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(CC[6a]O){1|C<4>,2|C<3>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){1|O<1>,3|C<3>,3|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	117.1987	0.608	3	117.1292	0.194	5	116.8080	0.774	6	116.8080	0.774	6	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	3:4:3:	3:3:1:	N[5,6]-3:C[5,5]-4:C-3:	C[6,6a]-3:C[5,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[6,6a]C[5,6])(C[5,5]C[5,5]C[5]H)(CC[6a]O)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,5]C[6]H)(N[5]C[5,5]C)	C(N[5]C[5,5]N[5,6])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[6,6a]C[5,6])(C[5,5]C[5,5]C[5]H)(CC[6a]O){1|N<3>,1|O<1>,2|H<1>,4|C<3>}	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,5]C[6]H)(N[5]C[5,5]C){4|H<1>,5|C<3>}	C(N[5]C[5,5]N[5,6])(C[6a]C[6a]2)(O)	127.5400	0.000	1	127.5400	0.000	1	127.5400	0.000	1	127.5400	0.000	1	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O){3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C){4|H<1>,5|C<4>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	122.4620	0.000	1	122.4620	0.000	1	121.3985	2.459	4	121.3985	2.459	4	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){2|C<3>,2|C<4>,4|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	121.6365	1.940	2	121.6365	3.762	2	121.3985	2.459	4	121.3985	2.459	4	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O){3|H<1>,4|C<4>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C){4|H<1>,5|C<4>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	119.8590	0.000	1	119.8590	0.000	1	121.3985	2.459	4	121.3985	2.459	4	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5,6]	C	4:3:3:	4:4:3:	3:3:1:	C[5,6]-4:N[5,6]-3:C-3:	C[6,6]-4:C[5,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](C[5,6]C[5,6,6]C[6]C)(N[5,6]C[5,6]C[6,6])(CC[6a]O)	N[5,6](C[6,6]C[3x6]C[6]H)(C[5,6]C[5,6,6]HH)(N[5]C[5,6]C)	C(N[5]C[5,6]N[5,6])(C[6a]C[6a]2)(O)	N[5](C[5,6]C[5,6,6]C[6]C)(N[5,6]C[5,6]C[6,6])(CC[6a]O){4|C<4>,6|H<1>}	N[5,6](C[6,6]C[3x6]C[6]H)(C[5,6]C[5,6,6]HH)(N[5]C[5,6]C){4|H<1>,5|C<4>}	C(N[5]C[5,6]N[5,6])(C[6a]C[6a]2)(O)	121.8020	0.000	2	121.8020	0.000	2	121.8020	0.000	2	121.8020	0.000	2	119.8143	11.925	13	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:1:	3:4:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]CC)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CC[6a]CH)(O)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){2|C<4>,2|H<1>}	N[5](C[5]C[5]CC)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	C(N[5]C[5]N[5])(CC[6a]CH)(O)	120.4430	0.000	1	120.4430	0.000	1	118.7992	3.519	5	118.7992	3.519	5	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:1:	3:4:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CC[6a]CH)(O)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	C(N[5]C[5]N[5])(CC[6a]CH)(O)	118.9250	1.903	3	118.9250	3.620	3	118.7992	3.519	5	118.7992	3.519	5	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:1:	3:4:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CC[6a]CH)(O)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(H){1|O<1>,2|C<3>,2|H<1>}	C(N[5]C[5]N[5])(CC[6a]CH)(O)	116.7780	0.000	1	116.7780	0.000	1	118.7992	3.519	5	118.7992	3.519	5	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:1:	4:3:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	C[5]-4:N[5]-3:O-1:	N[5](C[5]C[5]O)(N[5]C[5]H)(CC[5]O)	N[5](C[5]C[5]CC)(N[5]C[5]C)(H)	C(C[5]C[5,6]C[5]H)(N[5]C[5]N[5])(O)	N[5](C[5]C[5]O)(N[5]C[5]H)(CC[5]O){2|C<4>,2|H<1>}	N[5](C[5]C[5]CC)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	C(C[5]C[5,6]C[5]H)(N[5]C[5]N[5])(O)	117.0520	0.000	1	117.0520	0.000	1	117.0520	0.000	1	117.0520	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:4:	3:3:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-4:	N[5]-3:C-3:H-1:	N[5](C[5]C[5]O)(N[5]C[5]C)(CCH)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CC[6a]CH)	C(N[5]C[5]N[5])(CCH)(H)	N[5](C[5]C[5]O)(N[5]C[5]C)(CCH){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(CC[6a]CH){1|O<1>,2|H<1>}	C(N[5]C[5]N[5])(CCH)(H)	121.6365	0.494	2	121.6365	0.244	2	121.6365	0.244	2	121.6365	0.244	2	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:4:	3:4:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-4:	N[5]-3:C[5]-4:O-1:	N[5](C[5]C[5]O)(N[5]C[5]C)(CC[5]O)	N[5](C[5]C[5]CC)(N[5]C[5]C)(CC[6a]HH)	C(N[5]C[5]N[5])(C[5]C[5]2H)(O)	N[5](C[5]C[5]O)(N[5]C[5]C)(CC[5]O){2|C<4>,2|H<1>}	N[5](C[5]C[5]CC)(N[5]C[5]C)(CC[6a]HH){1|O<1>,2|H<1>}	C(N[5]C[5]N[5])(C[5]C[5]2H)(O)	116.5020	0.058	2	116.5020	0.003	2	116.5020	0.003	2	116.5020	0.003	2	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:2:3:	3:2:1:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:S[5]-2:C-3:	N[5]-3:O-2:O-1:	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	C(N[5]C[5,6]N[5])(OC)(O)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	C(N[5]C[5,6]N[5])(OC)(O)	120.9540	0.000	1	120.9540	0.000	1	120.9540	0.000	1	120.9540	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:3:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:N[5]-3:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	N[5](C[5]C[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])2(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){3|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]C)(COO){4|H<1>}	C(N[5]C[5]N[5])2(O)	112.2740	0.000	1	112.2740	0.000	1	112.2740	0.000	1	112.2740	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:4:	3:3:3:	C[5,5]-4:N[5]-3:C-3:	C[5,6a]-3:N[5]-3:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5,5]C[5,6a]3)(N[5]C[5,6a]C)(CC[6a]2)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(CH3)	C(N[5]C[5,5]N[5])(C[6a]C[6a]2)2	N[5](C[5,5]C[5,6a]3)(N[5]C[5,6a]C)(CC[6a]2){6|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(CH3){1|H<1>,4|C<3>}	C(N[5]C[5,5]N[5])(C[6a]C[6a]2)2	123.5870	0.000	1	123.5870	0.000	1	123.5870	0.000	1	123.5870	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:1:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C[6a]-3:O-1:	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]O)	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]O){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|C<3>,1|N<3>,2|H<1>}	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	118.8850	0.000	1	118.8850	0.000	1	118.8850	0.000	1	118.8850	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:1:	3:4:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[6a]P[5]H)(N[5]C[5]H)(CCO)	N[5](C[5]C[6a]P[5]H)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CH3)(O)	N[5](C[5]C[6a]P[5]H)(N[5]C[5]H)(CCO){1|Rh<6>,1|H<1>,4|C<3>}	N[5](C[5]C[6a]P[5]H)(N[5]C[5]C)(H){1|Rh<6>,1|H<1>,4|C<3>}	C(N[5]C[5]N[5])(CH3)(O)	118.7810	0.000	1	118.7810	0.000	1	118.7810	0.000	1	120.4250	5.405	2	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:1:	3:4:1:	S[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]HH)(N[5]S[5]C)(H)	C(N[5]N[5]S[5])(CC[6a]HH)(O)	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	N[5](C[5]C[5]HH)(N[5]S[5]C)(H){1|C<4>,1|H<1>,2|O<1>}	C(N[5]N[5]S[5])(CC[6a]HH)(O)	122.0690	0.000	1	122.0690	0.000	1	122.0690	0.000	1	120.4250	5.405	2	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP2_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:4:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-4:	N[5]-3:C[6a]-3:O-1:	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(CC[6a]O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CCHH)	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(CC[6a]O){2|C<3>,4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(CCHH){1|C<3>,3|H<1>}	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	121.1410	0.000	1	121.1410	0.000	1	121.1410	0.000	1	121.1410	0.000	1	119.1186	8.039	17	119.5400	9.622	31
542	542	930	0:SP3_SP2_SP2	N[5]	N[5]	C	3:2:3:	4:3:3:	3:2:1:	N[5]-3:S[5]-2:C-3:	C[5,6]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](N[5]C[5,6]C)(S[5]C[5])(COO)	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO)	C(N[5]N[5]S[5])(OC)(O)	N[5](N[5]C[5,6]C)(S[5]C[5])(COO){1|C<3>,1|C<4>,1|N<2>}	N[5](C[5,6]C[5]C[6]2)(N[5]S[5]C)(COO){1|C<3>,1|C<4>,1|N<2>,1|O<1>,2|H<1>}	C(N[5]N[5]S[5])(OC)(O)	115.0060	0.000	1	115.0060	0.000	1	115.0060	0.000	1	115.0060	0.000	1	117.7405	14.955	2	117.7405	14.955	2
542	542	930	0:SP3_SP2_SP2	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]H)(N[5]C[5]C)(COO){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	120.4750	0.000	1	120.4750	0.000	1	120.4750	0.000	1	120.4750	0.000	1	117.7405	14.955	2	117.7405	14.955	2
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,5]	C	3:3:3:	4:3:3:	3:2:1:	N[5,5]-3:C[5]-3:C-3:	C[5,5]-4:C[5]-3:N[5]-3:	N[5]-3:O-2:O-1:	N[5](N[5,5]C[5,5]C[5])(C[5]C[6a]N[5])(COO)	N[5,5](C[5,5]C[5]N[5]C)(C[5]N[5]O)(N[5]C[5]C)	C(N[5]N[5,5]C[5])(OC)(O)	N[5](N[5,5]C[5,5]C[5])(C[5]C[6a]N[5])(COO){1|C<4>,1|N<3>,1|O<1>,3|C<3>}	N[5,5](C[5,5]C[5]N[5]C)(C[5]N[5]O)(N[5]C[5]C){1|C<3>,1|C<4>,1|O<1>}	C(N[5]N[5,5]C[5])(OC)(O)	117.5150	0.000	1	117.5150	0.000	1	117.5150	0.000	1	117.5150	0.000	1	117.5150	0.000	1	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	3:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[6,6a]-3:C[5,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[6,6a]C[5,6])(C[5]C[5]HH)(CC[6a]O)	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]H)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[6,6a]C[5,6])(C[5]C[5]HH)(CC[6a]O){2|H<1>,4|C<3>}	N[5,6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5]C[6]H)(N[5]C[5]C){4|C<3>,5|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	120.2040	0.000	1	120.2040	0.000	1	120.2040	0.000	1	120.2040	0.000	1	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O){1|C<3>,2|C<4>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){2|C<3>,2|C<4>,4|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	121.6330	0.000	1	123.6035	7.766	2	120.4730	7.986	6	120.4730	7.986	6	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]CH)(CC[6a]O){1|C<4>,2|C<3>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){1|C<4>,3|C<3>,4|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	125.5740	0.000	1	123.6035	7.766	2	120.4730	7.986	6	120.4730	7.986	6	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O){3|C<4>,4|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]HH)(N[5]C[5]C){4|C<4>,5|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	117.9990	0.000	1	117.9990	0.000	1	120.4730	7.986	6	120.4730	7.986	6	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(CC[6a]O){1|C<2>,1|C<3>,1|C<4>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){1|C<2>,2|C<3>,5|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	119.4630	1.133	2	119.4630	1.283	2	120.4730	7.986	6	120.4730	7.986	6	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5,6]	C	3:4:3:	4:4:3:	3:3:1:	N[5,6]-3:C[5]-4:C-3:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(CC[6a]O)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C)	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(CC[6a]O){1|C<4>,4|C<3>,4|H<1>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]C[6]HH)(N[5]C[5]C){4|C<3>,4|H<1>}	C(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)	118.7060	0.000	1	118.7060	0.000	1	120.4730	7.986	6	120.4730	7.986	6	120.4346	6.666	7	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:3:3:	3:3:3:	3:1:1:	N[5]-3:C[5]-3:C-3:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:H-1:O-1:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(CHO)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]C)	C(N[5]C[5]N[5])(H)(O)	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(CHO){1|O<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]C){1|O<1>,2|H<1>,3|C<3>}	C(N[5]C[5]N[5])(H)(O)	121.6870	0.000	1	121.6870	0.000	1	121.6870	0.000	1	121.6870	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:1:	3:4:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CC[6a]CH)(O)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	C(N[5]C[5]N[5])(CC[6a]CH)(O)	118.5590	0.000	1	118.5590	0.000	1	118.5590	0.000	1	118.5590	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]C)(N[5]C[5]C)(COO)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]C)(N[5]C[5]C)(COO){1|H<1>,2|C<4>}	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){2|C<4>}	C(N[5]C[5]N[5])(OC)(O)	114.6270	0.000	1	114.6270	0.000	1	116.7216	2.157	5	116.7216	2.157	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]H)(N[5]C[5]C)(COO){1|H<1>,2|C<3>}	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(COO){1|H<1>,3|C<3>}	C(N[5]C[5]N[5])(OC)(O)	117.6060	0.889	3	117.6060	0.790	3	116.7216	2.157	5	116.7216	2.157	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:3:3:	4:3:3:	3:2:1:	C[5]-3:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO){4|C<3>}	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){3|C<3>}	C(N[5]C[5]N[5])(OC)(O)	116.1630	0.000	1	116.1630	0.000	1	116.7216	2.157	5	116.7216	2.157	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	3:4:3:	4:3:1:	3:2:1:	N[5]-3:C[5]-4:C-3:	C[5,5]-4:N[5]-3:H-1:	N[5]-3:O-2:O-1:	N[5](N[5]C[5,5]H)(C[5]C[5]CH)(COO)	N[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(OC)(O)	N[5](N[5]C[5,5]H)(C[5]C[5]CH)(COO){2|C<3>,2|H<1>}	N[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5]C)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,3|H<1>}	C(N[5]C[5]N[5])(OC)(O)	120.4690	0.000	1	120.4690	0.000	1	120.4690	0.000	1	120.4690	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:1:	3:4:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5]-3:C-4:O-1:	N[5](C[5]N[5]HH)(N[5]C[5]H)(CCO)	N[5](C[5]N[5]S)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(CN[5a]HH)(O)	N[5](C[5]N[5]HH)(N[5]C[5]H)(CCO){1|C<3>,1|S<1>}	N[5](C[5]N[5]S)(N[5]C[5]C)(H){1|C<3>,2|H<1>}	C(N[5]C[5]N[5])(CN[5a]HH)(O)	121.0200	0.000	1	121.0200	0.000	1	121.0200	0.000	1	121.0200	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]C)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]CH)(N[5]C[5]C)(COO){2|C<4>}	N[5](C[5]C[5]C)(N[5]C[5]C)(COO){1|H<1>,2|C<4>}	C(N[5]C[5]N[5])(OC)(O)	117.9050	0.000	1	117.9050	0.000	1	116.2934	14.505	5	116.2934	14.505	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(COO)	N[5](C[5]C[5]H)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(COO){1|H<1>,3|C<3>}	N[5](C[5]C[5]H)(N[5]C[5]C)(COO){1|H<1>,2|C<3>}	C(N[5]C[5]N[5])(OC)(O)	113.7547	0.124	3	113.7547	0.015	3	116.2934	14.505	5	116.2934	14.505	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	3:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-3:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO)	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[6a]N[5]C)(N[5]C[5]C)(COO){3|C<3>}	N[5](C[5]C[6a]N[5])(N[5]C[5]C)(COO){4|C<3>}	C(N[5]C[5]N[5])(OC)(O)	122.2980	0.000	1	122.2980	0.000	1	116.2934	14.505	5	116.2934	14.505	5	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:1:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5,5]-4:N[5]-3:H-1:	N[5]-3:C[6a]-3:O-1:	N[5](C[5]C[3,5,5]HH)(N[5]C[5,5]H)(CC[6a]O)	N[5](C[5,5]C[3,5,5]C[5]C)(N[5]C[5]C)(H)	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	N[5](C[5]C[3,5,5]HH)(N[5]C[5,5]H)(CC[6a]O){4|C<4>}	N[5](C[5,5]C[3,5,5]C[5]C)(N[5]C[5]C)(H){3|C<4>,4|H<1>}	C(N[5]C[5]N[5])(C[6a]C[6a]2)(O)	120.7210	0.000	1	120.7210	0.000	1	120.7210	0.000	1	120.7210	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:3:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){4|H<1>}	C(N[5]C[5]N[5])(OC)(O)	120.4235	0.340	2	120.4235	0.116	2	120.4235	0.116	2	120.4235	0.116	2	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:3:	3:3:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:C-3:	N[5]-3:N[5]-3:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO)	C(N[5]C[5]N[5])2(O)	N[5](C[5]C[5]HH)(N[5]C[5]C)(CN[5]O){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]C)(COO){4|H<1>}	C(N[5]C[5]N[5])2(O)	114.2720	1.226	2	114.2720	1.503	2	114.2720	1.503	2	114.2720	1.503	2	117.7065	8.735	20	118.3817	9.086	28
542	542	930	0:SP3_SP2_SP3	N[5]	N[5]	C	4:3:3:	4:3:4:	3:2:1:	C[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:S-4:	N[5]-3:O-2:O-1:	N[5](C[5]C[5]HH)(N[5]C[5]S)(COO)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(SC[6a]OO)	C(N[5]C[5]N[5])(OC)(O)	N[5](C[5]C[5]HH)(N[5]C[5]S)(COO){1|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(SC[6a]OO){2|C<3>,4|H<1>}	C(N[5]C[5]N[5])(OC)(O)	117.2080	0.000	1	117.2080	0.000	1	117.2080	0.000	1	117.2080	0.000	1	117.7065	8.735	20	118.3817	9.086	28
542	542	931	5:SP2_SP2_SPD5	N[5,5]	N[5,5]	Si[5,5]	5:3:3:	3:3:3:	3:3:3:3:2:	Si[5,5]-5:N[5,5]-3:C[5]-3:	N[5,5]-3:C[5]-3:C[5]-3:	N[5,5]-3:N[5,5]-3:C[6a]-3:C[6a]-3:O[5]-2:	N[5,5](Si[5,5]N[5,5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C)	N[5,5](N[5,5]Si[5,5]C[5])(C[5]N[5,5]O)(C[5]C[5]C)	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5,6a])	N[5,5](Si[5,5]N[5,5]C[6a]2O[5])(N[5,5]C[5]2)(C[5]C[5]C){1|C<4>,1|H<1>,1|O<1>,6|C<3>}	N[5,5](N[5,5]Si[5,5]C[5])(C[5]N[5,5]O)(C[5]C[5]C){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	Si[5,5](N[5,5]C[5,6a]C[5])(N[5,5]N[5,5]C[5])(C[6a]C[6a]2)2(O[5]C[5,6a]){1|C<4>,1|O<1>,4|H<1>,8|C<3>}	112.6170	0.000	1	112.6170	0.000	1	112.6170	0.000	1	112.6170	0.000	1	112.6170	0.000	1	112.6170	0.000	1
542	542	941	0:SP2_SP2_SP2	N[5]	N[5]	N	3:2:2:	3:2:1:	3:3:	N[5]-3:N[5]-2:N-2:	N[5]-3:N[5]-2:H-1:	N[5]-3:N-3:	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]N)(N[5]N[5])(H)	N(N[5]N[5]2)(NOO)	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]N)(N[5]N[5])(H)	N(N[5]N[5]2)(NOO)	132.3206	0.451	5	132.3206	0.203	5	132.3206	0.203	5	132.3206	0.203	5	132.3206	0.203	5	132.3206	0.203	5
542	542	943	6:SP2_SP-NON_SP2	N[5,6]	N[5,6]	Ga[6]	3:3:4:	3:4:3:	3:3:4:4:	C[5,6a]-3:N[5,6]-3:Ga[6]-4:	N[5,6]-3:Ga[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC)	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H)	Ga[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CH3)2	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	Ga[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CH3)2{1|Ga<4>,1|H<1>,5|C<3>}	123.8965	0.162	2	123.8965	0.026	2	124.6547	0.781	4	124.6547	0.781	4	125.7295	2.471	8	125.7295	2.471	8
542	542	943	6:SP2_SP-NON_SP2	N[5,6]	N[5,6]	Ga[6]	3:3:4:	3:4:3:	3:3:4:4:	C[5,6a]-3:N[5,6]-3:Ga[6]-4:	N[5,6]-3:Ga[6]-4:C[5]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC)	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H)	Ga[6](N[5,6]C[5,6a]N[5,6])2(CH3)2	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	Ga[6](N[5,6]C[5,6a]N[5,6])2(CH3)2{1|Ga<4>,6|C<3>}	125.4130	0.126	2	125.4130	0.016	2	124.6547	0.781	4	124.6547	0.781	4	125.7295	2.471	8	125.7295	2.471	8
542	542	943	6:SP2_SP-NON_SP2	N[5,6]	N[5,6]	Ga[6]	3:4:3:	3:3:4:	3:3:4:4:	N[5,6]-3:Ga[6]-4:C[5]-3:	C[5,6a]-3:N[5,6]-3:Ga[6]-4:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H)	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC)	Ga[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CH3)2	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	Ga[6](N[5,6]C[5,6a]N[5,6])(N[5,6]N[5,6]C[5])(CH3)2{1|Ga<4>,1|H<1>,5|C<3>}	127.9080	0.631	2	127.9080	0.398	2	126.8042	1.905	4	126.8042	1.905	4	125.7295	2.471	8	125.7295	2.471	8
542	542	943	6:SP2_SP-NON_SP2	N[5,6]	N[5,6]	Ga[6]	3:4:3:	3:3:4:	3:3:4:4:	N[5,6]-3:Ga[6]-4:C[5]-3:	C[5,6a]-3:N[5,6]-3:Ga[6]-4:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H)	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC)	Ga[6](N[5,6]N[5,6]C[5])2(CH3)2	N[5,6](N[5,6]C[5,6a]Ga[6])(Ga[6]N[5,6]CC)(C[5]C[5,6a]H){1|N<3>,2|C<4>,3|C<3>}	N[5,6](C[5,6a]C[5,6a]C[6a])(N[5,6]Ga[6]C[5])(Ga[6]N[5,6]CC){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	Ga[6](N[5,6]N[5,6]C[5])2(CH3)2{1|Ga<4>,2|H<1>,4|C<3>}	125.7005	0.667	2	125.7005	0.445	2	126.8042	1.905	4	126.8042	1.905	4	125.7295	2.471	8	125.7295	2.471	8
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5,6]	H	3:3:1:	3:4:3:	3:	N[5,6]-3:C[5]-3:H-1:	C[5,6]-3:C[6]-4:N[5]-3:	N[5]-3:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]H)(H)	N[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6]H)(N[5]C[5]H)	H(N[5]N[5,6]C[5])	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]H)(H){2|H<1>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5])(C[6]C[6a]C[6]H)(N[5]C[5]H){2|H<1>,5|C<3>}	H(N[5]N[5,6]C[5])	127.7470	0.000	1	127.7470	0.000	1	127.7470	0.000	1	127.7470	0.000	1	124.1957	9.467	3	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5,6]	H	3:3:1:	4:3:3:	3:	N[5,6]-3:B[5]-3:H-1:	C[5,6,6]-4:B[6]-3:N[5]-3:	N[5]-3:	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	N[5,6](C[5,6,6]C[5,6]C[6,6]C)(B[6]C[6,6a]C[5])(N[5]B[5]H)	H(N[5]N[5,6]B[5])	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>}	N[5,6](C[5,6,6]C[5,6]C[6,6]C)(B[6]C[6,6a]C[5])(N[5]B[5]H){1|H<1>,2|N<3>,5|C<3>}	H(N[5]N[5,6]B[5])	122.3290	0.000	1	122.3290	0.000	1	122.4200	0.017	2	122.4200	0.017	2	124.1957	9.467	3	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5,6]	H	3:3:1:	4:3:3:	3:	N[5,6]-3:B[5]-3:H-1:	C[5,6,6]-4:B[6]-3:N[5]-3:	N[5]-3:	N[5](N[5,6]C[5,6,6]B[6])(B[5]C[5,6]C[6a])(H)	N[5,6](C[5,6,6]C[5,6]C[6,6]C)(B[6]C[6,6a]O)(N[5]B[5]H)	H(N[5]N[5,6]B[5])	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>}	N[5,6](C[5,6,6]C[5,6]C[6,6]C)(B[6]C[6,6a]O)(N[5]B[5]H){1|H<1>,5|C<3>}	H(N[5]N[5,6]B[5])	122.5110	0.000	1	122.5110	0.000	1	122.4200	0.017	2	122.4200	0.017	2	124.1957	9.467	3	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:2:1:	3:2:2:	3:	N[5]-3:N[5]-2:H-1:	N[5]-3:N[5]-2:N-2:	N[5]-3:	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]H)(N[5]N[5])(NN)	H(N[5]N[5]2)	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]H)(N[5]N[5])(NN)	H(N[5]N[5]2)	125.7022	4.761	5	125.7022	22.669	5	125.7022	22.669	5	125.7022	22.669	5	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:2:1:	3:3:1:	3:	N[5]-3:C[5]-2:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]H)(C[5]C[5])(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](N[5]C[5]H)(C[5]C[5])(H){1|C<3>,1|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>}	H(N[5]C[5]N[5])	118.2510	0.000	1	118.2510	0.000	1	118.2510	0.000	1	118.2510	0.000	1	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:2:1:	3:	C[5]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](N[5]C[5]H)(C[5]C[5])(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>}	N[5](N[5]C[5]H)(C[5]C[5])(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	124.1080	0.000	1	124.1080	0.000	1	124.1080	0.000	1	124.1080	0.000	1	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H)	N[5](C[5]C[5,6]C)(N[5]C[5,6]H)(H)	H(N[5]C[5,6]N[5])	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H){2|H<1>,3|C<4>}	N[5](C[5]C[5,6]C)(N[5]C[5,6]H)(H){2|C<4>}	H(N[5]C[5,6]N[5])	125.6390	0.000	1	125.6390	0.000	1	123.3816	10.231	5	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H)	N[5](C[5]C[5,6]H)(N[5]C[5,6]H)(H)	H(N[5]C[5,6]N[5])	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H){2|C<4>,3|H<1>}	N[5](C[5]C[5,6]H)(N[5]C[5,6]H)(H){2|C<4>}	H(N[5]C[5,6]N[5])	122.8173	3.394	4	122.8173	11.518	4	123.3816	10.231	5	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5,6a]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(H)	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(H)	H(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(H){2|C<3>,2|H<1>}	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(H){2|C<3>}	H(N[5]C[5,6a]N[5])	126.3545	0.365	4	126.3545	0.134	4	126.3545	0.134	4	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5,6]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5,6]C)(N[5]C[5,6]H)(H)	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5,6]C)(N[5]C[5,6]H)(H){2|C<4>}	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H){2|H<1>,3|C<4>}	H(N[5]C[5]N[5])	125.1710	0.000	1	125.1710	0.000	1	125.4574	11.020	5	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5,6]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5,6]H)(N[5]C[5,6]H)(H)	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5,6]H)(N[5]C[5,6]H)(H){2|C<4>}	N[5](C[5,6]C[5,6]C[6])(N[5]C[5]H)(H){2|C<4>,3|H<1>}	H(N[5]C[5]N[5])	125.5290	3.829	4	125.5290	14.659	4	125.4574	11.020	5	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5,6a]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(H){2|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(H){2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	124.1642	0.421	4	124.1642	0.177	4	124.1642	0.177	4	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]2)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]2)(N[5]C[5]H)(H){1|C<4>,1|H<1>,2|C<3>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	121.6320	0.000	1	121.6320	0.000	1	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]2)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	N[5](C[5]C[5]2)(N[5]C[5]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(N[5]C[5]N[5])	119.6410	0.000	1	119.6410	0.000	1	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|C<4>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|C<4>}	H(N[5]C[5]N[5])	124.2465	2.029	30	123.8684	6.943	124	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	123.4341	3.083	28	123.8684	6.943	124	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|Se<2>,1|C<4>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|Se<2>,1|C<4>}	H(N[5]C[5]N[5])	121.6785	0.716	2	123.8684	6.943	124	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|C<4>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|C<4>}	H(N[5]C[5]N[5])	123.9495	2.696	64	123.8684	6.943	124	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	125.5336	1.547	7	125.5336	2.394	7	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	125.2942	0.160	5	125.2942	0.025	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(N[5]C[5]N[5])	125.3340	0.000	1	125.3340	0.000	1	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|H<1>}	H(N[5]C[5]N[5])	119.1809	2.454	7	119.1809	6.024	7	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	123.3080	3.017	34	124.5472	5.082	114	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){2|H<1>}	H(N[5]C[5]N[5])	125.0739	1.589	80	124.5472	5.082	114	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|Br<1>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|Br<1>,1|H<1>}	H(N[5]C[5]N[5])	125.7310	0.000	1	120.6818	17.974	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	114.1530	0.000	1	120.6818	17.974	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){2|H<1>}	H(N[5]C[5]N[5])	121.1750	1.234	3	120.6818	17.974	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	127.6970	7.210	3	127.6970	51.991	3	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	H(N[5]C[5]N[5])	125.8434	0.141	5	125.8434	0.020	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|Br<1>,1|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|Br<1>,1|N<3>}	H(N[5]C[5]N[5])	125.3590	0.000	1	121.7998	4.354	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|N<3>}	H(N[5]C[5]N[5])	120.1200	0.000	1	121.7998	4.354	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	H(N[5]C[5]N[5])	121.1733	0.612	3	121.7998	4.354	5	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	H(N[5]C[5]N[5])	120.1873	3.850	8	120.1873	14.820	8	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5a]C[5])(N[5]C[5]H)(H)	N[5](C[5]C[5a]C[5])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5a]C[5])(N[5]C[5]H)(H){1|H<1>,1|N<3>,2|C<3>}	N[5](C[5]C[5a]C[5])(N[5]C[5]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(N[5]C[5]N[5])	125.4363	0.097	6	125.4363	0.009	6	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){1|C<4>,1|H<1>,2|C<3>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	125.1230	0.000	1	125.1230	0.000	1	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){2|C<3>,2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<3>,1|H<1>}	H(N[5]C[5]N[5])	118.4723	1.494	3	118.4723	2.233	3	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){1|H<1>,3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[5]H)(H){1|H<1>,3|C<3>}	H(N[5]C[5]N[5])	125.3297	0.831	23	125.3297	0.690	23	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[6a]O[5])(N[5]C[5]H)(H)	N[5](C[5]C[6a]O[5])(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]O[5])(N[5]C[5]H)(H){3|C<3>}	N[5](C[5]C[6a]O[5])(N[5]C[5]H)(H){3|C<3>}	H(N[5]C[5]N[5])	126.2857	0.345	6	126.2857	0.119	6	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]N[5]H)(N[5]C[5]H)(H)	N[5](C[5]N[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]N[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	N[5](C[5]N[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	120.3830	5.107	2	120.3830	26.079	2	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]N[5]N)(N[5]C[5]H)(H)	N[5](C[5]N[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]N[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	N[5](C[5]N[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	H(N[5]C[5]N[5])	119.8590	0.724	2	119.8590	0.524	2	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]S[5]H)(N[5]C[5]H)(H)	N[5](C[5]S[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]S[5]H)(N[5]C[5]H)(H){1|H<1>}	N[5](C[5]S[5]H)(N[5]C[5]H)(H){1|H<1>}	H(N[5]C[5]N[5])	125.7100	0.000	1	125.7100	0.000	1	124.0303	7.802	330	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	H(N[5]N[5]2)	127.1350	0.000	1	127.1350	0.000	1	125.9025	3.038	2	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	H(N[5]N[5]2)	124.6700	0.000	1	124.6700	0.000	1	125.9025	3.038	2	124.0802	7.725	350	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	C[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[6a]C[5])(H)	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5])(N[5]C[6a]C[5])(H){1|H<1>,5|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]H){2|H<1>,4|C<3>}	H(N[5]C[5]N[5])	126.9130	0.000	1	126.9130	0.000	1	126.9130	0.000	1	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5,6]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[5,6]C[6a])(C[5]C[5,6]C)(H)	N[5](C[5,6]C[5,6]O[6])(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[5,6]C[6a])(C[5]C[5,6]C)(H){1|C<4>,1|O<2>,2|C<3>}	N[5](C[5,6]C[5,6]O[6])(C[6a]C[6a]2)(N[5]C[5]H){2|C<4>,2|H<1>,3|C<3>}	H(N[5]C[5]N[5])	127.0770	0.000	1	127.0770	0.000	1	127.0770	0.000	1	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5,6a]-3:C[5a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[5,6a]C[5a])(C[5]C[5,6a]H)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5a]N[5a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[5,6a]C[5a])(C[5]C[5,6a]H)(H){2|C<3>,2|N<2>}	N[5](C[5,6a]C[5,6a]C[6a])(C[5a]N[5a]2)(N[5]C[5]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	126.5940	0.000	1	126.5940	0.000	1	126.5940	0.000	1	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[3,5]C)(H)	N[5](C[5]C[3,5]O)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[3,5]C)(H){1|O<1>,2|C<3>,2|C<4>}	N[5](C[5]C[3,5]O)(C[6a]C[6a]2)(N[5]C[5]H){2|C<3>,2|H<1>,3|C<4>}	H(N[5]C[5]N[5])	125.6710	0.000	1	125.6710	0.000	1	125.7925	0.030	2	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5,6]C)(H)	N[5](C[5]C[5,6]O)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5,6]C)(H){1|O<1>,2|C<3>,2|C<4>}	N[5](C[5]C[5,6]O)(C[6a]C[6a]2)(N[5]C[5]H){2|C<3>,2|H<1>,3|C<4>}	H(N[5]C[5]N[5])	125.9140	0.000	1	125.9140	0.000	1	125.7925	0.030	2	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:B[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]B[5])(C[5]N[5]C)(H)	N[5](C[6a]C[6a]2)(B[5]N[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]B[5])(C[5]N[5]C)(H){1|O<2>,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>}	H(N[5]C[5]N[5])	123.9080	0.000	1	123.9080	0.000	1	123.9080	0.000	1	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,1|H<1>,2|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]C[5]H){2|C<3>,2|C<4>,2|H<1>}	H(N[5]C[5]N[5])	119.0100	0.000	1	119.0100	0.000	1	121.0122	5.875	6	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]N)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H){1|H<1>,1|N<3>,2|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]N)(N[5]C[5]H){1|C<4>,2|C<3>,3|H<1>}	H(N[5]C[5]N[5])	117.4330	0.000	1	117.4330	0.000	1	121.0122	5.875	6	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]C)(H){1|C<4>,1|O<2>,2|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H){2|C<3>,2|C<4>,2|H<1>}	H(N[5]C[5]N[5])	121.2440	0.000	1	121.2440	0.000	1	121.0122	5.875	6	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){1|O<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H){1|O<1>,2|H<1>,3|C<3>}	H(N[5]C[5]N[5])	122.7953	1.217	3	122.7953	1.480	3	121.0122	5.875	6	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	N[5]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]N[5])(C[5]N[5]S)(H)	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]N[5])(C[5]N[5]S)(H){1|H<1>,3|C<3>}	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]H){1|S<1>,3|H<1>,4|C<3>}	H(N[5]C[5]N[5])	127.3530	0.000	1	127.3530	0.000	1	127.3530	0.000	1	123.8079	10.404	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5,6a]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]B)(H)	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(BC[6a]3)	H(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]B)(H){1|C<4>,1|H<1>,2|C<3>}	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(BC[6a]3){2|C<3>}	H(N[5]C[5,6a]N[5])	118.9720	0.000	1	118.9720	0.000	1	118.9720	0.000	1	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5,5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5,5]H)(N[5]C[5,5]C)(H)	N[5](C[5,5]C[5,6a]C[5,5])(N[5]C[5]H)(CH3)	H(N[5]C[5]N[5])	N[5](C[5]C[5,5]H)(N[5]C[5,5]C)(H){1|C<3>,1|C<4>}	N[5](C[5,5]C[5,6a]C[5,5])(N[5]C[5]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	H(N[5]C[5]N[5])	116.9000	0.000	1	116.9000	0.000	1	116.9000	0.000	1	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5,6a]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5,6a]C)(N[5]C[5,6a]C)(H)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(CH3)	H(N[5]C[5]N[5])	N[5](C[5]C[5,6a]C)(N[5]C[5,6a]C)(H){1|C<3>,1|N<2>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]H)(CH3){1|Cl<1>,1|C<4>,1|N<2>,1|N<3>}	H(N[5]C[5]N[5])	125.8660	0.000	1	125.8660	0.000	1	125.8660	0.000	1	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2C)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2C){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	116.3900	0.000	1	116.3900	0.000	1	121.8364	15.378	10	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	119.8960	0.000	1	119.8960	0.000	1	121.8364	15.378	10	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5]2H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	123.9775	1.106	6	123.9775	1.223	6	121.8364	15.378	10	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5a]HH)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5a]HH){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	113.7940	0.000	1	113.7940	0.000	1	121.8364	15.378	10	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:B-4:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(BC[6a]3)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]B)(H){2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(BC[6a]3){2|H<1>}	H(N[5]C[5]N[5])	124.4190	0.000	1	124.4190	0.000	1	121.8364	15.378	10	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CH3)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]C)(H){1|C<4>,1|O<2>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CH3){2|C<4>}	H(N[5]C[5]N[5])	122.5525	1.395	2	122.5525	1.946	2	126.7285	27.729	6	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]N[5]H)(N[5]C[5]C)(H)	N[5](C[5]N[5]H)(N[5]C[5]H)(CCHH)	H(N[5]C[5]N[5])	N[5](C[5]N[5]H)(N[5]C[5]C)(H){2|H<1>}	N[5](C[5]N[5]H)(N[5]C[5]H)(CCHH){2|H<1>}	H(N[5]C[5]N[5])	125.3120	1.045	2	125.3120	1.092	2	126.7285	27.729	6	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]N[5]H)(N[5]C[5]C)(H)	N[5](C[5]N[5]H)(N[5]C[5]H)(CC[6a]HH)	H(N[5]C[5]N[5])	N[5](C[5]N[5]H)(N[5]C[5]C)(H){1|Cd<6>,1|H<1>}	N[5](C[5]N[5]H)(N[5]C[5]H)(CC[6a]HH){1|Cd<6>,1|H<1>}	H(N[5]C[5]N[5])	136.4540	0.000	1	132.3210	34.163	2	126.7285	27.729	6	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](C[5]N[5]H)(N[5]C[5]C)(H)	N[5](C[5]N[5]H)(N[5]C[5]H)(CC[6a]HH)	H(N[5]C[5]N[5])	N[5](C[5]N[5]H)(N[5]C[5]C)(H){1|H<1>}	N[5](C[5]N[5]H)(N[5]C[5]H)(CC[6a]HH){1|H<1>}	H(N[5]C[5]N[5])	128.1880	0.000	1	132.3210	34.163	2	126.7285	27.729	6	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3){1|Pd<4>,1|H<1>}	H(N[5]N[5]2)	127.1090	0.000	1	127.1090	0.000	1	127.1090	0.000	1	123.3791	23.666	20	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	B-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](BC[6a]N[5a]2)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){2|H<1>}	N[5](BC[6a]N[5a]2)(C[5]C[5]H)(N[5]C[5]H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	113.6610	0.000	1	113.6610	0.000	1	121.3097	43.879	3	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	B-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]B)(H)	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	125.1870	0.000	1	125.1870	0.000	1	121.3097	43.879	3	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	B-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]B)(H)	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]B)(H){1|H<1>,1|I<1>}	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]H){1|H<1>,1|I<1>}	H(N[5]C[5]N[5])	125.0810	0.000	1	125.0810	0.000	1	121.3097	43.879	3	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	C-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]C)(H)	N[5](CC[6a]N[5]H)(C[5]C[5]C)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]C)(H){1|C<4>,1|H<1>}	N[5](CC[6a]N[5]H)(C[5]C[5]C)(N[5]C[5]H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	127.0850	0.554	2	127.0850	0.307	2	127.1327	0.160	3	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	C-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]C)(H)	N[5](CC[6a]N[5a]H)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]C)(H){2|H<1>}	N[5](CC[6a]N[5a]H)(C[5]C[5]H)(N[5]C[5]H){2|H<1>}	H(N[5]C[5]N[5])	127.2280	0.000	1	127.2280	0.000	1	127.1327	0.160	3	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){1|C<3>,3|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCO){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	119.5190	0.000	1	119.5190	0.000	1	121.6590	9.159	2	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]HH)(N[5]C[5]H)(CCC)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]H)(CCC){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	123.7990	0.000	1	123.7990	0.000	1	121.6590	9.159	2	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:C[5]-3:H-1:	B[6a]-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]B[6a]C[5])(C[5]C[5]H)(H)	N[5](B[6a]C[6a]O[6a]2)(C[5]C[5]H)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]B[6a]C[5])(C[5]C[5]H)(H){1|C<3>,2|H<1>,2|O<2>}	N[5](B[6a]C[6a]O[6a]2)(C[5]C[5]H)(N[5]C[5]H){2|B<3>,2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	118.6350	0.000	1	118.6350	0.000	1	118.6350	0.000	1	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5]-4:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){3|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H){1|O<1>,4|C<3>,4|H<1>}	H(N[5]C[5]N[5])	122.4920	0.044	2	122.4920	0.002	2	122.4920	0.002	2	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6]-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[5]C[6])(C[5]C[5]O)(H)	N[5](C[6]C[6]O[6]H)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[5]C[6])(C[5]C[5]O)(H){1|H<1>,1|O<1>,1|O<2>,3|C<4>}	N[5](C[6]C[6]O[6]H)(C[5]C[5]O)(N[5]C[5]H){1|O<1>,2|H<1>,4|C<4>}	H(N[5]C[5]N[5])	114.4260	0.000	1	114.4260	0.000	1	114.4260	0.000	1	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:N[5]-3:H-1:	C[5]-4:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[5]Re)(N[5]C[5]2)(H)	N[5](C[5]C[5]2Re)(C[5]C[5]H)(N[5]N[5]H)	H(N[5]N[5]2)	N[5](N[5]C[5]Re)(N[5]C[5]2)(H){1|Re<8>,1|C<2>,1|H<1>,2|C<4>}	N[5](C[5]C[5]2Re)(C[5]C[5]H)(N[5]N[5]H){1|Re<6>,1|C<2>,2|C<4>,2|H<1>}	H(N[5]N[5]2)	126.1100	0.000	1	126.1100	0.000	1	126.1100	0.000	1	122.5231	21.704	13	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	6:3:3:	3:	C[5]-3:N[5]-3:H-1:	Si[5,5]-6:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H)	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]O[5])(N[5]Si[5,5]C)(H){2|Br<1>,1|N<3>,1|O<2>,2|C<3>}	N[5](Si[5,5]N[5]O[5]2Br2)(N[5]C[5]H)(CCC){1|N<3>,3|C<3>}	H(N[5]C[5]N[5])	124.7420	0.000	1	124.7420	0.000	1	124.7420	0.000	1	124.7420	0.000	1	123.9940	9.202	404	123.9955	9.181	407
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5,5]	H	3:3:1:	4:4:3:	3:	N[5,5]-3:C[5]-3:H-1:	C[5,5]-4:C[5,5]-4:N[5]-3:	N[5]-3:	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H)	N[5,5](C[5,5]C[5,6a]C[5,5]C[5])(C[5,5]C[5,5]C[5]H)(N[5]C[5]H)	H(N[5]N[5,5]C[5])	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H){2|C<3>,2|C<4>,3|H<1>}	N[5,5](C[5,5]C[5,6a]C[5,5]C[5])(C[5,5]C[5,5]C[5]H)(N[5]C[5]H){1|N<3>,2|O<1>,4|C<3>,4|H<1>}	H(N[5]N[5,5]C[5])	124.7885	0.254	2	124.7885	0.064	2	122.2007	16.070	4	122.2007	16.070	4	122.2007	16.070	4	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5,5]	H	3:3:1:	4:4:3:	3:	N[5,5]-3:C[5]-3:H-1:	C[5,5]-4:C[5,5]-4:N[5]-3:	N[5]-3:	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H)	N[5,5](C[5,5]C[5,6a]C[5,5]C[5])(C[5,5]C[5]2H)(N[5]C[5]H)	H(N[5]N[5,5]C[5])	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H){2|C<3>,2|C<4>,3|H<1>}	N[5,5](C[5,5]C[5,6a]C[5,5]C[5])(C[5,5]C[5]2H)(N[5]C[5]H){1|N<3>,2|O<1>,3|H<1>,5|C<3>}	H(N[5]N[5,5]C[5])	116.3450	0.000	1	116.3450	0.000	1	122.2007	16.070	4	122.2007	16.070	4	122.2007	16.070	4	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5,5]	H	3:3:1:	4:4:3:	3:	N[5,5]-3:C[5]-3:H-1:	C[5,5]-4:C[5,5]-4:N[5]-3:	N[5]-3:	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H)	N[5,5](C[5,5]C[5,6a]C[5]2)(C[5,5]C[5]2H)(N[5]C[5]H)	H(N[5]N[5,5]C[5])	N[5](N[5,5]C[5,5]2)(C[5]C[5]O)(H){2|C<3>,2|C<4>,3|H<1>}	N[5,5](C[5,5]C[5,6a]C[5]2)(C[5,5]C[5]2H)(N[5]C[5]H){1|N<3>,2|O<1>,4|C<3>,4|H<1>}	H(N[5]N[5,5]C[5])	122.8810	0.000	1	122.8810	0.000	1	122.2007	16.070	4	122.2007	16.070	4	122.2007	16.070	4	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5,6]	H	3:4:1:	4:3:3:	3:	N[5,6]-3:C[5]-4:H-1:	C[5,6]-4:C[6]-3:N[5]-3:	N[5]-3:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(H)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]N)(N[5]C[5]H)	H(N[5]N[5,6]C[5])	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]HH)(H){1|C<2>,1|N<3>,2|C<3>,2|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6]N)(N[5]C[5]H){1|C<3>,2|C<2>,4|H<1>}	H(N[5]N[5,6]C[5])	126.5900	0.000	1	126.5900	0.000	1	126.5900	0.000	1	126.5900	0.000	1	126.5900	0.000	1	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|H<1>}	H(N[5]C[5]N[5])	130.2690	0.000	2	130.2690	0.000	2	130.2690	0.000	2	130.2690	0.000	2	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:4:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-4:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[6a]C[6a]N[6a])(C[5]C[5]CH)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){1|N<2>,2|C<3>,3|H<1>}	N[5](C[6a]C[6a]N[6a])(C[5]C[5]CH)(N[5]C[5]H){1|Cl<1>,1|O<1>,2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	122.5370	0.000	1	122.5370	0.000	1	122.5370	0.000	1	122.5370	0.000	1	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5]-4:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){3|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H){1|O<1>,4|C<3>,4|H<1>}	H(N[5]C[5]N[5])	121.5422	1.571	4	121.5422	2.469	4	121.5422	2.469	4	121.5422	2.469	4	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCHH)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){1|C<4>,3|H<1>}	N[5](C[5]C[5]CH)(N[5]C[5]H)(CCHH){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	122.4400	0.274	2	122.4400	0.075	2	121.8947	4.830	11	121.8947	4.830	11	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]2H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]2H){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	122.3830	0.379	4	122.3830	0.144	4	121.8947	4.830	11	121.8947	4.830	11	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]CH)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]CH){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	118.9300	5.005	2	118.9300	25.049	2	121.8947	4.830	11	121.8947	4.830	11	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]HP)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]H)(CC[6a]HP){1|O<1>,2|H<1>}	H(N[5]C[5]N[5])	123.1400	0.600	2	123.1400	0.360	2	121.8947	4.830	11	121.8947	4.830	11	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:4:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]C)(H)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]2H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]C)(H){1|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]2H){1|O<1>,2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	122.2900	0.000	1	122.2900	0.000	1	121.8947	4.830	11	121.8947	4.830	11	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:4:3:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:C[5]-4:N[5]-3:	N[5]-3:	N[5](C[5]C[5]O)(N[5]C[5]2)(H)	N[5](C[5]C[5,6a]C[5]C)(C[5]C[5]HH)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]O)(N[5]C[5]2)(H){1|C<4>,2|C<3>,4|H<1>}	N[5](C[5]C[5,6a]C[5]C)(C[5]C[5]HH)(N[5]C[5]H){1|N<3>,2|C<3>,2|H<1>,2|O<1>}	H(N[5]C[5]N[5])	122.3130	0.000	1	122.3130	0.000	1	122.3130	0.000	1	122.8715	0.624	2	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP2_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:4:3:	3:	N[5]-3:C[5]-3:H-1:	C[6]-4:C[5]-4:N[5]-3:	N[5]-3:	N[5](N[5]C[5]C[6])(C[5]C[5]O)(H)	N[5](C[6]C[6,6a]O[6]H)(C[5]C[5]CC)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[5]C[6])(C[5]C[5]O)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	N[5](C[6]C[6,6a]O[6]H)(C[5]C[5]CC)(N[5]C[5]H){1|O<1>,2|H<1>,3|C<3>}	H(N[5]C[5]N[5])	123.4300	0.000	1	123.4300	0.000	1	123.4300	0.000	1	122.8715	0.624	2	122.7915	9.649	20	122.8489	10.303	25
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5,5]	H	4:3:1:	4:3:3:	3:	C[5,5]-4:N[5,5]-3:H-1:	C[5,5]-4:N[5]-3:C[5]-3:	N[5]-3:	N[5](C[5,5]C[5,5]C[5]C)(N[5,5]C[5,5]C[5])(H)	N[5,5](C[5,5]C[5,5]C[5]O)(N[5]C[5,5]H)(C[5]N[5]S)	H(N[5]C[5,5]N[5,5])	N[5](C[5,5]C[5,5]C[5]C)(N[5,5]C[5,5]C[5])(H){1|C<3>,1|N<3>,1|O<2>,1|S<1>,2|C<4>,3|H<1>}	N[5,5](C[5,5]C[5,5]C[5]O)(N[5]C[5,5]H)(C[5]N[5]S){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(N[5]C[5,5]N[5,5])	106.2175	7.380	2	106.2175	54.465	2	106.2175	54.465	2	106.2175	54.465	2	106.2175	54.465	2	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]C)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]C)(N[5]C[5]H)(H){2|H<1>}	N[5](C[5]C[5]H)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	H(N[5]C[5]N[5])	116.6560	0.000	2	116.6560	0.000	2	116.6560	0.000	2	116.6560	0.000	2	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){1|O<1>,3|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H){1|O<1>,2|H<1>,3|C<3>}	H(N[5]C[5]N[5])	114.7600	0.816	2	114.7600	0.666	2	114.7600	0.666	2	114.7600	0.666	2	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3){1|Pd<4>,1|H<1>}	H(N[5]N[5]2)	126.7390	0.000	1	126.5320	0.037	3	127.1646	0.769	5	127.1646	0.769	5	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<5>,1|S<2>}	N[5](C[5]N[5]S)(N[5]N[5]H)(CH3){1|Pd<5>,1|H<1>}	H(N[5]N[5]2)	126.4285	0.101	2	126.5320	0.037	3	127.1646	0.769	5	127.1646	0.769	5	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](N[5]C[5]C)2(H)	N[5](C[5]C[5]Ru)(N[5]N[5]H)(CC[6a]HH)	H(N[5]N[5]2)	N[5](N[5]C[5]C)2(H){1|Ru<9>,1|C<3>}	N[5](C[5]C[5]Ru)(N[5]N[5]H)(CC[6a]HH){1|C<3>,1|C<4>}	H(N[5]N[5]2)	128.1350	0.000	1	128.1350	0.000	1	127.1646	0.769	5	127.1646	0.769	5	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	3:3:4:	3:	N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5]-3:	N[5](N[5]C[5]C)2(H)	N[5](C[5]C[6a]C[5])(N[5]N[5]H)(CH3)	H(N[5]N[5]2)	N[5](N[5]C[5]C)2(H){1|Ru<9>,1|C<3>}	N[5](C[5]C[6a]C[5])(N[5]N[5]H)(CH3){1|Ru<9>,1|C<4>,2|C<3>}	H(N[5]N[5]2)	128.0920	0.000	1	128.0920	0.000	1	127.1646	0.769	5	127.1646	0.769	5	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5,6a]-3:N[5]-3:H-1:	Si[5,6]-4:N[5]-3:C[6a]-3:	N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]Si[5,6]C[6a])(H)	N[5](Si[5,6]C[5,6a]N[6]2)(N[5]C[5,6a]H)(C[6a]C[6a]2)	H(N[5]C[5,6a]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]Si[5,6]C[6a])(H){1|H<1>,2|N<3>,4|C<3>}	N[5](Si[5,6]C[5,6a]N[6]2)(N[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	H(N[5]C[5,6a]N[5])	109.1020	0.000	1	109.1020	0.000	1	109.1020	0.000	1	109.1020	0.000	1	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:4:1:	3:3:3:	3:	N[5]-3:C[5]-4:H-1:	C[5]-3:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5,5]CH)(H)	N[5](C[5]C[5,5]O)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5,5]CH)(H){1|C<4>,1|O<1>,3|C<3>}	N[5](C[5]C[5,5]O)(C[6a]C[6a]2)(N[5]C[5]H){1|C<4>,3|H<1>,4|C<3>}	H(N[5]C[5]N[5])	105.5650	0.000	1	105.5650	0.000	1	105.5650	0.000	1	119.9553	155.371	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:4:1:	3:3:3:	3:	N[5]-3:C[5]-4:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]CH)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]CH)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H){2|C<3>,2|C<4>,4|H<1>}	H(N[5]C[5]N[5])	127.3940	0.000	1	127.1505	0.119	2	127.1505	0.119	2	119.9553	155.371	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	3:4:1:	3:3:3:	3:	N[5]-3:C[5]-4:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]CH)(H)	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]CH)(H){1|O<1>,2|C<3>,2|H<1>}	N[5](C[6a]C[6a]2)(C[5]C[5]O)(N[5]C[5]H){1|C<4>,2|C<3>,5|H<1>}	H(N[5]C[5]N[5])	126.9070	0.000	1	127.1505	0.119	2	127.1505	0.119	2	119.9553	155.371	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	3:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-3:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]CC)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[5]CC)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){2|C<4>,2|H<1>}	H(N[5]C[5]N[5])	99.5499	0.000	1	99.5499	0.000	1	107.2032	111.443	6	107.2032	111.443	6	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	3:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-3:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]CC)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CC[5]O)	H(N[5]C[5]N[5])	N[5](C[5]C[5]CC)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CC[5]O){2|C<4>,2|H<1>}	H(N[5]C[5]N[5])	127.5240	0.000	1	127.5240	0.000	1	107.2032	111.443	6	107.2032	111.443	6	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	3:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-3:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	H(N[5]C[5]N[5])	104.3371	4.717	3	104.3371	22.252	3	107.2032	111.443	6	107.2032	111.443	6	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	3:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-3:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(H){1|O<1>,2|C<3>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<3>,3|H<1>}	H(N[5]C[5]N[5])	103.1340	0.000	1	103.1340	0.000	1	107.2032	111.443	6	107.2032	111.443	6	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	4:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]O)	H(N[5]C[5]N[5])	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|C<3>,1|N<3>,2|H<1>}	N[5](C[5]C[6a]C[5]H)(N[5]C[5]H)(CC[6a]O){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(N[5]C[5]N[5])	105.4190	0.000	1	105.4190	0.000	1	106.8835	4.290	2	107.9613	5.630	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	4:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[6a]P[5]H)(N[5]C[5]C)(H)	N[5](C[5]C[6a]P[5]H)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[6a]P[5]H)(N[5]C[5]C)(H){1|Rh<6>,1|H<1>,4|C<3>}	N[5](C[5]C[6a]P[5]H)(N[5]C[5]H)(CCO){1|Rh<6>,1|H<1>,4|C<3>}	H(N[5]C[5]N[5])	108.3480	0.000	1	108.3480	0.000	1	106.8835	4.290	2	107.9613	5.630	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP2	N[5]	N[5]	H	4:3:1:	4:3:3:	3:	C[5]-4:N[5]-3:H-1:	S[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]HH)(N[5]S[5]C)(H)	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[5]HH)(N[5]S[5]C)(H){1|C<4>,1|H<1>,2|O<1>}	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	H(N[5]C[5]N[5])	110.1170	0.000	1	110.1170	0.000	1	110.1170	0.000	1	107.9613	5.630	3	115.2148	107.107	22	114.4650	106.614	24
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5,5]	H	3:4:1:	4:4:3:	3:	N[5,5]-3:C[5]-4:H-1:	C[5,5]-4:C[5]-4:N[5]-3:	N[5]-3:	N[5](N[5,5]C[5,5]C[5])(C[5]C[5]CH)(H)	N[5,5](C[5,5]C[5,5]C[5]H)(C[5]C[5,5]CH)(N[5]C[5]H)	H(N[5]N[5,5]C[5])	N[5](N[5,5]C[5,5]C[5])(C[5]C[5]CH)(H){1|C<3>,3|C<4>,3|H<1>}	N[5,5](C[5,5]C[5,5]C[5]H)(C[5]C[5,5]CH)(N[5]C[5]H){2|C<3>,2|O<2>,4|H<1>}	H(N[5]N[5,5]C[5])	109.7310	0.000	1	109.7310	0.000	1	109.7310	0.000	1	109.7310	0.000	1	109.7310	0.000	1	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5,6]	H	3:3:1:	4:4:3:	3:	N[5,6]-3:C[5]-3:H-1:	C[5,6]-4:C[6]-4:N[5]-3:	N[5]-3:	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(H)	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6]C)(N[5]C[5]H)	H(N[5]N[5,6]C[5])	N[5](N[5,6]C[5,6]C[6])(C[5]C[5]O)(H){1|C<3>,3|C<4>,3|H<1>}	N[5,6](C[5,6]C[5]C[6]H)(C[6]C[6a]C[6]C)(N[5]C[5]H){1|C<4>,1|O<1>,2|C<3>,6|H<1>}	H(N[5]N[5,6]C[5])	118.1660	0.000	1	118.1660	0.000	1	118.1660	0.000	1	118.1660	0.000	1	118.1660	0.000	1	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	C[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	N[5](C[5]C[5]N)(N[5]C[5]H)(H)	H(N[5]C[5]N[5])	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	N[5](C[5]C[5]N)(N[5]C[5]H)(H){1|H<1>,1|N<3>}	H(N[5]C[5]N[5])	116.1605	3.201	2	116.1605	10.247	2	116.1605	10.247	2	123.1985	21.261	8	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	H(N[5]N[5]2)	126.7960	0.000	1	126.5453	0.047	3	125.5445	1.298	6	123.1985	21.261	8	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<5>,1|S<2>}	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	H(N[5]N[5]2)	126.4200	0.007	2	126.5453	0.047	3	125.5445	1.298	6	123.1985	21.261	8	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<4>,1|S<2>}	H(N[5]N[5]2)	124.9870	0.000	1	124.5437	0.192	3	125.5445	1.298	6	123.1985	21.261	8	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	3:3:1:	3:	N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:H-1:	N[5]-3:	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H)	N[5](N[5]C[5]C)(N[5]N[5]H)(H)	H(N[5]N[5]2)	N[5](N[5]C[5]Pd)(N[5]N[5]H)(H){1|C<4>,1|S<2>}	N[5](N[5]C[5]C)(N[5]N[5]H)(H){1|Pd<5>,1|S<2>}	H(N[5]N[5]2)	124.3220	0.298	2	124.5437	0.192	3	125.5445	1.298	6	123.1985	21.261	8	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	C[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5]N[5]S)(N[5]C[5]C)(H)	N[5](C[5]N[5]HH)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]N[5]S)(N[5]C[5]C)(H){1|C<3>,2|H<1>}	N[5](C[5]N[5]HH)(N[5]C[5]H)(CCO){1|C<3>,1|S<1>}	H(N[5]C[5]N[5])	113.7040	0.000	1	113.7040	0.000	1	113.7040	0.000	1	117.4520	28.095	2	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	3:3:1:	4:3:3:	3:	N[5]-3:C[5]-3:H-1:	C[5]-4:C[6a]-3:N[5]-3:	N[5]-3:	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H)	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H)	H(N[5]C[5]N[5])	N[5](N[5]C[6a]C[5])(C[5]C[5]O)(H){3|C<3>,3|H<1>}	N[5](C[5]C[6a]C[5]H)(C[6a]C[6a]2)(N[5]C[5]H){1|O<1>,4|C<3>,4|H<1>}	H(N[5]C[5]N[5])	121.2000	0.000	1	121.2000	0.000	1	121.2000	0.000	1	117.4520	28.095	2	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	4:3:1:	3:3:3:	3:	C[5]-4:N[5]-3:H-1:	C[5]-3:N[5]-3:C-3:	N[5]-3:	N[5](C[5]C[5]CH)(N[5]C[5]C)(H)	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO)	H(N[5]C[5]N[5])	N[5](C[5]C[5]CH)(N[5]C[5]C)(H){1|O<1>,2|H<1>}	N[5](C[5]C[5]O)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	H(N[5]C[5]N[5])	101.7570	0.000	1	101.7570	0.000	1	101.7570	0.000	1	101.7570	0.000	1	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	4:3:1:	3:4:3:	3:	C[5,5]-4:N[5]-3:H-1:	N[5]-3:C[5]-4:C-3:	N[5]-3:	N[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5]C)(H)	N[5](N[5]C[5,5]H)(C[5]C[5]CH)(COO)	H(N[5]C[5,5]N[5])	N[5](C[5,5]C[5,6a]C[5]2)(N[5]C[5]C)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,3|H<1>}	N[5](N[5]C[5,5]H)(C[5]C[5]CH)(COO){2|C<3>,2|H<1>}	H(N[5]C[5,5]N[5])	104.8690	0.000	1	104.8690	0.000	1	104.8690	0.000	1	104.8690	0.000	1	117.9945	79.597	13	117.4551	72.794	15
542	542	951	0:SP3_SP-NON_SP3	N[5]	N[5]	H	4:3:1:	4:3:3:	3:	C[5,5]-4:N[5]-3:H-1:	C[5]-4:N[5]-3:C-3:	N[5]-3:	N[5](C[5,5]C[3,5,5]C[5]C)(N[5]C[5]C)(H)	N[5](C[5]C[3,5,5]HH)(N[5]C[5,5]H)(CC[6a]O)	H(N[5]C[5,5]N[5])	N[5](C[5,5]C[3,5,5]C[5]C)(N[5]C[5]C)(H){3|C<4>,4|H<1>}	N[5](C[5]C[3,5,5]HH)(N[5]C[5,5]H)(CC[6a]O){4|C<4>}	H(N[5]C[5,5]N[5])	106.8110	0.000	1	106.8110	0.000	1	106.8110	0.000	1	106.8110	0.000	1	117.9945	79.597	13	117.4551	72.794	15
542	542	952	0:SP3_SP2_SP3	N[5]	N[5,6]	S	3:4:4:	4:3:3:	3:3:1:1:	N[5,6]-3:C[5]-4:S-4:	C[5,6]-4:C[6]-3:N[5]-3:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(SC[6a]OO)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S)	S(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)2	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(SC[6a]OO){1|C<4>,1|H<1>,1|N<2>,2|N<3>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	S(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)2	111.0560	0.000	1	111.0560	0.000	1	111.0560	0.000	1	111.0560	0.000	1	112.3160	3.175	2	112.3160	3.175	2
542	542	952	0:SP3_SP2_SP3	N[5]	N[5,6]	S	4:3:4:	4:3:3:	3:3:1:1:	C[5,6]-4:N[5,6]-3:S-4:	C[5,6]-4:N[5]-3:C[6]-3:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](C[5,6]C[5,6]C[6]H)(N[5,6]C[5,6]C[6])(SC[6a]OO)	N[5,6](C[5,6]C[6,6a]C[5,6]H)(N[5]C[5,6]S)(C[6]N[6]H)	S(N[5]C[5,6]N[5,6])(C[6a]C[6a]2)(O)2	N[5](C[5,6]C[5,6]C[6]H)(N[5,6]C[5,6]C[6])(SC[6a]OO){1|N<2>,2|C<4>,3|C<3>,3|H<1>}	N[5,6](C[5,6]C[6,6a]C[5,6]H)(N[5]C[5,6]S)(C[6]N[6]H){1|H<1>,2|C<4>,3|C<3>}	S(N[5]C[5,6]N[5,6])(C[6a]C[6a]2)(O)2	113.5760	0.000	1	113.5760	0.000	1	113.5760	0.000	1	113.5760	0.000	1	112.3160	3.175	2	112.3160	3.175	2
542	542	952	0:SP3_SP3_SP3	N[5]	N[5,6,6]	S	3:4:4:	4:4:3:	3:3:1:1:	N[5,6,6]-3:C[5]-4:S-4:	C[5,6,6]-4:C[6,6]-4:N[5]-3:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](N[5,6,6]C[5,6,6]C[6,6])(C[5]C[5,6]HH)(SC[6a]OO)	N[5,6,6](C[5,6,6]C[5,6]C[6]H)(C[6,6]C[6,6a]O[6]H)(N[5]C[5]S)	S(N[5]N[5,6,6]C[5])(C[6a]C[6a]2)(O)2	N[5](N[5,6,6]C[5,6,6]C[6,6])(C[5]C[5,6]HH)(SC[6a]OO){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	N[5,6,6](C[5,6,6]C[5,6]C[6]H)(C[6,6]C[6,6a]O[6]H)(N[5]C[5]S){1|C<4>,3|C<3>,3|H<1>}	S(N[5]N[5,6,6]C[5])(C[6a]C[6a]2)(O)2	112.2860	0.000	1	112.2860	0.000	1	112.2860	0.000	1	112.2860	0.000	1	112.2860	0.000	1	111.6250	0.564	4
542	542	952	0:SP3_SP3_SP3	N[5]	N[5,6]	S	3:4:4:	4:3:3:	3:3:1:1:	N[5,6]-3:C[5]-4:S-4:	C[5,6]-4:C[6]-3:N[5]-3:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(SC[6a]OO)	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S)	S(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)2	N[5](N[5,6]C[5,6]C[6])(C[5]C[6a]C[5]H)(SC[6a]OO){1|C<4>,1|H<1>,1|N<2>,2|N<3>,3|C<3>}	N[5,6](C[5,6]C[6,6a]C[5]H)(C[6]N[6]N)(N[5]C[5]S){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	S(N[5]N[5,6]C[5])(C[6a]C[6a]2)(O)2	110.7230	0.000	1	110.7230	0.000	1	110.7230	0.000	1	110.7230	0.000	1	111.0070	0.161	2	111.6250	0.564	4
542	542	952	0:SP3_SP3_SP3	N[5]	N[5,6]	S	4:3:4:	4:3:4:	3:3:1:1:	C[5,5]-4:N[5,6]-3:S-4:	C[5,6]-4:N[5]-3:C[6]-4:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](C[5,5]C[5,5]N[5]H)(N[5,6]C[5,6]C[6])(SC[6a]OO)	N[5,6](C[5,6]C[6,6a]C[5,5]H)(N[5]C[5,5]S)(C[6]C[6]HH)	S(N[5]C[5,5]N[5,6])(C[6a]C[6a]2)(O)2	N[5](C[5,5]C[5,5]N[5]H)(N[5,6]C[5,6]C[6])(SC[6a]OO){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	N[5,6](C[5,6]C[6,6a]C[5,5]H)(N[5]C[5,5]S)(C[6]C[6]HH){2|N<3>,3|C<3>,3|H<1>}	S(N[5]C[5,5]N[5,6])(C[6a]C[6a]2)(O)2	111.2910	0.000	1	111.2910	0.000	1	111.2910	0.000	1	111.2910	0.000	1	111.0070	0.161	2	111.6250	0.564	4
542	542	952	0:SP3_SP3_SP3	N[5]	N[5]	S	4:3:4:	4:3:3:	3:3:1:1:	C[5]-4:N[5]-3:S-4:	C[5]-4:N[5]-3:C-3:	N[5]-3:C[6a]-3:O-1:O-1:	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(SC[6a]OO)	N[5](C[5]C[5]HH)(N[5]C[5]S)(COO)	S(N[5]C[5]N[5])(C[6a]C[6a]2)(O)2	N[5](C[5]C[6a]C[5]H)(N[5]C[5]C)(SC[6a]OO){2|C<3>,4|H<1>}	N[5](C[5]C[5]HH)(N[5]C[5]S)(COO){1|C<3>,3|H<1>}	S(N[5]C[5]N[5])(C[6a]C[6a]2)(O)2	112.2000	0.000	1	112.2000	0.000	1	112.2000	0.000	1	112.2000	0.000	1	112.2000	0.000	1	111.6250	0.564	4
542	542	955	5:SP2_SP3_SP3	N[5,6]	N[5,6]	P[5]	4:3:4:	4:3:4:	3:2:4:4:	B[5a,6]-4:N[5,6]-3:P[5]-4:	B[5,5a]-4:N[5,6]-3:C[6]-4:	N[5,6]-3:O[5]-2:C-4:C-4:	N[5,6](B[5a,6]O[5a]2O[6])(N[5,6]B[5,5a]C[6])(P[5]O[5]CC)	N[5,6](B[5,5a]O[5a]2O[5])(N[5,6]B[5a,6]P[5])(C[6]P[6]CH)	P[5](N[5,6]B[5a,6]N[5,6])(O[5]B[5,5a])(CC3)2	N[5,6](B[5a,6]O[5a]2O[6])(N[5,6]B[5,5a]C[6])(P[5]O[5]CC){1|H<1>,1|P<4>,2|O<2>,3|C<3>}	N[5,6](B[5,5a]O[5a]2O[5])(N[5,6]B[5a,6]P[5])(C[6]P[6]CH){2|C<3>,3|O<2>,4|C<4>}	P[5](N[5,6]B[5a,6]N[5,6])(O[5]B[5,5a])(CC3)2{1|C<4>,5|O<2>}	109.9620	0.000	1	109.9620	0.000	1	109.9620	0.000	1	109.9620	0.000	1	109.9620	0.000	1	109.9620	0.000	1
542	542	959	5:SP2_SP3_SP3	N[5]	N[5]	S[5]	4:3:3:	4:3:1:	4:3:1:1:	S[5]-4:N[5]-3:C-3:	C[5]-4:N[5]-3:H-1:	C[5]-4:N[5]-3:O-1:O-1:	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO)	N[5](C[5]C[5]HH)(N[5]S[5]C)(H)	S[5](C[5]C[5]CH)(N[5]N[5]C)(O)2	N[5](S[5]C[5]OO)(N[5]C[5]H)(CCO){1|C<4>,3|H<1>}	N[5](C[5]C[5]HH)(N[5]S[5]C)(H){1|C<4>,1|H<1>,2|O<1>}	S[5](C[5]C[5]CH)(N[5]N[5]C)(O)2{3|H<1>}	112.4230	0.000	1	112.4230	0.000	1	112.4230	0.000	1	112.4230	0.000	1	112.4230	0.000	1	112.4230	0.000	1
542	542	960	5:SP2_SP2_SP2	N[5,5]	N[5,5]	N[5]	3:2:3:	3:4:3:	3:3:	N[5,5]-3:N[5]-2:C[5]-3:	C[5,6a]-3:C[5]-4:N[5,5]-3:	C[5,6a]-3:N[5,5]-3:	N[5,5](N[5,5]C[5,6a]C[5])(N[5]C[5,6a])(C[5]C[5]Re)	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]2C[5])(N[5,5]C[5]N[5])	N[5](C[5,6a]C[5,6a]C[6a])(N[5,5]N[5,5]C[5])	N[5,5](N[5,5]C[5,6a]C[5])(N[5]C[5,6a])(C[5]C[5]Re){1|H<1>,4|C<3>}	N[5,5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]2C[5])(N[5,5]C[5]N[5]){1|Re<6>,2|H<1>,6|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5,5]N[5,5]C[5]){1|Re<6>,1|C<4>,1|H<1>,3|C<3>}	113.7870	0.000	1	113.7870	0.000	1	113.7870	0.000	1	113.7870	0.000	1	113.3255	0.426	2	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5,5]	N[5,5]	N[5]	3:3:2:	3:4:3:	3:3:	N[5,5]-3:C[5]-3:N[5]-2:	N[5,5]-3:C[5]-4:C[5]-3:	N[5,5]-3:C[5]-3:	N[5,5](N[5,5]C[5]2)(C[5]C[5]H)(N[5]C[5])	N[5,5](N[5,5]C[5]N[5])(C[5]C[5]HH)(C[5]C[5]C)	N[5](N[5,5]N[5,5]C[5])(C[5]C[6a]C[5])	N[5,5](N[5,5]C[5]2)(C[5]C[5]H)(N[5]C[5]){1|Au<2>,1|C<3>,1|C<4>,2|H<1>}	N[5,5](N[5,5]C[5]N[5])(C[5]C[5]HH)(C[5]C[5]C){1|Au<2>,1|C<3>,1|H<1>}	N[5](N[5,5]N[5,5]C[5])(C[5]C[6a]C[5]){3|H<1>,4|C<3>}	112.8640	0.000	1	112.8640	0.000	1	112.8640	0.000	1	112.8640	0.000	1	113.3255	0.426	2	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5,6]	N[5,6]	N[5]	4:3:2:	4:3:3:	3:3:	B[6]-4:N[5,6]-3:N[5]-2:	B[6]-4:N[5,6]-3:C[5]-3:	N[5,6]-3:C[5]-3:	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5])	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C)	N[5](N[5,6]N[5,6]B[6])(C[5]C[5]C)	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]C[5])(N[5]C[5]){1|N<2>,1|N<3>,8|C<3>}	N[5,6](B[6]N[5,6]C[6a]2)(N[5,6]B[6]N[5])(C[5]C[5]C){1|N<3>,8|C<3>}	N[5](N[5,6]N[5,6]B[6])(C[5]C[5]C){1|B<4>,1|N<3>,3|C<3>}	111.7930	0.461	2	111.7930	0.213	2	111.7930	0.213	2	111.7930	0.213	2	111.7930	0.213	2	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:2:1:	3:2:2:	3:2:	N[5]-3:N[5]-2:H-1:	N[5]-3:N[5]-2:N-2:	N[5]-3:N[5]-2:	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]H)(N[5]N[5])	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]H)(N[5]N[5]){1|N<2>}	108.7854	0.239	5	108.7854	0.057	5	108.7854	0.057	5	108.7854	0.057	5	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:2:2:	3:2:1:	3:2:	N[5]-3:N[5]-2:N-2:	N[5]-3:N[5]-2:H-1:	N[5]-3:N[5]-2:	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]N)(N[5]N[5])	N[5](N[5]N[5]H)(N[5]N[5])(NN)	N[5](N[5]N[5]N)(N[5]N[5])(H)	N[5](N[5]N[5]N)(N[5]N[5]){1|H<1>}	107.4673	0.597	4	107.4673	0.356	4	107.4673	0.356	4	107.4673	0.356	4	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:1:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	C[5,6a]-3:N[5]-3:O-1:	C[5,6a]-3:N[5]-3:	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a]){1|H<1>,1|O<2>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O){1|H<1>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5]){1|H<1>,1|O<1>,4|C<3>}	112.7710	0.000	1	113.4285	0.865	2	113.4285	0.865	2	113.4285	0.865	2	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:1:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	C[5,6a]-3:N[5]-3:O-1:	C[5,6a]-3:N[5]-3:	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a])	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])	N[5](N[5]C[5,6a]O)(C[6a]C[6a]2)(N[5]C[5,6a]){1|H<1>,5|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(O){1|H<1>,4|C<3>}	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5]){1|H<1>,1|O<1>,4|C<3>}	114.0860	0.000	1	113.4285	0.865	2	113.4285	0.865	2	113.4285	0.865	2	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:2:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[6a]-3:N[5]-2:	C[5]-3:N[5]-3:	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](C[5]C[6a]N[5])(N[5]C[6a]N[5])	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){2|H<1>,5|C<3>}	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){2|H<1>,5|C<3>}	N[5](C[5]C[6a]N[5])(N[5]C[6a]N[5]){5|C<3>}	109.9742	0.258	28	109.9742	0.067	28	109.9742	0.067	28	110.0764	0.234	41	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:2:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[5]-3:	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]N[5]O)	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|O<2>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|O<2>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[5]N[5]O){3|C<3>}	110.4061	0.922	8	110.4061	0.851	8	110.2964	0.552	13	110.0764	0.234	41	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:2:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[5]-3:	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]N[5]S)	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|S<1>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|S<1>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[5]N[5]S){3|C<3>}	110.1850	0.000	1	110.1208	0.105	5	110.2964	0.552	13	110.0764	0.234	41	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:2:	3:3:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[6a]-3:N[5]-2:	N[5]-3:C[5]-3:	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]N[5]S)	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|S<2>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[6a]C[6a]2)(N[5]C[5]){1|S<2>,2|H<1>,4|C<3>}	N[5](N[5]C[6a]N[5])(C[5]N[5]S){3|C<3>}	110.1047	0.371	4	110.1208	0.105	5	110.2964	0.552	13	110.0764	0.234	41	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:4:	3:3:	C[6a]-3:N[5]-3:N[5]-2:	N[5]-3:C[5]-3:C-4:	C[5]-3:N[5]-3:	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]C[5]Ir)(CH3)	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5])	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5]){1|Ir<4>,2|H<1>,3|C<3>}	N[5](N[5]C[6a]N[5])(C[5]C[5]Ir)(CH3){3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5]){1|Ir<4>,1|C<4>,4|C<3>}	110.3770	0.000	1	110.3770	0.000	1	110.4545	0.063	4	110.4545	0.063	4	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:4:	3:3:	C[6a]-3:N[5]-3:N[5]-2:	N[5]-3:C[5]-3:C-4:	C[5]-3:N[5]-3:	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]C[5]Mo)(CH3)	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5])	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5]){1|Mo<9>,2|H<1>,3|C<3>}	N[5](N[5]C[6a]N[5])(C[5]C[5]Mo)(CH3){3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5]){1|Mo<9>,1|C<4>,4|C<3>}	110.1940	0.000	1	110.1940	0.000	1	110.4545	0.063	4	110.4545	0.063	4	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP2	N[5]	N[5]	N[5]	3:3:2:	3:3:4:	3:3:	C[6a]-3:N[5]-3:N[5]-2:	N[5]-3:C[5]-3:C-4:	C[5]-3:N[5]-3:	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]C[5]Pd)(CH3)	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5])	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5]){1|Pd<4>,2|H<1>,3|C<3>}	N[5](N[5]C[6a]N[5])(C[5]C[5]Pd)(CH3){3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5]){1|Pd<4>,1|C<4>,4|C<3>}	110.6235	0.240	2	110.6235	0.057	2	110.4545	0.063	4	110.4545	0.063	4	109.9215	1.254	56	110.0973	1.660	60
542	542	960	5:SP2_SP2_SP3	N[5]	N[5]	N[5]	3:3:2:	3:4:4:	3:3:	C[6a]-3:N[5]-3:N[5]-2:	N[5]-3:C[5]-4:C-4:	C[5]-3:N[5]-3:	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]C[5]HN)(CH3)	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5])	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5]){1|N<3>,3|C<3>,3|H<1>}	N[5](N[5]C[6a]N[5])(C[5]C[5]HN)(CH3){3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5]){1|C<4>,1|H<1>,1|N<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	110.3110	0.000	1
542	542	960	5:SP3_SP2_SP3	N[5]	N[5]	N[5]	3:3:2:	3:4:4:	3:3:	C[6a]-3:N[5]-3:N[5]-2:	N[5]-3:C[5]-4:C-4:	C[5]-3:N[5]-3:	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5])	N[5](N[5]C[6a]N[5])(C[5]C[5]CH)(CH3)	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5])	N[5](C[6a]C[6a]2)(N[5]C[5]C)(N[5]C[5]){1|C<4>,3|C<3>,3|H<1>}	N[5](N[5]C[6a]N[5])(C[5]C[5]CH)(CH3){3|C<3>}	N[5](C[5]C[6a]C[5])(N[5]C[6a]N[5]){1|H<1>,2|C<4>,4|C<3>}	111.1780	0.000	1	111.1780	0.000	1	111.1780	0.000	1	111.1780	0.000	1	111.1780	0.000	1	111.1780	0.000	1
542	542	969	0:SP2_SP-NON_SP2	N[5]	N[5]	Ga	3:3:3:	3:3:4:	3:3:3:	Ga-3:N[5]-3:C[5]-3:	N[5]-3:C[5]-3:Ga-4:	N[5]-3:C[6a]-3:C[6]-3:	N[5](GaC[6a]C[6])(N[5]C[5]Ga)(C[5]C[5]C)	N[5](N[5]C[5]Ga)(C[5]C[5]C)(GaC[6a]3)	Ga(N[5]C[5]N[5])(C[6a]C[6a]2)(C[6]C[6]2)	N[5](GaC[6a]C[6])(N[5]C[5]Ga)(C[5]C[5]C){1|C<4>,1|H<1>}	N[5](N[5]C[5]Ga)(C[5]C[5]C)(GaC[6a]3){1|C<4>,1|H<1>}	Ga(N[5]C[5]N[5])(C[6a]C[6a]2)(C[6]C[6]2)	116.1530	0.000	1	116.1530	0.000	1	116.1530	0.000	1	116.1530	0.000	1	116.1530	0.000	1	116.1530	0.000	1
542	542	976	5:SP2_SP2_SP2	N[5]	N[5]	O[5]	3:2:4:	3:3:1:	3:3:	N[5]-3:O[5]-2:C-4:	C[5]-3:N[5]-3:O-1:	C[5]-3:N[5]-3:	N[5](N[5]C[5]O)(O[5]C[5])(CH3)	N[5](C[5]C[5]C)(N[5]O[5]C)(O)	O[5](C[5]C[5]O)(N[5]N[5]C)	N[5](N[5]C[5]O)(O[5]C[5])(CH3){1|C<3>,1|O<1>}	N[5](C[5]C[5]C)(N[5]O[5]C)(O){1|O<1>}	O[5](C[5]C[5]O)(N[5]N[5]C){1|C<3>,1|O<1>}	104.2520	0.000	1	104.2520	0.000	1	104.2520	0.000	1	104.2520	0.000	1	104.2520	0.000	1	104.2520	0.000	1
542	542	983	0:SP3_SP1_SP2	N[5]	N[5]	C	3:4:2:	4:3:3:	3:1:	N[5]-3:C[5]-4:C-2:	C[5,5]-4:C[6a]-3:N[5]-3:	N[5]-3:N-1:	N[5](N[5]C[5,5]C[6a])(C[5]C[5]HH)(CN)	N[5](C[5,5]C[5,6a]2C[5])(C[6a]C[6a]2)(N[5]C[5]C)	C(N[5]C[5]N[5])(N)	N[5](N[5]C[5,5]C[6a])(C[5]C[5]HH)(CN){1|Cl<1>,5|C<3>}	N[5](C[5,5]C[5,6a]2C[5])(C[6a]C[6a]2)(N[5]C[5]C){1|Cl<1>,4|H<1>,7|C<3>}	C(N[5]C[5]N[5])(N)	110.2660	0.000	1	110.2660	0.000	1	110.2660	0.000	1	110.2660	0.000	1	112.5280	10.233	2	112.5280	10.233	2
542	542	983	0:SP3_SP1_SP2	N[5]	N[5]	C	4:3:2:	4:3:3:	3:1:	C[5,5,6]-4:N[5]-3:C-2:	C[5,5]-4:N[5]-3:C[6a]-3:	N[5]-3:N-1:	N[5](C[5,5,6]C[5,5,6]2H)(N[5]C[5,5]C[6a])(CN)	N[5](C[5,5]C[5,5,6]C[5,6a]2)(N[5]C[5,5,6]C)(C[6a]C[6a]2)	C(N[5]C[5,5,6]N[5])(N)	N[5](C[5,5,6]C[5,5,6]2H)(N[5]C[5,5]C[6a])(CN){2|H<1>,3|C<4>,4|C<3>}	N[5](C[5,5]C[5,5,6]C[5,6a]2)(N[5]C[5,5,6]C)(C[6a]C[6a]2){2|C<4>,4|H<1>,6|C<3>}	C(N[5]C[5,5,6]N[5])(N)	114.7900	0.000	1	114.7900	0.000	1	114.7900	0.000	1	114.7900	0.000	1	112.5280	10.233	2	112.5280	10.233	2
542	542	983	0:SP3_SP1_SP3	N[5]	N[5]	C	3:4:2:	4:3:3:	3:1:	N[5]-3:C[5]-4:C-2:	C[5,5]-4:C[6a]-3:N[5]-3:	N[5]-3:N-1:	N[5](N[5]C[5,5]C[6a])(C[5]C[5]HH)(CN)	N[5](C[5,5]C[5,6a]2C[5])(C[6a]C[6a]2)(N[5]C[5]C)	C(N[5]C[5]N[5])(N)	N[5](N[5]C[5,5]C[6a])(C[5]C[5]HH)(CN){1|Cl<1>,5|C<3>}	N[5](C[5,5]C[5,6a]2C[5])(C[6a]C[6a]2)(N[5]C[5]C){1|Cl<1>,4|H<1>,7|C<3>}	C(N[5]C[5]N[5])(N)	110.2540	0.000	1	110.2540	0.000	1	110.2540	0.000	1	110.2540	0.000	1	110.2540	0.000	1	110.2540	0.000	1
542	542	984	0:SP2_SP-NON_SP2	N[5]	N[5]	Ga	3:3:4:	3:3:3:	3:3:3:3:	N[5]-3:C[5]-3:Ga-4:	Ga-3:N[5]-3:C[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	N[5](N[5]C[5]Ga)(C[5]C[5]C)(GaC[6a]3)	N[5](GaC[6a]C[6])(N[5]C[5]Ga)(C[5]C[5]C)	Ga(N[5]C[5]N[5])(C[6a]C[6a]2)3	N[5](N[5]C[5]Ga)(C[5]C[5]C)(GaC[6a]3){1|C<4>,1|H<1>}	N[5](GaC[6a]C[6])(N[5]C[5]Ga)(C[5]C[5]C){1|C<4>,1|H<1>}	Ga(N[5]C[5]N[5])(C[6a]C[6a]2)3	114.8290	0.000	1	114.8290	0.000	1	114.8290	0.000	1	114.8290	0.000	1	114.8290	0.000	1	114.8290	0.000	1
542	542	987	5:SP2_SP-NON_SP2	N[5,5]	N[5,5]	P[5]	3:3:2:	3:3:2:	3:3:	C[5,6]-3:N[5,5]-3:P[5]-2:	C[5,6]-3:N[5,5]-3:P[5]-2:	N[5,5]-3:C[5,6]-3:	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6])	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6])	P[5](N[5,5]C[5,6]N[5,5])(C[5,6]C[5,6]C[6])	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6]){2|H<1>,4|C<4>}	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6]){2|H<1>,4|C<4>}	P[5](N[5,5]C[5,6]N[5,5])(C[5,6]C[5,6]C[6]){1|C<3>,1|P<2>,2|H<1>,3|C<4>}	114.3340	0.166	4	114.3340	0.027	4	114.3340	0.027	4	114.3340	0.027	4	114.3770	0.030	5	114.3770	0.030	5
542	542	987	5:SP2_SP-NON_SP2	N[5,5]	N[5,5]	P[5]	3:3:2:	3:3:3:	3:3:	C[5,6]-3:N[5,5]-3:P[5]-2:	C[5,6]-3:N[5,5]-3:P[5]-3:	N[5,5]-3:C[5,6]-3:	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6])	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6]Sn)	P[5](N[5,5]C[5,6]N[5,5])(C[5,6]C[5,6]C[6])	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6]){1|Sn<3>,2|H<1>,4|C<4>}	N[5,5](C[5,6]C[5,6]C[6])(N[5,5]C[5,6]P[5])(P[5]C[5,6]Sn){2|H<1>,4|C<4>}	P[5](N[5,5]C[5,6]N[5,5])(C[5,6]C[5,6]C[6]){1|C<3>,1|P<3>,2|H<1>,3|C<4>}	114.5490	0.000	1	114.5490	0.000	1	114.5490	0.000	1	114.5490	0.000	1	114.3770	0.030	5	114.3770	0.030	5
542	542	992	0:SP2_SP3_SP3	N[5]	N[5]	P	3:3:4:	4:3:4:	3:4:4:4:	C[5,6a]-3:N[5]-3:P-4:	C[5,5]-4:N[5]-3:C-4:	N[5]-3:C-4:C-4:C-4:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(PC3)	N[5](C[5,5]C[5,6a]3)(N[5]C[5,6a]P)(CC[6a]2H)	P(N[5]C[5,6a]N[5])(CH3)3	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5,5]C)(PC3){1|H<1>,4|C<3>}	N[5](C[5,5]C[5,6a]3)(N[5]C[5,6a]P)(CC[6a]2H){6|C<3>}	P(N[5]C[5,6a]N[5])(CH3)3	116.8670	0.000	1	116.8670	0.000	1	116.8670	0.000	1	116.8670	0.000	1	116.8670	0.000	1	116.8670	0.000	1
542	562	562	0:SP2_SP3_SP3	N[5,5]	Si[5]	Si[5]	6:4:4:	3:4:4:4:	3:4:4:4:	Nb[3,4x5]-6:Si[5]-4:Si[5]-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5](Nb[3,4x5]N[5,5]P[5,5]2C[3]2)(Si[5]C[5]CC)2	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	N[5,5](Nb[3,4x5]N[5,5]P[5,5]2C[3]2)(Si[5]C[5]CC)2{2|Si<4>,2|C<4>,3|C<3>,5|H<1>}	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|N<3>,1|P<4>,3|C<3>,4|C<4>}	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|N<3>,1|P<4>,3|C<3>,4|C<4>}	123.1760	0.000	1	123.1760	0.000	1	123.1760	0.000	1	123.1760	0.000	1	123.1760	0.000	1	123.1760	0.000	1
542	562	562	0:SP3_SP3_SP3	N[5,5]	Si[5]	Si[5]	5:4:4:	3:4:4:4:	3:4:4:4:	Nb[4x5]-5:Si[5]-4:Si[5]-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5](Nb[4x5]N[5,5]P[5,5]2N)(Si[5]C[5]CC)2	Si[5](N[5,5]Nb[4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	Si[5](N[5,5]Nb[4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	N[5,5](Nb[4x5]N[5,5]P[5,5]2N)(Si[5]C[5]CC)2{2|Si<4>,2|C<3>,2|C<4>,4|H<1>}	Si[5](N[5,5]Nb[4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|C<3>,1|N<2>,1|N<3>,1|P<4>,4|C<4>}	Si[5](N[5,5]Nb[4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|C<3>,1|N<2>,1|N<3>,1|P<4>,4|C<4>}	123.7650	0.831	4	123.7650	0.690	4	123.7650	0.690	4	123.7650	0.690	4	123.4562	0.995	5	123.4562	0.995	5
542	562	562	0:SP3_SP3_SP3	N[5,5]	Si[5]	Si[5]	6:4:4:	3:4:4:4:	3:4:4:4:	Nb[3,4x5]-6:Si[5]-4:Si[5]-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5]-3:C[5]-4:C-4:C-4:	N[5,5](Nb[3,4x5]N[5,5]P[5,5]2C[3]2)(Si[5]C[5]CC)2	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2	N[5,5](Nb[3,4x5]N[5,5]P[5,5]2C[3]2)(Si[5]C[5]CC)2{2|Si<4>,2|C<4>,3|C<3>,5|H<1>}	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|N<3>,1|P<4>,3|C<3>,4|C<4>}	Si[5](N[5,5]Nb[3,4x5]Si[5])(C[5]P[5,5]HH)(CH3)2{1|N<3>,1|P<4>,3|C<3>,4|C<4>}	122.2210	0.000	1	122.2210	0.000	1	122.2210	0.000	1	122.2210	0.000	1	123.4562	0.995	5	123.4562	0.995	5
542	562	562	5:SP2_SP3_SP3	N[5,5]	Si[5,5,6]	Si[5,5,6]	4:4:1:	4:4:3:4:	4:4:3:4:	Si[5,5,6]-4:Si[5,5,6]-4:H-1:	Si[5,6]-4:Si[5,6]-4:N[5,5]-3:C-4:	Si[5,6]-4:Si[5,6]-4:N[5,5]-3:C-4:	N[5,5](Si[5,5,6]Si[5,6]2C)2(H)	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3)	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3)	N[5,5](Si[5,5,6]Si[5,6]2C)2(H){8|C<4>}	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3){5|C<4>}	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3){5|C<4>}	113.6530	0.000	1	113.6530	0.000	1	113.6530	0.000	1	113.6530	0.000	1	113.6530	0.000	1	113.0942	4.709	6
542	562	562	5:SP2_SP3_SP3	N[5]	Si[5]	Si[5]	4:4:2:	4:3:4:4:	4:3:4:4:	Si[5]-4:Si[5]-4:N-2:	C[5]-4:N[5]-3:C-4:C-4:	C[5]-4:N[5]-3:C-4:C-4:	N[5](Si[5]C[5]CC)2(NFe)	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2	N[5](Si[5]C[5]CC)2(NFe){4|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2{2|C<4>,2|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2{2|C<4>,2|H<1>}	112.2482	2.032	4	112.2482	4.130	4	112.2482	4.130	4	112.2482	4.130	4	112.9824	5.792	5	113.0942	4.709	6
542	562	562	5:SP2_SP3_SP3	N[5]	Si[5]	Si[5]	4:4:3:	4:3:1:1:	4:3:1:1:	Si[5]-4:Si[5]-4:N-3:	C[5]-4:N[5]-3:H-1:H-1:	C[5]-4:N[5]-3:H-1:H-1:	N[5](Si[5]C[5]HH)2(NCC)	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2	N[5](Si[5]C[5]HH)2(NCC){4|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2{4|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2{4|H<1>}	115.9190	0.000	1	115.9190	0.000	1	115.9190	0.000	1	115.9190	0.000	1	112.9824	5.792	5	113.0942	4.709	6
542	562	562	5:SP3_SP3_SP3	N[5]	Si[5]	Si[5]	4:4:3:	4:3:4:4:	4:3:4:4:	Si[5]-4:Si[5]-4:N-3:	C[5]-4:N[5]-3:C-4:C-4:	C[5]-4:N[5]-3:C-4:C-4:	N[5](Si[5]C[5]CC)2(NFeH)	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2	N[5](Si[5]C[5]CC)2(NFeH){4|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2{2|C<4>,2|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(CH3)2{2|C<4>,2|H<1>}	114.2210	0.000	1	114.2210	0.000	1	114.2210	0.000	1	114.2210	0.000	1	114.2210	0.000	1	114.2210	0.000	1
542	562	643	0:SP2_SP2_SP3	N[5,5]	Si[5,5,6]	C[6a]	4:4:3:	3:3:2:2:	3:3:3:	Si[5,5,6]-4:C[5,5,6]-4:C[6a]-3:	N[5,5]-3:N[5,6]-3:S[5,6]-2:N-2:	N[5,5]-3:C[6a]-3:C[6a]-3:	N[5,5](Si[5,5,6]N[5,6]S[5,6]N)(C[5,5,6]C[5,6]S[5,6]H)(C[6a]C[6a]2)	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a])	C[6a](N[5,5]Si[5,5,6]C[5,5,6])(C[6a]C[6a]C)2	N[5,5](Si[5,5,6]N[5,6]S[5,6]N)(C[5,5,6]C[5,6]S[5,6]H)(C[6a]C[6a]2){1|H<1>,2|C<4>,3|C<3>}	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a]){2|H<1>,4|C<3>}	C[6a](N[5,5]Si[5,5,6]C[5,5,6])(C[6a]C[6a]C)2{1|N<2>,1|N<3>,2|C<3>,2|S<2>,3|H<1>}	135.0570	0.000	1	135.0570	0.000	1	135.0570	0.000	1	135.0570	0.000	1	135.0570	0.000	1	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5,6]	Si[5,5,6]	C[6a]	4:3:3:	3:3:2:2:	3:3:3:	Si[5,5,6]-4:C[5,6]-3:C[6a]-3:	N[5,5]-3:N[5,6]-3:S[5,6]-2:N-2:	N[5,6]-3:C[6a]-3:C[6a]-3:	N[5,6](Si[5,5,6]N[5,5]S[5,6]N)(C[5,6]C[5,5,6]H)(C[6a]C[6a]2)	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a])	C[6a](N[5,6]Si[5,5,6]C[5,6])(C[6a]C[6a]C)2	N[5,6](Si[5,5,6]N[5,5]S[5,6]N)(C[5,6]C[5,5,6]H)(C[6a]C[6a]2){1|H<1>,1|S<2>,2|C<4>,3|C<3>}	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a]){2|H<1>,4|C<3>}	C[6a](N[5,6]Si[5,5,6]C[5,6])(C[6a]C[6a]C)2{1|C<3>,1|C<4>,1|N<2>,1|N<3>,1|S<2>,3|H<1>}	127.9070	0.000	1	127.9070	0.000	1	127.9070	0.000	1	127.9070	0.000	1	127.9070	0.000	1	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5,5]	C[6a]	4:3:3:	3:3:3:3:	3:3:3:	Si[5,5]-4:C[5]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5,5]N[5,6]2N[5])(C[5]C[5,6]H)(C[6a]C[6a]2)	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2	C[6a](N[5]Si[5,5]C[5])(C[6a]C[6a]C)2	N[5](Si[5,5]N[5,6]2N[5])(C[5]C[5,6]H)(C[6a]C[6a]2){2|C<4>,8|C<3>}	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2{4|H<1>,8|C<3>}	C[6a](N[5]Si[5,5]C[5])(C[6a]C[6a]C)2{2|C<3>,3|H<1>,3|N<3>}	131.2790	0.048	2	131.2790	0.002	2	131.2790	0.002	2	131.2790	0.002	2	131.2790	0.002	2	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5,6]	C[6a]	4:3:3:	3:3:3:3:	3:3:3:	Si[5,6]-4:N[5]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:N[6]-3:N[6]-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5,6]C[5,6a]N[6]2)(N[5]C[5,6a]H)(C[6a]C[6a]2)	Si[5,6](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(N[6]C[6a]C[6])2	C[6a](N[5]Si[5,6]N[5])(C[6a]C[6a]H)2	N[5](Si[5,6]C[5,6a]N[6]2)(N[5]C[5,6a]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	Si[5,6](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]N[5])(N[6]C[6a]C[6])2{10|C<3>,1|C<4>,2|H<1>}	C[6a](N[5]Si[5,6]N[5])(C[6a]C[6a]H)2{2|N<3>,3|C<3>,3|H<1>}	130.8690	0.000	1	130.8690	0.000	1	130.8690	0.000	1	130.8690	0.000	1	130.8690	0.000	1	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	3:4:3:	3:3:4:4:	3:3:3:	C[5]-3:Si[5]-4:C[6a]-3:	C[5,5]-3:N[5]-3:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2)	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2){1|Si<4>,1|C<4>,6|C<3>}	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2{1|Si<4>,1|N<3>,4|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,4|C<3>}	123.6140	0.000	1	124.0146	1.468	7	124.0146	1.468	7	124.0146	1.468	7	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	3:4:3:	3:3:4:4:	3:3:3:	C[5]-3:Si[5]-4:C[6a]-3:	C[5,5]-3:N[5]-3:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2)	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2){1|Si<4>,2|C<4>,5|C<3>}	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2{1|Si<4>,1|N<3>,4|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{2|C<4>,2|H<1>,4|C<3>}	124.0813	1.313	6	124.0146	1.468	7	124.0146	1.468	7	124.0146	1.468	7	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:2:	3:4:4:4:	3:3:3:	Si[5]-4:C[6a]-3:Ge[5]-2:	N[5]-3:Si[5]-4:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]Si[5]CC)(C[6a]C[6a]2)(Ge[5]N[5])	Si[5](N[5]C[6a]Ge[5])(Si[5]N[5]CC)(CH3)2	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2	N[5](Si[5]Si[5]CC)(C[6a]C[6a]2)(Ge[5]N[5]){3|C<3>,4|C<4>}	Si[5](N[5]C[6a]Ge[5])(Si[5]N[5]CC)(CH3)2{3|C<3>}	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2{1|Si<4>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	123.8730	0.530	2	123.8730	0.281	2	123.8730	0.281	2	123.8730	0.281	2	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:2:2:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:N[5]-3:N-2:S-2:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]N[5]NS)(C[6a]C[6a]2)(C[5]C[5]H)	Si[5](N[5]C[6a]C[5])2(NC[6a])(SS)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](Si[5]N[5]NS)(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,3|C<3>}	Si[5](N[5]C[6a]C[5])2(NC[6a])(SS){2|H<1>,4|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{1|N<2>,1|N<3>,1|S<2>,2|C<3>,3|H<1>}	131.6000	1.969	2	131.6000	3.875	2	131.6000	3.875	2	131.6000	3.875	2	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:2:4:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:Si-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[5]SiN)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(SiSi3)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](Si[5]C[5]SiN)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(SiSi3){1|H<1>,1|N<3>,2|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{1|Si<4>,1|N<2>,1|N<3>,2|H<1>,3|C<3>}	127.1060	0.000	1	127.1060	0.000	1	127.1060	0.000	1	127.1060	0.000	1	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:3:4:	3:3:3:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Br)	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Br){2|C<4>,2|H<1>,8|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH){1|Br<1>,4|H<1>,8|C<3>}	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2{1|Br<1>,1|C<4>,1|P<4>,2|H<1>,3|C<3>}	119.1900	0.000	1	119.1900	0.000	1	120.2682	1.073	4	120.2682	1.073	4	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:3:4:	3:3:3:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Cl)	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Cl){2|C<4>,2|H<1>,8|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH){1|Cl<1>,4|H<1>,8|C<3>}	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2{1|Cl<1>,1|C<4>,1|P<4>,2|H<1>,3|C<3>}	120.6277	0.914	3	120.6277	0.835	3	120.2682	1.073	4	120.2682	1.073	4	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:4:4:4:	3:3:3:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[5]-4:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Br)	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Br){2|C<4>,2|H<1>,4|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2{1|Br<1>,4|C<3>}	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2{1|Br<1>,1|C<3>,1|P<4>,2|H<1>,3|C<4>}	122.5705	0.947	2	122.5705	0.896	2	122.5512	0.547	4	122.5512	0.547	4	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:4:4:4:	3:3:3:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[5]-4:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Cl)	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Cl){2|C<4>,2|H<1>,4|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2{1|Cl<1>,4|C<3>}	C[6a](N[5]Ge[5]Si[5])(C[6a]C[6a]C)2{1|Cl<1>,1|C<3>,1|P<4>,2|H<1>,3|C<4>}	122.5320	0.861	2	122.5320	0.742	2	122.5512	0.547	4	122.5512	0.547	4	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:4:	3:3:3:1:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-4:	N[5]-3:N[5]-3:C[6a]-3:H-1:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[6a]N[5]H)(C[6a]C[6a]2)(C[5]C[5]HH)	Si[5](N[5]C[6a]C[5])2(C[6a]C[6a]2)(H)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](Si[5]C[6a]N[5]H)(C[6a]C[6a]2)(C[5]C[5]HH){2|C<4>,2|H<1>,5|C<3>}	Si[5](N[5]C[6a]C[5])2(C[6a]C[6a]2)(H){6|C<3>,6|H<1>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{1|C<4>,1|N<3>,2|C<3>,5|H<1>}	127.9895	1.091	2	127.9895	1.190	2	127.9895	1.190	2	127.9895	1.190	2	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:4:	4:3:3:4:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-4:	Si[6]-4:N[5]-3:N[5]-3:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]Si[6]N[5]C)(C[6a]C[6a]2)(C[5]C[5]HH)	Si[5](Si[6]N[6]O[6]C)(N[5]C[6a]C[5])2(CH3)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2	N[5](Si[5]Si[6]N[5]C)(C[6a]C[6a]2)(C[5]C[5]HH){1|C<4>,1|N<3>,1|O<2>,3|C<3>,4|H<1>}	Si[5](Si[6]N[6]O[6]C)(N[5]C[6a]C[5])2(CH3){1|C<4>,4|H<1>,6|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2{1|Si<4>,1|C<3>,1|N<3>,2|C<4>,4|H<1>}	127.4055	0.474	2	127.4055	0.225	2	127.4055	0.225	2	127.4055	0.225	2	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP2_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:4:	5:3:3:4:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-4:	Si[5,6]-5:N[5]-3:N[5]-3:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]Si[5,6]N[5]C)(C[6a]C[6a]2)(C[5]C[5]HH)	Si[5](Si[5,6]N[5,6]O[5]O[6]C)(N[5]C[6a]C[5])2(CH3)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2	N[5](Si[5]Si[5,6]N[5]C)(C[6a]C[6a]2)(C[5]C[5]HH){1|C<4>,1|N<3>,2|O<2>,3|C<3>,4|H<1>}	Si[5](Si[5,6]N[5,6]O[5]O[6]C)(N[5]C[6a]C[5])2(CH3){4|H<1>,8|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2{1|Si<5>,1|C<3>,1|N<3>,2|C<4>,4|H<1>}	128.1045	1.296	2	128.1045	1.680	2	128.1045	1.680	2	128.1045	1.680	2	124.7858	11.315	26	125.8330	16.182	31
542	562	643	0:SP3_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:2:3:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:N-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[5]NN)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(NSi2)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](Si[5]C[5]NN)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(NSi2){1|H<1>,1|N<3>,2|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{1|N<2>,2|H<1>,2|N<3>,3|C<3>}	123.6850	0.000	1	123.6850	0.000	1	123.6850	0.000	1	122.8810	1.293	2	123.3513	1.310	3	123.3513	1.310	3
542	562	643	0:SP3_SP2_SP3	N[5]	Si[5]	C[6a]	4:3:3:	3:3:2:3:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:P-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Si[5]C[5]NP)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(PSi2)	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2	N[5](Si[5]C[5]NP)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(PSi2){1|H<1>,1|N<3>,2|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]C)2{1|N<2>,1|N<3>,1|P<3>,2|H<1>,3|C<3>}	122.0770	0.000	1	122.0770	0.000	1	122.0770	0.000	1	122.8810	1.293	2	123.3513	1.310	3	123.3513	1.310	3
542	562	643	0:SP3_SP2_SP3	N[5]	Si[5]	C[6a]	4:4:3:	3:2:4:4:	3:3:3:	C[5]-4:Si[5]-4:C[6a]-3:	N[5]-3:O[5]-2:C-4:C-4:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5]C[6a]C[5]H)(Si[5]O[5]CC)(C[6a]C[6a]2)	Si[5](N[5]C[6a]C[5])(O[5]C[5])(CC3)2	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2	N[5](C[5]C[6a]C[5]H)(Si[5]O[5]CC)(C[6a]C[6a]2){3|H<1>,5|C<3>}	Si[5](N[5]C[6a]C[5])(O[5]C[5])(CC3)2{2|H<1>,4|C<3>}	C[6a](N[5]Si[5]C[5])(C[6a]C[6a]H)2{1|O<2>,2|C<3>,3|C<4>,3|H<1>}	124.2920	0.000	1	124.2920	0.000	1	124.2920	0.000	1	124.2920	0.000	1	123.3513	1.310	3	123.3513	1.310	3
542	562	727	5:SP2_SP2_SP3	N[5,6]	Si[5]	C[5,6,6a]	3:4:4:	3:2:2:4:	3:3:3:	C[5,6,6a]-3:Si[5]-4:C[6]-4:	N[5,6]-3:O[5]-2:O-2:C-4:	C[5,6a]-3:C[6,6a]-3:N[5,6]-3:	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[5]O[5]CO)(C[6]C[6]CH)	Si[5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(OC[6a])(CCHH)	C[5,6,6a](C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])(N[5,6]Si[5]C[6])	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Si[5]O[5]CO)(C[6]C[6]CH){1|H<1>,3|C<3>}	Si[5](N[5,6]C[5,6,6a]C[6])(O[5]C[5,6a])(OC[6a])(CCHH){1|C<4>,1|H<1>,3|C<3>}	C[5,6,6a](C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])(N[5,6]Si[5]C[6]){1|O<2>,2|C<3>,2|C<4>,4|H<1>}	111.0590	0.000	1	111.0590	0.000	1	111.0590	0.000	1	111.0590	0.000	1	111.0590	0.000	1	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[3x5]	C[5,6a]	4:3:4:	4:3:3:3:	3:3:3:	Si[3x5]-4:C[5,6a]-3:C-4:	C[5,5,6]-4:P[5,5,6]-3:N[5]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5](Si[3x5]C[5,5,6]P[5,5,6]N[5])(C[5,6a]C[5,6a]C[6a])(CCHH)	Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5,6a]C)2	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Si[3x5]C)(C[6a]C[6a]H)	N[5](Si[3x5]C[5,5,6]P[5,5,6]N[5])(C[5,6a]C[5,6a]C[6a])(CCHH){1|H<1>,2|C<4>,2|P<2>,4|C<3>}	Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5,6a]C)2{2|C<3>,2|C<4>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Si[3x5]C)(C[6a]C[6a]H){1|C<3>,1|P<3>,2|C<4>,2|H<1>}	109.6340	0.276	2	109.6340	0.076	2	109.6340	0.076	2	109.6340	0.076	2	109.6340	0.076	2	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:3:	3:2:4:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-3:	N[5]-3:O[5]-2:C-4:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]O[5]CC)(CC[5a]O)	Si[5](N[5]C[5,6a]C)(O[5]C[5,6a])(CH3)2	C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]O[5]CC)(CC[5a]O){1|H<1>,2|C<3>}	Si[5](N[5]C[5,6a]C)(O[5]C[5,6a])(CH3)2{2|C<3>}	C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|C<3>,2|C<4>,2|H<1>}	113.4430	0.000	1	113.4430	0.000	1	113.4430	0.000	1	113.4430	0.000	1	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:3:	3:3:3:2:	3:3:3:	C[5,6a]-3:Si[5]-4:C-3:	N[5]-3:C[6a]-3:C[6a]-3:O[5]-2:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]2O[5])(CN[5a]O)	Si[5](N[5]C[5,6a]C)(C[6a]C[6a]2)2(O[5]C[5,6a])	C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]2O[5])(CN[5a]O){1|H<1>,6|C<3>}	Si[5](N[5]C[5,6a]C)(C[6a]C[6a]2)2(O[5]C[5,6a]){4|H<1>,6|C<3>}	C[5,6a](C[5,6a]C[6a]O[5])(C[6a]C[6a]H)(N[5]Si[5]C){2|H<1>,3|C<3>}	113.0900	0.000	1	113.0900	0.000	1	113.0900	0.000	1	113.0900	0.000	1	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	3:2:2:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	N[5]-3:S[5]-2:S-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]S[5]CS)(CC[6a]HH)	Si[5](N[5]C[5,6a]C)(S[5]C[5,6a])(SC[6a])(CH3)	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]S[5]CS)(CC[6a]HH){1|H<1>,2|C<3>}	Si[5](N[5]C[5,6a]C)(S[5]C[5,6a])(SC[6a])(CH3){2|C<3>}	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	121.6590	0.000	1	121.6590	0.000	1	121.6590	0.000	1	121.4675	0.073	2	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	3:2:2:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	N[5]-3:S[5]-2:Se-2:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]S[5]SeC)(CC[6a]HH)	Si[5](N[5]C[5,6a]C)(S[5]C[5,6a])(SeC[6a])(CH3)	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]S[5]SeC)(CC[6a]HH){1|H<1>,2|C<3>}	Si[5](N[5]C[5,6a]C)(S[5]C[5,6a])(SeC[6a])(CH3){2|C<3>}	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Se<2>,1|C<3>,1|C<4>,2|H<1>}	121.2760	0.000	1	121.2760	0.000	1	121.2760	0.000	1	121.4675	0.073	2	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	N[5]-3:N[5]-3:C[6a]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]N[5]H)(CHHP)	Si[5](N[5]C[5,6a]C)2(C[6a]C[6a]2)(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]N[5]H)(CHHP){1|C<4>,1|H<1>,4|C<3>}	Si[5](N[5]C[5,6a]C)2(C[6a]C[6a]2)(H){2|H<1>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|C<4>,2|C<3>,3|H<1>}	111.4660	0.206	2	111.4660	0.043	2	111.4660	0.043	2	111.4660	0.043	2	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	3:3:4:1:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	N[5]-3:N[5]-3:Si[5]-4:Br-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]Br)(CCHH)	Si[5](N[5]C[5,6a]C)2(Si[5]N[5]2C)(Br)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]Br)(CCHH){1|H<1>,2|C<3>,2|C<4>,2|N<3>}	Si[5](N[5]C[5,6a]C)2(Si[5]N[5]2C)(Br){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Br<1>,1|Si<4>,1|C<3>,1|C<4>,2|H<1>}	110.4445	0.397	4	110.4445	0.157	4	110.4445	0.157	4	110.2108	0.229	6	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	3:3:4:1:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	N[5]-3:N[5]-3:Si[5]-4:Cl-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]Cl)(CCHH)	Si[5](N[5]C[5,6a]C)2(Si[5]N[5]2C)(Cl)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]Cl)(CCHH){1|H<1>,2|C<3>,2|C<4>,2|N<3>}	Si[5](N[5]C[5,6a]C)2(Si[5]N[5]2C)(Cl){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Cl<1>,1|Si<4>,1|C<3>,1|C<4>,2|H<1>}	109.7435	0.132	2	109.7435	0.017	2	109.7435	0.017	2	110.2108	0.229	6	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	4:3:3:1:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	Si[6]-4:N[5]-3:N[5]-3:Cl-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[6]N[5]Cl)(CCHH)	Si[5](Si[6]C[6]N[6]Cl)(N[5]C[5,6a]C)2(Cl)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[6]N[5]Cl)(CCHH){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](Si[6]C[6]N[6]Cl)(N[5]C[5,6a]C)2(Cl){1|N<3>,3|C<3>,3|C<4>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Cl<1>,1|Si<4>,1|C<3>,1|C<4>,2|H<1>}	109.4670	0.257	2	109.4670	0.066	2	109.4670	0.066	2	109.4670	0.066	2	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	4:3:3:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	Si[5]-4:N[5]-3:N[5]-3:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH)	Si[5](Si[5]N[5]2Br)(N[5]C[5,6a]C)2(CSi[5]HH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH){1|Br<1>,1|C<4>,1|H<1>,2|C<3>,2|N<3>}	Si[5](Si[5]N[5]2Br)(N[5]C[5,6a]C)2(CSi[5]HH){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	110.0503	0.183	3	110.0503	0.033	3	109.7900	0.164	5	109.7900	0.164	5	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP2_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	4:3:3:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	Si[5]-4:N[5]-3:N[5]-3:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH)	Si[5](Si[5]N[5]2Cl)(N[5]C[5,6a]C)2(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH){1|Cl<1>,1|C<4>,1|H<1>,2|C<3>,2|N<3>}	Si[5](Si[5]N[5]2Cl)(N[5]C[5,6a]C)2(CCHH){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	109.3995	0.285	2	109.3995	0.081	2	109.7900	0.164	5	109.7900	0.164	5	111.6605	13.298	19	111.4489	11.763	22
542	562	727	5:SP3_SP2_SP3	N[5]	Si[5]	C[5,6a]	3:4:4:	4:3:3:4:	3:3:3:	C[5,6a]-3:Si[5]-4:C-4:	Si[5]-4:N[5]-3:N[5]-3:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH)	Si[5](Si[5]N[5]2Br)(N[5]C[5,6a]C)2(CSi[5]HH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]Si[5]N[5]C)(CCHH){1|Br<1>,1|C<4>,1|H<1>,2|C<3>,2|N<3>}	Si[5](Si[5]N[5]2Br)(N[5]C[5,6a]C)2(CSi[5]HH){2|C<4>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Si[5]C){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	109.7760	0.000	1	109.7760	0.000	1	109.7760	0.000	1	109.7760	0.000	1	109.7760	0.000	1	109.7760	0.000	1
542	562	762	0:SP2_SP2_SP3	N[5,6]	Si[5,5]	C[6]	4:3:3:	3:3:3:3:	3:3:1:	Si[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2{4|H<1>,8|C<3>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	128.5735	0.053	2	128.5735	0.003	2	128.5735	0.003	2	128.5735	0.003	2	128.5735	0.003	2	129.2960	0.782	7
542	562	762	0:SP2_SP2_SP3	N[5,6]	Si[5,6]	C[6]	4:3:3:	3:3:3:2:	3:3:1:	Si[5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[6]-3:N[6]-3:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	Si[5,6](N[5,6]C[5,6]C[6])(N[6]C[6a]C[6])2(O[5]C[5])	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,6|C<3>}	Si[5,6](N[5,6]C[5,6]C[6])(N[6]C[6a]C[6])2(O[5]C[5]){1|C<4>,1|H<1>,9|C<3>}	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	129.6700	0.000	1	129.6700	0.000	1	129.6700	0.000	1	129.6700	0.000	1	129.6700	0.000	1	129.2960	0.782	7
542	562	762	0:SP2_SP2_SP3	N[5,6]	Si[5]	C[6]	3:4:3:	3:3:4:4:	3:3:1:	C[5,6]-3:Si[5]-4:C[6]-3:	N[5,6]-3:N[5,5]-3:C-4:C-4:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H)	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H)	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2{2|C<3>,2|H<1>,3|C<4>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|C<4>}	128.0420	0.000	1	128.0420	0.000	1	128.0420	0.000	1	128.0420	0.000	1	129.5637	1.073	4	129.2960	0.782	7
542	562	762	0:SP2_SP2_SP3	N[5,6]	Si[5]	C[6]	4:3:3:	3:3:3:3:	3:3:1:	Si[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2{2|H<1>,6|C<3>,7|C<4>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	130.0710	0.255	3	130.0710	0.065	3	130.0710	0.065	3	130.0710	0.065	3	129.5637	1.073	4	129.2960	0.782	7
542	562	818	5:SP2_SP2_SP3	N[5,5]	Si[5]	C[5,5]	4:4:3:	3:3:3:3:	3:3:4:	C[5,5]-4:Si[5]-4:C[5,5]-3:	N[5,6]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	N[5,5]-3:C[5,6]-3:C[5]-4:	N[5,5](C[5,5]C[5,5]C[5]H)(Si[5]N[5,6]C[6a]2)(C[5,5]C[5,6]C[5])	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2	C[5,5](N[5,5]C[5,5]Si[5])(C[5,6]N[5,6]C[6])(C[5]C[5,5]HH)	N[5,5](C[5,5]C[5,5]C[5]H)(Si[5]N[5,6]C[6a]2)(C[5,5]C[5,6]C[5]){2|C<4>,5|H<1>,6|C<3>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2{2|H<1>,6|C<3>,7|C<4>}	C[5,5](N[5,5]C[5,5]Si[5])(C[5,6]N[5,6]C[6])(C[5]C[5,5]HH){2|C<4>,3|H<1>,4|C<3>}	111.6887	0.660	3	111.6887	0.436	3	111.6887	0.436	3	111.6887	0.436	3	111.6887	0.436	3	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5,6]	Si[5,5,6]	C[5,6]	4:3:3:	3:3:2:2:	4:3:1:	Si[5,5,6]-4:C[5,6]-3:C[6a]-3:	N[5,5]-3:N[5,6]-3:S[5,6]-2:N-2:	C[5,5,6]-4:N[5,6]-3:H-1:	N[5,6](Si[5,5,6]N[5,5]S[5,6]N)(C[5,6]C[5,5,6]H)(C[6a]C[6a]2)	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a])	C[5,6](C[5,5,6]N[5,5]S[5,6]H)(N[5,6]Si[5,5,6]C[6a])(H)	N[5,6](Si[5,5,6]N[5,5]S[5,6]N)(C[5,6]C[5,5,6]H)(C[6a]C[6a]2){1|H<1>,1|S<2>,2|C<4>,3|C<3>}	Si[5,5,6](N[5,5]C[5,5,6]C[6a])(N[5,6]C[5,6]C[6a])(S[5,6]S[5,6])(NC[6a]){2|H<1>,4|C<3>}	C[5,6](C[5,5,6]N[5,5]S[5,6]H)(N[5,6]Si[5,5,6]C[6a])(H){1|N<2>,1|S<2>,3|C<3>}	107.9740	0.000	1	107.9740	0.000	1	107.9740	0.000	1	107.9740	0.000	1	107.9740	0.000	1	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5,6]	Si[5,5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	Si[5,5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H)	N[5,6](Si[5,5]N[5,6]N[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|H<1>,6|C<3>}	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2{4|H<1>,8|C<3>}	C[5,6](N[5,6]Si[5,5]C[6])(C[5]N[5]H)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	111.9880	0.034	2	111.9880	0.001	2	111.9880	0.001	2	111.9880	0.001	2	111.9880	0.001	2	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5,6]	Si[5,6]	C[5,6]	4:3:3:	3:3:3:2:	3:3:3:	Si[5,6]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[6]-3:N[6]-3:O[5]-2:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H)	Si[5,6](N[5,6]C[5,6]C[6])(N[6]C[6a]C[6])2(O[5]C[5])	C[5,6](N[5,6]Si[5,6]C[6])(C[5]C[6a]O[5])(C[6]C[6]H)	N[5,6](Si[5,6]N[6]2O[5])(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,6|C<3>}	Si[5,6](N[5,6]C[5,6]C[6])(N[6]C[6a]C[6])2(O[5]C[5]){1|C<4>,1|H<1>,9|C<3>}	C[5,6](N[5,6]Si[5,6]C[6])(C[5]C[6a]O[5])(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	109.4710	0.000	1	109.4710	0.000	1	109.4710	0.000	1	109.4710	0.000	1	109.4710	0.000	1	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5,6]	Si[5]	C[5,6]	3:4:3:	3:3:4:4:	3:3:3:	C[5,6]-3:Si[5]-4:C[6]-3:	N[5,6]-3:N[5,5]-3:C-4:C-4:	C[4,6]-3:C[5,5]-3:N[5,6]-3:	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H)	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2	C[5,6](C[4,6]C[4,6]Si[4])(C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])	N[5,6](C[5,6]C[4,6]C[5,5])(Si[5]N[5,5]CC)(C[6]C[6]H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2{2|C<3>,2|H<1>,3|C<4>}	C[5,6](C[4,6]C[4,6]Si[4])(C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6]){1|Si<4>,1|C<3>,3|H<1>,6|C<4>}	110.1750	0.000	1	110.1750	0.000	1	110.1750	0.000	1	110.1750	0.000	1	111.0250	1.192	4	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5,6]	Si[5]	C[5,6]	4:3:3:	3:3:3:3:	3:3:3:	Si[5]-4:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,5]-3:C[6a]-3:C[6a]-3:	C[5,5]-3:N[5,6]-3:C[6]-3:	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H)	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2	C[5,6](C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])(C[6]C[6]H)	N[5,6](Si[5]N[5,5]C[6a]2)(C[5,6]C[5,5]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(C[6a]C[6a]2)2{2|H<1>,6|C<3>,7|C<4>}	C[5,6](C[5,5]N[5,5]C[5])(N[5,6]Si[5]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	111.3083	1.143	3	111.3083	1.306	3	111.3083	1.306	3	111.3083	1.306	3	111.0250	1.192	4	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[3x5]	C[5]	4:3:4:	4:3:3:3:	3:3:1:	Si[3x5]-4:C[5]-3:C-4:	C[5,5,6]-4:P[5,5,6]-3:N[5]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](Si[3x5]C[5,5,6]P[5,5,6]N[5])(C[5]C[5]H)(CC3)	Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5]C)2	C[5](N[5]Si[3x5]C)(C[5]N[5]H)(H)	N[5](Si[3x5]C[5,5,6]P[5,5,6]N[5])(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,2|C<4>,2|P<2>}	Si[3x5](C[5,5,6]P[5,6]2C)(P[5,5,6]C[5,6]2)(N[5]C[5]C)2{2|C<4>,2|H<1>}	C[5](N[5]Si[3x5]C)(C[5]N[5]H)(H){1|P<3>,2|C<4>}	105.5940	0.068	2	105.5940	0.005	2	105.5940	0.005	2	105.5940	0.005	2	105.5940	0.005	2	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5,5]	C[5]	4:3:3:	3:3:3:3:	3:3:1:	Si[5,5]-4:C[5]-3:C[6a]-3:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	C[5,6]-3:N[5]-3:H-1:	N[5](Si[5,5]N[5,6]2N[5])(C[5]C[5,6]H)(C[6a]C[6a]2)	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2	C[5](C[5,6]N[5,6]C[6])(N[5]Si[5,5]C[6a])(H)	N[5](Si[5,5]N[5,6]2N[5])(C[5]C[5,6]H)(C[6a]C[6a]2){2|C<4>,8|C<3>}	Si[5,5](N[5,6]C[5,6]C[6])2(N[5]C[6a]C[5])2{4|H<1>,8|C<3>}	C[5](C[5,6]N[5,6]C[6])(N[5]Si[5,5]C[6a])(H){1|H<1>,2|N<3>,4|C<3>}	111.6695	0.247	2	111.6695	0.061	2	111.6695	0.061	2	111.6695	0.061	2	111.7862	8.523	5	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5,5]	C[5]	4:3:4:	3:3:3:3:	3:3:1:	Si[5,5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:C[5]-3:H-1:	N[5](Si[5,5]N[5]3)(C[5]C[5]H)(CC3)	Si[5,5](N[5]B[5a]N[5])2(N[5]C[5]C)2	C[5](N[5]Si[5,5]C)(C[5]N[5]H)(H)	N[5](Si[5,5]N[5]3)(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|B<3>,2|N<2>}	Si[5,5](N[5]B[5a]N[5])2(N[5]C[5]C)2{2|H<1>,4|N<3>}	C[5](N[5]Si[5,5]C)(C[5]N[5]H)(H){1|C<4>,2|N<3>}	109.4870	0.293	2	109.4870	0.086	2	109.4870	0.086	2	109.4870	0.086	2	111.7862	8.523	5	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5,5]	C[5]	4:3:4:	5:3:3:2:	5:3:2:	Si[5,5]-4:C[5]-3:C-4:	C[3x3,4x5,12x6]-5:C[5,6a]-3:N[5]-3:O[5]-2:	C[3x3,4x5,12x6]-5:N[5]-3:N-2:	N[5](Si[5,5]C[3x3,4x5,12x6]C[5,6a]O[5])(C[5]C[3x3,4x5,12x6]N)(CCCH)	Si[5,5](C[3x3,4x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6])(C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(O[5]C[5])	C[5](C[3x3,4x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6])(N[5]Si[5,5]C)(NC)	N[5](Si[5,5]C[3x3,4x5,12x6]C[5,6a]O[5])(C[5]C[3x3,4x5,12x6]N)(CCCH){1|B<5>,1|C<4>,2|C<3>,4|B<6>}	Si[5,5](C[3x3,4x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6])(C[5,6a]C[5,6a]C[6a])(N[5]C[5]C)(O[5]C[5]){1|N<2>,3|C<3>,5|B<6>,5|H<1>}	C[5](C[3x3,4x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,4x5,12x6])(N[5]Si[5,5]C)(NC){1|B<4>,1|B<5>,1|C<3>,1|O<2>,3|H<1>,4|B<6>}	116.6180	0.000	1	116.6180	0.000	1	116.6180	0.000	1	116.6180	0.000	1	111.7862	8.523	5	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5,6]	C[5]	4:3:3:	4:3:3:3:	3:3:3:	Si[5,6]-4:C[5]-3:N-3:	C[5,6]-4:N[6]-3:N[6]-3:N[5]-3:	C[5,6]-3:N[5]-3:C[6a]-3:	N[5](Si[5,6]C[5,6]N[6]2)(C[5]C[5,6]C[6a])(NHH)	Si[5,6](C[5,6]C[5,6]C[6]H)(N[6]C[6a]C[6])2(N[5]C[5]N)	C[5](C[5,6]C[5,6]C[6])(N[5]Si[5,6]N)(C[6a]C[6a]2)	N[5](Si[5,6]C[5,6]N[6]2)(C[5]C[5,6]C[6a])(NHH){1|H<1>,8|C<3>}	Si[5,6](C[5,6]C[5,6]C[6]H)(N[6]C[6a]C[6])2(N[5]C[5]N){1|C<4>,1|H<1>,9|C<3>}	C[5](C[5,6]C[5,6]C[6])(N[5]Si[5,6]N)(C[6a]C[6a]2){2|N<3>,4|C<3>,4|H<1>}	112.4520	0.000	1	112.4520	0.000	1	112.4520	0.000	1	112.4520	0.000	1	112.4520	0.000	1	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	3:4:3:	3:3:4:4:	3:3:3:	C[5]-3:Si[5]-4:C[6a]-3:	C[5,5]-3:N[5]-3:C-4:C-4:	C[5,5]-3:N[5]-3:C[6a]-3:	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2)	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2	C[5](C[5,5]C[5,5]Si[5])(N[5]C[6a]Si[5])(C[6a]C[6a]2)	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2){1|Si<4>,1|C<4>,6|C<3>}	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2{1|Si<4>,1|N<3>,4|C<3>}	C[5](C[5,5]C[5,5]Si[5])(N[5]C[6a]Si[5])(C[6a]C[6a]2){1|N<3>,2|H<1>,4|C<4>,5|C<3>}	111.3100	0.000	1	111.2610	0.736	7	111.2610	0.736	7	111.2610	0.736	7	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	3:4:3:	3:3:4:4:	3:3:3:	C[5]-3:Si[5]-4:C[6a]-3:	C[5,5]-3:N[5]-3:C-4:C-4:	C[5,5]-3:N[5]-3:C[6a]-3:	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2)	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2	C[5](C[5,5]C[5,5]Si[5])(N[5]C[6a]Si[5])(C[6a]C[6a]2)	N[5](C[5]C[5,5]C[6a])(Si[5]C[5,5]CC)(C[6a]C[6a]2){1|Si<4>,2|C<4>,5|C<3>}	Si[5](C[5,5]C[5,5]C[5])(N[5]C[6a]C[5])(CH3)2{1|Si<4>,1|N<3>,4|C<3>}	C[5](C[5,5]C[5,5]Si[5])(N[5]C[6a]Si[5])(C[6a]C[6a]2){1|N<3>,2|H<1>,4|C<4>,5|C<3>}	111.2528	0.940	6	111.2610	0.736	7	111.2610	0.736	7	111.2610	0.736	7	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	3:4:4:	3:2:3:2:	3:3:3:	C[5]-3:Si[5]-4:C-4:	N[5]-3:O[5]-2:N-3:N-2:	C[5]-3:C[6a]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(Si[5]O[5]NN)(CC3)	Si[5](N[5]C[5]C)(O[5]C[5])(NSiC)(NSi)	C[5](C[5]C[6a]O[5])(C[6a]C[6a]2)(N[5]Si[5]C)	N[5](C[5]C[6a]C[5])(Si[5]O[5]NN)(CC3){3|C<3>}	Si[5](N[5]C[5]C)(O[5]C[5])(NSiC)(NSi){2|C<3>}	C[5](C[5]C[6a]O[5])(C[6a]C[6a]2)(N[5]Si[5]C){1|N<2>,1|N<3>,2|H<1>,4|C<3>}	107.9730	0.000	1	107.9730	0.000	1	107.9730	0.000	1	107.9730	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	3:4:4:	3:2:3:3:	3:3:3:	C[5]-3:Si[5]-4:C-4:	N[5]-3:O[5]-2:N-3:N-3:	C[5]-3:C[6a]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(Si[5]O[5]NN)(CC3)	Si[5](N[5]C[5]C)(O[5]C[5])(NSiC)(NSiH)	C[5](C[5]C[6a]O[5])(C[6a]C[6a]2)(N[5]Si[5]C)	N[5](C[5]C[6a]C[5])(Si[5]O[5]NN)(CC3){3|C<3>}	Si[5](N[5]C[5]C)(O[5]C[5])(NSiC)(NSiH){2|C<3>}	C[5](C[5]C[6a]O[5])(C[6a]C[6a]2)(N[5]Si[5]C){2|H<1>,2|N<3>,4|C<3>}	108.1090	0.000	1	108.1090	0.000	1	108.1090	0.000	1	108.1090	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:1:	4:3:4:4:	3:3:4:	Si[5]-4:C[5]-3:H-1:	C[5,5]-4:N[5]-3:C-4:C-4:	C[5,5]-3:N[5]-3:C-4:	N[5](Si[5]C[5,5]CC)(C[5]C[5,5]C)(H)	Si[5](C[5,5]C[5,5]C[6a]C[5])(N[5]C[5]H)(CH3)2	C[5](C[5,5]C[5,5]C[5])(N[5]Si[5]H)(CC3)	N[5](Si[5]C[5,5]CC)(C[5]C[5,5]C)(H){1|C<4>,2|C<3>}	Si[5](C[5,5]C[5,5]C[6a]C[5])(N[5]C[5]H)(CH3)2{1|N<3>,2|C<4>,3|C<3>}	C[5](C[5,5]C[5,5]C[5])(N[5]Si[5]H)(CC3){1|Zr<14>,1|N<3>,2|C<4>,3|C<3>}	110.1800	0.000	1	110.1800	0.000	1	110.1800	0.000	1	110.1800	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:3:	3:3:2:2:	3:3:1:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:N[5]-3:N-2:S-2:	N[5]-3:C[5]-3:H-1:	N[5](Si[5]N[5]NS)(C[6a]C[6a]2)(C[5]C[5]H)	Si[5](N[5]C[6a]C[5])2(NC[6a])(SS)	C[5](N[5]C[6a]Si[5])(C[5]N[5]H)(H)	N[5](Si[5]N[5]NS)(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,3|C<3>}	Si[5](N[5]C[6a]C[5])2(NC[6a])(SS){2|H<1>,4|C<3>}	C[5](N[5]C[6a]Si[5])(C[5]N[5]H)(H){1|N<2>,1|S<2>,3|C<3>}	107.0010	0.946	2	107.0010	0.895	2	107.0010	0.895	2	107.0010	0.895	2	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:3:	3:3:2:4:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:Si-4:	N[5]-3:C[5]-3:N-3:	N[5](Si[5]C[5]SiN)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(SiSi3)	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC)	N[5](Si[5]C[5]SiN)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(SiSi3){1|H<1>,1|N<3>,2|C<3>}	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC){1|Si<4>,1|N<2>,1|N<3>,2|C<3>}	111.1590	0.000	1	111.1590	0.000	1	111.1590	0.000	1	111.1590	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	3:2:4:4:	4:3:1:	Si[5]-4:C[5]-3:C-4:	N[5]-3:O[5]-2:C-4:C-4:	P[5]-4:N[5]-3:O-1:	N[5](Si[5]O[5]CC)(C[5]P[5]O)(CC3)	Si[5](N[5]C[5]C)(O[5]P[5])(CH3)2	C[5](P[5]O[5]CW)(N[5]Si[5]C)(O)	N[5](Si[5]O[5]CC)(C[5]P[5]O)(CC3){1|C<4>,1|W<6>}	Si[5](N[5]C[5]C)(O[5]P[5])(CH3)2{1|C<4>,1|O<1>,1|W<6>}	C[5](P[5]O[5]CW)(N[5]Si[5]C)(O){2|C<4>}	114.2150	0.000	1	114.2150	0.000	1	114.2150	0.000	1	114.2150	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	3:3:3:2:	3:3:1:	Si[5]-4:C[5]-3:C-4:	C[5]-3:N[5]-3:N[5]-3:As-2:	N[5]-3:C[5]-3:H-1:	N[5](Si[5]C[5]N[5]As)(C[5]C[5]H)(CC3)	Si[5](C[5]N[5]2)(N[5]C[5]C)2(AsZn)	C[5](N[5]Si[5]C)(C[5]N[5]H)(H)	N[5](Si[5]C[5]N[5]As)(C[5]C[5]H)(CC3){1|C<4>,1|H<1>,2|N<3>}	Si[5](C[5]N[5]2)(N[5]C[5]C)2(AsZn){2|C<3>,2|C<4>,2|H<1>}	C[5](N[5]Si[5]C)(C[5]N[5]H)(H){1|As<2>,1|C<3>,1|C<4>}	108.5920	0.048	2	108.5920	0.002	2	108.5920	0.002	2	108.4857	0.025	4	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	3:3:3:2:	3:3:1:	Si[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:N-3:O-2:	N[5]-3:C[5]-3:H-1:	N[5](Si[5]N[5]NO)(C[5]C[5]H)(CC3)	Si[5](N[5]C[5]C)2(NB[5a]H)(OH)	C[5](N[5]Si[5]C)(C[5]N[5]H)(H)	N[5](Si[5]N[5]NO)(C[5]C[5]H)(CC3){1|C<4>,1|H<1>}	Si[5](N[5]C[5]C)2(NB[5a]H)(OH){2|H<1>}	C[5](N[5]Si[5]C)(C[5]N[5]H)(H){1|C<4>,1|N<3>,1|O<2>}	108.3795	0.166	2	108.3795	0.028	2	108.3795	0.028	2	108.4857	0.025	4	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	4:3:3:1:	3:3:1:	Si[5]-4:C[5]-3:C-4:	C[6]-4:N[5]-3:N[5]-3:I-1:	N[5]-3:C[5]-3:H-1:	N[5](Si[5]C[6]N[5]I)(C[5]C[5]H)(CC3)	Si[5](C[6]C[6]N[6]H)(N[5]C[5]C)2(I)	C[5](N[5]Si[5]C)(C[5]N[5]H)(H)	N[5](Si[5]C[6]N[5]I)(C[5]C[5]H)(CC3){1|N<3>,2|C<4>,2|H<1>}	Si[5](C[6]C[6]N[6]H)(N[5]C[5]C)2(I){3|C<4>,4|H<1>}	C[5](N[5]Si[5]C)(C[5]N[5]H)(H){1|I<1>,2|C<4>}	107.9080	0.294	2	107.9080	0.087	2	107.9080	0.087	2	107.9080	0.087	2	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	6:3:3:3:	6:3:2:	Si[5]-4:C[5]-3:C[6]-4:	C[5x3,6x5,20x6]-6:N[5]-3:C[6a]-3:C[6a]-3:	C[5x3,6x5,20x6]-6:N[5]-3:N-2:	N[5](Si[5]C[5x3,6x5,20x6]C[6a]2)(C[5]C[5x3,6x5,20x6]N)(C[6]C[6]2H)	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[5]C[6])(C[6a]C[6a]2)2	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C[6])(NC[6])	N[5](Si[5]C[5x3,6x5,20x6]C[6a]2)(C[5]C[5x3,6x5,20x6]N)(C[6]C[6]2H){2|C<4>,4|C<3>,4|H<1>,6|B<6>}	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[5]C[6])(C[6a]C[6a]2)2{1|N<2>,2|C<4>,4|C<3>,5|B<6>,9|H<1>}	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C[6])(NC[6]){2|C<3>,2|C<4>,5|B<6>,5|H<1>}	119.0820	0.000	1	119.0820	0.000	1	119.0820	0.000	1	119.0820	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	6:3:3:4:	6:3:2:	Si[5]-4:C[5]-3:C-4:	C[5x3,6x5,20x6]-6:C[5]-3:N[5]-3:B-4:	C[5x3,6x5,20x6]-6:N[5]-3:N-2:	N[5](Si[5]C[5x3,6x5,20x6]C[5]B)(C[5]C[5x3,6x5,20x6]N)(CCCH)	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]N[5]2)(N[5]C[5]C)(BH3)	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C)(NC)	N[5](Si[5]C[5x3,6x5,20x6]C[5]B)(C[5]C[5x3,6x5,20x6]N)(CCCH){2|N<3>,6|B<6>}	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(C[5]N[5]2)(N[5]C[5]C)(BH3){1|N<2>,2|C<3>,2|C<4>,4|H<1>,5|B<6>}	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C)(NC){1|B<4>,1|C<3>,4|H<1>,5|B<6>}	120.2180	0.000	1	120.2180	0.000	1	120.2180	0.000	1	120.2180	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP2_SP2_SP3	N[5]	Si[5]	C[5]	4:3:4:	6:3:4:1:	6:3:2:	Si[5]-4:C[5]-3:C-4:	C[5x3,6x5,20x6]-6:N[5]-3:Si-4:H-1:	C[5x3,6x5,20x6]-6:N[5]-3:N-2:	N[5](Si[5]C[5x3,6x5,20x6]SiH)(C[5]C[5x3,6x5,20x6]N)(CCCH)	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[5]C)(SiSi3)(H)	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C)(NC)	N[5](Si[5]C[5x3,6x5,20x6]SiH)(C[5]C[5x3,6x5,20x6]N)(CCCH){6|B<6>}	Si[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]C[5]C)(SiSi3)(H){1|N<2>,4|H<1>,5|B<6>}	C[5](C[5x3,6x5,20x6]B[5x3,5x5,20x6]4C[5x3,6x5,20x6])(N[5]Si[5]C)(NC){1|Si<4>,5|B<6>,5|H<1>}	121.2590	0.000	1	121.2590	0.000	1	121.2590	0.000	1	121.2590	0.000	1	111.0775	16.650	23	110.9034	11.783	42
542	562	818	5:SP3_SP2_SP3	N[5,5]	Si[5]	C[5,5]	4:3:4:	3:3:4:4:	3:3:4:	C[5,5]-4:C[5,5]-3:Si[5]-4:	N[5,6]-3:N[5,5]-3:C-4:C-4:	C[5,6]-3:N[5,5]-3:C[5]-4:	N[5,5](C[5,5]C[5,5]C[5]H)(C[5,5]C[5,6]C[5])(Si[5]N[5,6]CC)	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2	C[5,5](C[5,6]C[4,6]N[5,6])(N[5,5]C[5,5]Si[5])(C[5]C[5,5]HH)	N[5,5](C[5,5]C[5,5]C[5]H)(C[5,5]C[5,6]C[5])(Si[5]N[5,6]CC){2|C<3>,2|C<4>,5|H<1>}	Si[5](N[5,6]C[5,6]C[6])(N[5,5]C[5,5]2)(CC3)2{2|C<3>,2|H<1>,3|C<4>}	C[5,5](C[5,6]C[4,6]N[5,6])(N[5,5]C[5,5]Si[5])(C[5]C[5,5]HH){1|Si<4>,2|C<3>,2|H<1>,4|C<4>}	108.8560	0.000	1	108.8560	0.000	1	108.8560	0.000	1	108.8560	0.000	1	108.8560	0.000	1	110.4287	1.974	3
542	562	818	5:SP3_SP2_SP3	N[5]	Si[5]	C[5]	4:3:3:	3:3:2:3:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:N-3:	N[5]-3:C[5]-3:N-3:	N[5](Si[5]C[5]NN)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(NSi2)	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC)	N[5](Si[5]C[5]NN)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(NSi2){1|H<1>,1|N<3>,2|C<3>}	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC){1|N<2>,2|C<3>,2|N<3>}	110.8700	0.000	1	110.8700	0.000	1	110.8700	0.000	1	111.2150	0.238	2	111.2150	0.238	2	110.4287	1.974	3
542	562	818	5:SP3_SP2_SP3	N[5]	Si[5]	C[5]	4:3:3:	3:3:2:3:	3:3:3:	Si[5]-4:C[6a]-3:C[5]-3:	N[5]-3:C[5]-3:N-2:P-3:	N[5]-3:C[5]-3:N-3:	N[5](Si[5]C[5]NP)(C[6a]C[6a]2)(C[5]C[5]N)	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(PSi2)	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC)	N[5](Si[5]C[5]NP)(C[6a]C[6a]2)(C[5]C[5]N){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	Si[5](N[5]C[6a]C[5])(C[5]C[5]N)(NC[6a])(PSi2){1|H<1>,1|N<3>,2|C<3>}	C[5](N[5]C[6a]Si[5])(C[5]C[5]H)(NCC){1|N<2>,1|N<3>,1|P<3>,2|C<3>}	111.5600	0.000	1	111.5600	0.000	1	111.5600	0.000	1	111.2150	0.238	2	111.2150	0.238	2	110.4287	1.974	3
542	562	880	0:SP2_SP3_SP3	N[5]	Si[5]	Si	4:4:4:	3:3:4:4:	3:4:4:4:	Si[4,5]-4:Si[5]-4:Si-4:	N[5]-3:P[5]-3:C-4:C-4:	N[5]-3:C-4:C-4:C-4:	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3)	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2	Si(N[5]Si[4,5]Si[5])(CH3)3	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3){1|C<3>,4|C<4>}	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>}	Si(N[5]Si[4,5]Si[5])(CH3)3	120.5250	0.000	1	120.5250	0.000	1	120.5250	0.000	1	120.5250	0.000	1	121.1725	0.839	2	121.1725	0.839	2
542	562	880	0:SP2_SP3_SP3	N[5]	Si[5]	Si	4:4:4:	3:4:4:4:	3:4:4:4:	Si[5]-4:Si[5]-4:Si-4:	N[5]-3:C[5]-4:C-4:C-4:	N[5]-3:C-4:C-4:C-4:	N[5](Si[5]P[5]CoH)(Si[5]C[5]CC)(SiC3)	Si[5](N[5]Si[5]Si)(C[5]P[5]HH)(CH3)2	Si(N[5]Si[5]2)(CHHP)(CH3)2	N[5](Si[5]P[5]CoH)(Si[5]C[5]CC)(SiC3){2|C<4>,2|H<1>}	Si[5](N[5]Si[5]Si)(C[5]P[5]HH)(CH3)2{1|Co<7>,1|H<1>,2|C<4>}	Si(N[5]Si[5]2)(CHHP)(CH3)2	121.8200	0.000	1	121.8200	0.000	1	121.8200	0.000	1	121.8200	0.000	1	121.1725	0.839	2	121.1725	0.839	2
542	562	880	0:SP3_SP3_SP3	N[5]	Si[5]	Si	4:4:4:	3:3:1:1:	3:4:4:4:	Si[5]-4:C[5]-4:Si-4:	N[5]-3:N[5]-3:Cl-1:Cl-1:	N[5]-3:C-4:C-4:C-4:	N[5](Si[5]N[5]Cl2)(C[5]C[5]HH)(SiC3)	Si[5](N[5]C[5]Si)2(Cl)2	Si(N[5]Si[5]C[5])(CH3)3	N[5](Si[5]N[5]Cl2)(C[5]C[5]HH)(SiC3){1|Si<4>,2|H<1>}	Si[5](N[5]C[5]Si)2(Cl)2{4|H<1>}	Si(N[5]Si[5]C[5])(CH3)3	133.7280	0.000	1	133.7280	0.000	1	133.7280	0.000	1	133.7280	0.000	1	127.3015	82.600	2	127.3015	82.600	2
542	562	880	0:SP3_SP3_SP3	N[5]	Si[5]	Si	4:4:4:	3:3:4:4:	3:4:4:4:	Si[4,5]-4:Si[5]-4:Si-4:	N[5]-3:P[5]-3:C-4:C-4:	N[5]-3:C-4:C-4:C-4:	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3)	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2	Si(N[5]Si[4,5]Si[5])(CH3)3	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3){1|C<3>,4|C<4>}	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>}	Si(N[5]Si[4,5]Si[5])(CH3)3	120.8750	0.000	1	120.8750	0.000	1	120.8750	0.000	1	120.8750	0.000	1	127.3015	82.600	2	127.3015	82.600	2
542	562	930	0:SP2_SP2_SP3	N[5]	Si[5,6]	C	4:2:3:	3:3:3:2:	3:2:1:	Si[5,6]-4:N[5]-2:C-3:	N[6]-3:N[6]-3:N[5]-3:O[5]-2:	N[5]-3:O-2:O-1:	N[5](Si[5,6]N[6]2O[5])(N[5]C[5])(COO)	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5])	C(N[5]Si[5,6]N[5])(OC)(O)	N[5](Si[5,6]N[6]2O[5])(N[5]C[5])(COO){1|O<2>,4|C<3>}	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5]){1|C<4>,1|O<2>,6|C<3>}	C(N[5]Si[5,6]N[5])(OC)(O)	128.0550	0.000	1	128.0550	0.000	1	128.0550	0.000	1	128.0550	0.000	1	128.0550	0.000	1	125.4077	6.151	3
542	562	930	0:SP2_SP2_SP3	N[5]	Si[5]	C	3:4:3:	3:2:4:4:	3:3:1:	C[5,6a]-3:Si[5]-4:C-3:	N[5]-3:O[5]-2:C-4:C-4:	N[5]-3:C[5a]-3:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]O[5]CC)(CC[5a]O)	Si[5](N[5]C[5,6a]C)(O[5]C[5,6a])(CH3)2	C(N[5]C[5,6a]Si[5])(C[5a]N[5a]2)(O)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]O[5]CC)(CC[5a]O){1|H<1>,2|C<3>}	Si[5](N[5]C[5,6a]C)(O[5]C[5,6a])(CH3)2{2|C<3>}	C(N[5]C[5,6a]Si[5])(C[5a]N[5a]2)(O)	123.1380	0.000	1	123.1380	0.000	1	123.1380	0.000	1	123.1380	0.000	1	124.0840	1.790	2	125.4077	6.151	3
542	562	930	0:SP2_SP2_SP3	N[5]	Si[5]	C	3:4:3:	3:3:3:2:	3:3:1:	C[5,6a]-3:Si[5]-4:C-3:	N[5]-3:C[6a]-3:C[6a]-3:O[5]-2:	N[5]-3:N[5a]-3:O-1:	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]2O[5])(CN[5a]O)	Si[5](N[5]C[5,6a]C)(C[6a]C[6a]2)2(O[5]C[5,6a])	C(N[5]C[5,6a]Si[5])(N[5a]C[5a]N[5a])(O)	N[5](C[5,6a]C[5,6a]C[6a])(Si[5]C[6a]2O[5])(CN[5a]O){1|H<1>,6|C<3>}	Si[5](N[5]C[5,6a]C)(C[6a]C[6a]2)2(O[5]C[5,6a]){4|H<1>,6|C<3>}	C(N[5]C[5,6a]Si[5])(N[5a]C[5a]N[5a])(O)	125.0300	0.000	1	125.0300	0.000	1	125.0300	0.000	1	125.0300	0.000	1	124.0840	1.790	2	125.4077	6.151	3
542	562	939	5:SP2_SP2_SP3	N[5]	Si[5]	Ge[5]	4:3:3:	3:3:3:4:	4:3:1:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	P[5]-4:N[5]-3:Br-1:	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Br)	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Br)	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Br){2|C<4>,2|H<1>,8|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH){1|Br<1>,4|H<1>,8|C<3>}	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Br){2|H<1>,8|C<3>}	126.5380	0.000	1	126.5380	0.000	1	126.5380	0.000	1	126.2858	0.237	4	126.2010	0.223	8	126.2010	0.223	8
542	562	939	5:SP2_SP2_SP3	N[5]	Si[5]	Ge[5]	4:3:3:	3:3:3:4:	4:3:1:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:C[5]-4:	P[5]-4:N[5]-3:Cl-1:	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Cl)	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH)	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Cl)	N[5](Si[5]C[6a]2C[5])(C[6a]C[6a]2)(Ge[5]P[5]Cl){2|C<4>,2|H<1>,8|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[6a]C[6a]2)2(C[5]P[5]HH){1|Cl<1>,4|H<1>,8|C<3>}	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Cl){2|H<1>,8|C<3>}	126.2017	0.559	3	126.2017	0.312	3	126.2017	0.312	3	126.2858	0.237	4	126.2010	0.223	8	126.2010	0.223	8
542	562	939	5:SP2_SP2_SP3	N[5]	Si[5]	Ge[5]	4:3:3:	3:4:4:4:	4:3:1:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[5]-4:C-4:C-4:	P[5]-4:N[5]-3:Br-1:	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Br)	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Br)	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Br){2|C<4>,2|H<1>,4|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2{1|Br<1>,4|C<3>}	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Br){2|C<4>,2|H<1>,6|C<3>}	125.9015	0.733	2	125.9015	0.538	2	125.9015	0.538	2	126.1162	0.265	4	126.2010	0.223	8	126.2010	0.223	8
542	562	939	5:SP2_SP2_SP3	N[5]	Si[5]	Ge[5]	4:3:3:	3:4:4:4:	4:3:1:	Si[5]-4:C[6a]-3:Ge[5]-3:	N[5]-3:C[5]-4:C-4:C-4:	P[5]-4:N[5]-3:Cl-1:	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Cl)	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Cl)	N[5](Si[5]C[5]CC)(C[6a]C[6a]2)(Ge[5]P[5]Cl){2|C<4>,2|H<1>,4|C<3>}	Si[5](N[5]C[6a]Ge[5])(C[5]P[5]HH)(CCCH)2{1|Cl<1>,4|C<3>}	Ge[5](P[5]C[6a]2C[5])(N[5]C[6a]Si[5])(Cl){2|C<4>,2|H<1>,6|C<3>}	126.3310	0.272	2	126.3310	0.074	2	126.3310	0.074	2	126.1162	0.265	4	126.2010	0.223	8	126.2010	0.223	8
542	562	946	5:SP2_SP1_SP3	N[5]	Si[5]	Ge[5]	4:3:2:	3:4:4:4:	3:3:	Si[5]-4:C[6a]-3:Ge[5]-2:	N[5]-3:Si[5]-4:C-4:C-4:	N[5]-3:N[5]-3:	N[5](Si[5]Si[5]CC)(C[6a]C[6a]2)(Ge[5]N[5])	Si[5](N[5]C[6a]Ge[5])(Si[5]N[5]CC)(CH3)2	Ge[5](N[5]C[6a]Si[5])2	N[5](Si[5]Si[5]CC)(C[6a]C[6a]2)(Ge[5]N[5]){3|C<3>,4|C<4>}	Si[5](N[5]C[6a]Ge[5])(Si[5]N[5]CC)(CH3)2{3|C<3>}	Ge[5](N[5]C[6a]Si[5])2{4|C<3>,4|C<4>}	122.0965	0.564	2	122.0965	0.318	2	122.0965	0.318	2	122.0965	0.318	2	122.0965	0.318	2	122.0965	0.318	2
542	562	951	0:SP2_SP-NON_SP3	N[5,5]	Si[5,5,6]	H	4:4:1:	4:4:3:4:	3:	Si[5,5,6]-4:Si[5,5,6]-4:H-1:	Si[5,6]-4:Si[5,6]-4:N[5,5]-3:C-4:	N[5,5]-3:	N[5,5](Si[5,5,6]Si[5,6]2C)2(H)	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3)	H(N[5,5]Si[5,5,6]2)	N[5,5](Si[5,5,6]Si[5,6]2C)2(H){8|C<4>}	Si[5,5,6](Si[5,6]Si[5,6]CC)2(N[5,5]Si[5,5,6]H)(CH3){5|C<4>}	H(N[5,5]Si[5,5,6]2)	123.1730	0.000	1	123.1730	0.000	1	123.1730	0.000	1	123.1730	0.000	1	123.1730	0.000	1	124.3367	3.261	3
542	562	951	0:SP2_SP-NON_SP3	N[5]	Si[5,5]	H	4:2:1:	4:4:3:4:	3:	Si[5,5]-4:N[5]-2:H-1:	C[5,5]-4:C[5]-4:N[5]-3:Si-4:	N[5]-3:	N[5](Si[5,5]C[5,5]C[5]Si)(N[5]C[5])(H)	Si[5,5](C[5,5]C[5]2Si)(C[5]C[5]Si2)(N[5]N[5]H)(SiC3)	H(N[5]Si[5,5]N[5])	N[5](Si[5,5]C[5,5]C[5]Si)(N[5]C[5])(H){4|Si<4>,2|C<4>}	Si[5,5](C[5,5]C[5]2Si)(C[5]C[5]Si2)(N[5]N[5]H)(SiC3){1|Si<4>,4|H<1>}	H(N[5]Si[5,5]N[5])	123.4200	0.000	1	123.4200	0.000	1	123.4200	0.000	1	123.4200	0.000	1	123.4200	0.000	1	124.3367	3.261	3
542	562	951	0:SP2_SP-NON_SP3	N[5]	Si[5]	H	4:3:1:	4:3:4:4:	3:	Si[5]-4:C[5]-3:H-1:	C[5,5]-4:N[5]-3:C-4:C-4:	N[5]-3:	N[5](Si[5]C[5,5]CC)(C[5]C[5,5]C)(H)	Si[5](C[5,5]C[5,5]C[6a]C[5])(N[5]C[5]H)(CH3)2	H(N[5]Si[5]C[5])	N[5](Si[5]C[5,5]CC)(C[5]C[5,5]C)(H){1|C<4>,2|C<3>}	Si[5](C[5,5]C[5,5]C[6a]C[5])(N[5]C[5]H)(CH3)2{1|N<3>,2|C<4>,3|C<3>}	H(N[5]Si[5]C[5])	126.4170	0.000	1	126.4170	0.000	1	126.4170	0.000	1	126.4170	0.000	1	126.4170	0.000	1	124.3367	3.261	3
542	562	956	0:SP2_SP3_SP3	N[5]	Si[5,6]	N	4:3:3:	4:3:3:3:	3:1:1:	Si[5,6]-4:C[5]-3:N-3:	C[5,6]-4:N[6]-3:N[6]-3:N[5]-3:	N[5]-3:H-1:H-1:	N[5](Si[5,6]C[5,6]N[6]2)(C[5]C[5,6]C[6a])(NHH)	Si[5,6](C[5,6]C[5,6]C[6]H)(N[6]C[6a]C[6])2(N[5]C[5]N)	N(N[5]Si[5,6]C[5])(H)2	N[5](Si[5,6]C[5,6]N[6]2)(C[5]C[5,6]C[6a])(NHH){1|H<1>,8|C<3>}	Si[5,6](C[5,6]C[5,6]C[6]H)(N[6]C[6a]C[6])2(N[5]C[5]N){1|C<4>,1|H<1>,9|C<3>}	N(N[5]Si[5,6]C[5])(H)2	117.4600	0.000	1	117.4600	0.000	1	117.4600	0.000	1	117.4600	0.000	1	117.4600	0.000	1	120.4987	56.121	3
542	562	956	0:SP2_SP3_SP3	N[5]	Si[5]	N	4:4:3:	4:3:1:1:	3:4:4:	Si[5]-4:Si[5]-4:N-3:	C[5]-4:N[5]-3:H-1:H-1:	N[5]-3:C-4:C-4:	N[5](Si[5]C[5]HH)2(NCC)	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2	N(N[5]Si[5]2)(CH3)2	N[5](Si[5]C[5]HH)2(NCC){4|H<1>}	Si[5](C[5]C[5]HH)(N[5]Si[5]N)(H)2{4|H<1>}	N(N[5]Si[5]2)(CH3)2	122.0180	9.919	2	122.0180	98.392	2	122.0180	98.392	2	122.0180	98.392	2	122.0180	98.392	2	120.4987	56.121	3
542	562	960	5:SP2_SP2_SP3	N[5,6]	Si[5,6]	N[5]	4:4:2:	3:4:2:2:	3:3:	Si[5,6]-4:C[6]-4:N[5]-2:	N[5,6]-3:C[6]-4:O[5]-2:O-2:	N[5,6]-3:C[5]-3:	N[5,6](Si[5,6]C[6]O[5]O)(C[6]C[6a]C[6]H)(N[5]C[5])	Si[5,6](N[5,6]C[6]N[5])(C[6]C[6]HH)(O[5]C[5])(OC)	N[5](N[5,6]Si[5,6]C[6])(C[5]O[5]C)	N[5,6](Si[5,6]C[6]O[5]O)(C[6]C[6a]C[6]H)(N[5]C[5]){2|C<3>,2|C<4>,4|H<1>}	Si[5,6](N[5,6]C[6]N[5])(C[6]C[6]HH)(O[5]C[5])(OC){1|C<3>,2|C<4>,3|H<1>}	N[5](N[5,6]Si[5,6]C[6])(C[5]O[5]C){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	113.9515	0.489	2	113.9515	0.239	2	113.9515	0.239	2	113.9515	0.239	2	113.9515	0.239	2	112.8720	1.571	9
542	562	960	5:SP2_SP2_SP3	N[5]	Si[5,5]	N[5]	4:2:1:	4:4:3:4:	3:3:	Si[5,5]-4:N[5]-2:H-1:	C[5,5]-4:C[5]-4:N[5]-3:Si-4:	C[5]-3:N[5]-3:	N[5](Si[5,5]C[5,5]C[5]Si)(N[5]C[5])(H)	Si[5,5](C[5,5]C[5]2Si)(C[5]C[5]Si2)(N[5]N[5]H)(SiC3)	N[5](C[5]C[5,5]Si)(N[5]Si[5,5]H)	N[5](Si[5,5]C[5,5]C[5]Si)(N[5]C[5])(H){4|Si<4>,2|C<4>}	Si[5,5](C[5,5]C[5]2Si)(C[5]C[5]Si2)(N[5]N[5]H)(SiC3){1|Si<4>,4|H<1>}	N[5](C[5]C[5,5]Si)(N[5]Si[5,5]H){2|Si<4>,2|C<4>}	113.1340	0.000	1	113.1340	0.000	1	113.1340	0.000	1	113.1340	0.000	1	112.3618	1.947	5	112.8720	1.571	9
542	562	960	5:SP2_SP2_SP3	N[5]	Si[5,5]	N[5]	4:3:2:	3:3:3:3:	3:2:	Si[5,5]-4:B[5a]-3:N[5]-2:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](Si[5,5]N[5]3)(B[5a]N[5a]2)(N[5]N[5])	Si[5,5](N[5]B[5a]N[5])2(N[5]C[5]C)2	N[5](N[5]Si[5,5]B[5a])(N[5]N[5])	N[5](Si[5,5]N[5]3)(B[5a]N[5a]2)(N[5]N[5]){1|B<3>,2|C<4>,6|C<3>}	Si[5,5](N[5]B[5a]N[5])2(N[5]C[5]C)2{2|H<1>,4|N<3>}	N[5](N[5]Si[5,5]B[5a])(N[5]N[5]){1|B<3>,4|N<3>}	110.8460	0.177	2	110.8460	0.031	2	110.8460	0.031	2	110.8460	0.031	2	112.3618	1.947	5	112.8720	1.571	9
542	562	960	5:SP2_SP2_SP3	N[5]	Si[5,5]	N[5]	4:4:2:	3:3:3:3:	3:2:	C[3x6]-4:Si[5,5]-4:N[5]-2:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-2:	N[5](C[3x6]C[6,6]3)(Si[5,5]N[5]3)(N[5]N[5])	Si[5,5](N[5]C[3x6]N[5])2(N[5]C[5]C)2	N[5](N[5]Si[5,5]C[3x6])(N[5]N[5])	N[5](C[3x6]C[6,6]3)(Si[5,5]N[5]3)(N[5]N[5]){6|H<1>,8|C<4>}	Si[5,5](N[5]C[3x6]N[5])2(N[5]C[5]C)2{3|H<1>,7|C<4>}	N[5](N[5]Si[5,5]C[3x6])(N[5]N[5]){2|N<3>,4|C<4>}	113.4915	0.107	2	113.4915	0.011	2	113.4915	0.011	2	113.4915	0.011	2	112.3618	1.947	5	112.8720	1.571	9
542	562	960	5:SP2_SP2_SP3	N[5]	Si[5,6]	N[5]	4:2:3:	3:3:3:2:	3:3:	Si[5,6]-4:N[5]-2:C-3:	N[6]-3:N[6]-3:N[5]-3:O[5]-2:	N[5]-3:C[5]-3:	N[5](Si[5,6]N[6]2O[5])(N[5]C[5])(COO)	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5])	N[5](N[5]Si[5,6]C)(C[5]O[5]O)	N[5](Si[5,6]N[6]2O[5])(N[5]C[5])(COO){1|O<2>,4|C<3>}	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5]){1|C<4>,1|O<2>,6|C<3>}	N[5](N[5]Si[5,6]C)(C[5]O[5]O){2|N<3>}	112.4210	0.000	1	112.4210	0.000	1	112.4210	0.000	1	112.4210	0.000	1	112.4210	0.000	1	112.8720	1.571	9
542	562	960	5:SP2_SP2_SP3	N[5]	Si[5]	N[5]	4:2:4:	3:2:4:2:	3:3:	Si[5]-4:N[5]-2:C-4:	N[5]-3:O[5]-2:C-4:O-2:	N[5]-3:C[5]-3:	N[5](Si[5]O[5]CO)(N[5]C[5])(CCCH)	Si[5](N[5]N[5]C)(O[5]C[5])(CH3)(OC)	N[5](N[5]Si[5]C)(C[5]O[5]C)	N[5](Si[5]O[5]CO)(N[5]C[5])(CCCH){1|C<4>}	Si[5](N[5]N[5]C)(O[5]C[5])(CH3)(OC){1|C<4>}	N[5](N[5]Si[5]C)(C[5]O[5]C){1|C<4>,1|O<2>}	113.7150	0.000	1	113.7150	0.000	1	113.7150	0.000	1	113.7150	0.000	1	113.7150	0.000	1	112.8720	1.571	9
542	562	996	5:SP2_SP3_SP3	N[5]	Si[5]	Si[4,5]	4:4:4:	3:3:4:4:	3:3:3:3:	Si[4,5]-4:Si[5]-4:Si-4:	N[5]-3:P[5]-3:C-4:C-4:	C[5]-3:N[5]-3:N[4]-3:N[4]-3:	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3)	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2	Si[4,5](C[5]C[3x6]P[5])(N[5]Si[5]Si)(N[4]C[4]C)2	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3){1|C<3>,4|C<4>}	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>}	Si[4,5](C[5]C[3x6]P[5])(N[5]Si[5]Si)(N[4]C[4]C)2{1|C<3>,6|C<4>}	108.0540	0.000	1	108.0540	0.000	1	108.0540	0.000	1	108.0540	0.000	1	108.0540	0.000	1	108.0540	0.000	1
542	562	996	5:SP3_SP3_SP3	N[5]	Si[5]	Si[4,5]	4:4:4:	3:3:4:4:	3:3:3:3:	Si[4,5]-4:Si[5]-4:Si-4:	N[5]-3:P[5]-3:C-4:C-4:	C[5]-3:N[5]-3:N[4]-3:N[4]-3:	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3)	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2	Si[4,5](C[5]C[3x6]P[5])(N[5]Si[5]Si)(N[4]C[4]C)2	N[5](Si[4,5]C[5]N[4]2)(Si[5]P[5]CC)(SiC3){1|C<3>,4|C<4>}	Si[5](N[5]Si[4,5]Si)(P[5]C[5]C)(CH3)2{1|C<4>,2|N<3>}	Si[4,5](C[5]C[3x6]P[5])(N[5]Si[5]Si)(N[4]C[4]C)2{1|C<3>,6|C<4>}	108.1720	0.000	1	108.1720	0.000	1	108.1720	0.000	1	108.1720	0.000	1	108.1720	0.000	1	108.1720	0.000	1
542	566	762	0:SP2_SP2_SPD6	N[5,6]	Ga[4,5,5]	C[6]	6:3:3:	3:3:3:3:2:2:	3:3:1:	Ga[4,5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[4]-2:O[4]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[4,5,5](N[5,6]C[5,6]C[6])4(O[4]Ga[4,5,5])2	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){1|Ga<6>,2|H<1>,7|C<3>}	Ga[4,5,5](N[5,6]C[5,6]C[6])4(O[4]Ga[4,5,5])2{4|H<1>,4|N<3>,8|C<3>}	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	125.6534	0.723	15	125.6534	0.523	15	125.6534	0.523	15	125.6534	0.523	15	125.6534	0.523	15	125.6534	0.523	15
542	566	818	5:SP2_SP2_SPD6	N[5,6]	Ga[4,5,5]	C[5,6]	6:3:3:	3:3:3:3:2:2:	3:3:3:	Ga[4,5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[4]-2:O[4]-2:	N[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[4,5,5](N[5,6]C[5,6]C[6])4(O[4]Ga[4,5,5])2	C[5,6](N[5,6]Ga[4,5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,6](Ga[4,5,5]N[5,6]3O[4]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){1|Ga<6>,2|H<1>,7|C<3>}	Ga[4,5,5](N[5,6]C[5,6]C[6])4(O[4]Ga[4,5,5])2{4|H<1>,4|N<3>,8|C<3>}	C[5,6](N[5,6]Ga[4,5,5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){2|N<3>,2|O<2>,3|C<3>,3|H<1>}	115.2200	0.588	16	115.2200	0.346	16	115.2200	0.346	16	115.2200	0.346	16	115.2200	0.346	16	115.2200	0.346	16
542	578	643	0:SP2_SP2_SPD6	N[5]	Ga[3x5]	C[6a]	3:6:3:	3:3:3:2:2:2:	3:3:3:	C[5,6a]-3:Ga[3x5]-6:C[6a]-3:	N[5]-3:N[5]-3:N[5]-3:O[5]-2:O[5]-2:O[5]-2:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Ga[3x5]N[5]2O[5]3)(C[6a]C[6a]2)	Ga[3x5](N[5]C[5,6a]C[6a])3(O[5]C[5,6a])3	C[6a](N[5]C[5,6a]Ga[3x5])(C[6a]C[6a]H)2	N[5](C[5,6a]C[5,6a]C[6a])(Ga[3x5]N[5]2O[5]3)(C[6a]C[6a]2){10|C<3>,3|H<1>}	Ga[3x5](N[5]C[5,6a]C[6a])3(O[5]C[5,6a])3{12|C<3>}	C[6a](N[5]C[5,6a]Ga[3x5])(C[6a]C[6a]H)2{2|C<4>,2|N<3>,3|C<3>,3|O<2>}	126.1217	2.178	3	126.1217	4.742	3	126.1217	4.742	3	126.1217	4.742	3	126.3517	1.842	13	126.3517	1.842	13
542	578	643	0:SP2_SP2_SPD6	N[5]	Ga[3x5]	C[6a]	3:6:3:	3:3:3:3:3:3:	3:3:3:	C[5,5]-3:Ga[3x5]-6:C[6a]-3:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5,5]C[5,6a]C[5,5])(Ga[3x5]N[5]5)(C[6a]C[6a]2)	Ga[3x5](N[5]C[5,5]C[6a])6	C[6a](N[5]Ga[3x5]C[5,5])(C[6a]C[6a]H)2	N[5](C[5,5]C[5,6a]C[5,5])(Ga[3x5]N[5]5)(C[6a]C[6a]2){14|C<3>,2|H<1>}	Ga[3x5](N[5]C[5,5]C[6a])6{18|C<3>}	C[6a](N[5]Ga[3x5]C[5,5])(C[6a]C[6a]H)2{2|C<4>,3|C<3>,5|N<3>}	126.4207	1.174	10	126.4207	1.379	10	126.4207	1.379	10	126.4207	1.379	10	126.3517	1.842	13	126.3517	1.842	13
542	578	727	5:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[5,6,6a]	3:6:3:	3:3:3:2:2:2:	3:3:3:	C[5,6,6a]-3:Ga[3x5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:	N[5,6]-3:C[5,6a]-3:C[6,6a]-3:	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6,6a]C[6])3(O[5]C[5,6a])3	C[5,6,6a](N[5,6]Ga[3x5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6])	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H){1|H<1>,9|C<3>}	Ga[3x5](N[5,6]C[5,6,6a]C[6])3(O[5]C[5,6a])3{3|H<1>,9|C<3>}	C[5,6,6a](N[5,6]Ga[3x5]C[6])(C[5,6a]C[6a]O[5])(C[6,6a]C[6a]C[6]){2|C<3>,2|N<3>,2|O<2>,4|H<1>}	109.7470	0.601	3	109.7470	0.362	3	109.7470	0.362	3	109.7470	0.362	3	109.7470	0.362	3	112.0195	2.302	14
542	578	727	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[5,6,6a]	3:6:3:	3:3:3:3:1:1:	3:3:3:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	C[5,6,6a]-3:N[5,6]-3:C[6,6a]-3:	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2	C[5,6,6a](C[5,6,6a]C[6,6a]N[5,6])(N[5,6]Ga[5,5]C[6])(C[6,6a]C[6a]C[6])	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2{4|H<1>,8|C<3>}	C[5,6,6a](C[5,6,6a]C[6,6a]N[5,6])(N[5,6]Ga[5,5]C[6])(C[6,6a]C[6a]C[6]){2|Cl<1>,2|N<3>,3|H<1>,4|C<3>}	113.4290	0.856	2	113.4290	0.732	2	113.4290	0.732	2	113.7387	0.654	3	113.7387	0.654	3	112.0195	2.302	14
542	578	727	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[5,6,6a]	3:6:3:	3:3:3:3:1:1:	3:3:3:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	C[5,6a,6a]-3:N[5,6]-3:C[6,6a]-3:	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2	C[5,6,6a](C[5,6a,6a]C[6a,6a]N[5,6a])(N[5,6]Ga[5,5]C[6])(C[6,6a]C[6a]C[6])	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2{4|H<1>,8|C<3>}	C[5,6,6a](C[5,6a,6a]C[6a,6a]N[5,6a])(N[5,6]Ga[5,5]C[6])(C[6,6a]C[6a]C[6]){2|Cl<1>,2|N<3>,3|H<1>,4|C<3>}	114.3580	0.000	1	114.3580	0.000	1	114.3580	0.000	1	113.7387	0.654	3	113.7387	0.654	3	112.0195	2.302	14
542	578	727	5:SP2_SP2_SPD6	N[5,6]	Ga[5,6]	C[5,6,6a]	3:6:3:	3:3:2:2:3:2:	3:3:3:	C[5,6,6a]-3:Ga[5,6]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:O-3:O-2:	C[5,6,6a]-3:N[5,6]-3:C[6,6a]-3:	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H)	Ga[5,6](N[5,6]C[5,6,6a]C[6])2(O[6]C[6,6a])(O[6]C[6,6])(OCH)(ON)	C[5,6,6a](C[5,6,6a]C[6,6a]N[5,6])(N[5,6]Ga[5,6]C[6])(C[6,6a]C[6a]C[6])	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H){1|H<1>,6|C<3>}	Ga[5,6](N[5,6]C[5,6,6a]C[6])2(O[6]C[6,6a])(O[6]C[6,6])(OCH)(ON){2|H<1>,7|C<3>}	C[5,6,6a](C[5,6,6a]C[6,6a]N[5,6])(N[5,6]Ga[5,6]C[6])(C[6,6a]C[6a]C[6]){1|O<3>,3|H<1>,3|O<2>,4|C<3>}	112.2105	0.848	4	112.2105	0.720	4	112.2105	0.720	4	112.2105	0.720	4	112.2105	0.720	4	112.0195	2.302	14
542	578	727	5:SP2_SP2_SPD6	N[5,6]	Ga[5]	C[5,6,6a]	3:6:3:	3:3:3:1:1:1:	3:3:3:	C[5,6,6a]-3:Ga[5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:O-3:F-1:F-1:F-1:	C[5,6a,6a]-3:C[6,6a]-3:N[5,6]-3:	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H)	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OHH)(F)3	C[5,6,6a](C[5,6a,6a]C[6a,6a]N[5,6a])(C[6,6a]C[6a]C[6])(N[5,6]Ga[5]C[6])	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H){1|H<1>,4|C<3>}	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OHH)(F)3{2|H<1>,4|C<3>}	C[5,6,6a](C[5,6a,6a]C[6a,6a]N[5,6a])(C[6,6a]C[6a]C[6])(N[5,6]Ga[5]C[6]){1|O<3>,3|F<1>,3|H<1>,4|C<3>}	112.9870	0.000	1	112.9870	0.000	1	112.9870	0.000	1	112.9870	0.000	1	112.9870	0.000	1	112.0195	2.302	14
542	578	727	5:SP2_SP2_SPD6	N[5]	Ga[3x5]	C[5,6a]	3:6:3:	3:3:3:2:2:2:	3:3:3:	C[5,6a]-3:Ga[3x5]-6:C[6a]-3:	N[5]-3:N[5]-3:N[5]-3:O[5]-2:O[5]-2:O[5]-2:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Ga[3x5]N[5]2O[5]3)(C[6a]C[6a]2)	Ga[3x5](N[5]C[5,6a]C[6a])3(O[5]C[5,6a])3	C[5,6a](C[5,6a]C[6a]O[5])(N[5]Ga[3x5]C[6a])(C[6a]C[6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(Ga[3x5]N[5]2O[5]3)(C[6a]C[6a]2){10|C<3>,3|H<1>}	Ga[3x5](N[5]C[5,6a]C[6a])3(O[5]C[5,6a])3{12|C<3>}	C[5,6a](C[5,6a]C[6a]O[5])(N[5]Ga[3x5]C[6a])(C[6a]C[6a]H){2|C<4>,2|N<3>,2|O<2>,3|C<3>}	111.9957	0.385	3	111.9957	0.148	3	111.9957	0.148	3	111.9957	0.148	3	111.9957	0.148	3	112.0195	2.302	14
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[3x5,6,6]	C[6]	6:3:3:	3:4:4:4:2:2:	3:3:1:	Ga[3x5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-4:N[5,6]-4:N[3x5]-4:O[6]-2:O[6]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[3x5,6,6](N[5,6]C[5,6]C[6])(N[5,6]C[5]C[6]H)2(N[3x5]C[5]3)(O[6]C[6,6a])2	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,6|C<4>,6|H<1>}	Ga[3x5,6,6](N[5,6]C[5,6]C[6])(N[5,6]C[5]C[6]H)2(N[3x5]C[5]3)(O[6]C[6,6a])2{15|H<1>,6|C<3>}	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<4>}	126.6195	0.378	2	126.6195	0.143	2	126.6195	0.143	2	126.6195	0.143	2	126.6195	0.143	2	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[6]	3:6:3:	3:3:3:2:2:2:	3:3:1:	C[5,6,6a]-3:Ga[3x5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6,6a]C[6])3(O[5]C[5,6a])3	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a]C[6,6a])(Ga[3x5]N[5,6]2O[5]3)(C[6]C[6]H){1|H<1>,9|C<3>}	Ga[3x5](N[5,6]C[5,6,6a]C[6])3(O[5]C[5,6a])3{3|H<1>,9|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	131.6057	0.643	3	131.6057	0.413	3	131.6057	0.413	3	131.6057	0.413	3	127.6481	6.733	11	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[6]	3:6:3:	3:3:3:3:3:3:	3:3:1:	C[5,6]-3:Ga[3x5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6]C[6])6	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H){11|C<3>,2|H<1>}	Ga[3x5](N[5,6]C[5,6]C[6])6{12|C<3>,6|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|N<3>}	125.9563	0.378	6	125.9563	0.143	6	125.9563	0.143	6	125.9563	0.143	6	127.6481	6.733	11	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[6]	6:3:3:	3:3:4:4:1:1:	3:3:1:	Ga[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-4:N[5,5]-4:Cl-1:Cl-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]2H)2(Cl)2	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,3|C<4>,6|H<1>}	Ga[3x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]2H)2(Cl)2{10|H<1>,4|C<3>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>}	126.7870	0.382	2	126.7870	0.146	2	126.7870	0.146	2	126.7870	0.146	2	127.6481	6.733	11	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[4x5]	C[6]	6:3:3:	3:3:3:3:2:2:	3:3:1:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|C<4>,2|H<1>,2|N<3>,4|C<3>}	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	125.4275	0.753	2	125.7587	0.390	4	125.7587	0.390	4	125.7587	0.390	4	125.7587	0.390	4	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[4x5]	C[6]	6:3:3:	3:3:3:3:2:2:	3:3:1:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,2|N<2>,7|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|H<1>,2|N<3>,6|C<3>}	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	126.0900	0.406	2	125.7587	0.390	4	125.7587	0.390	4	125.7587	0.390	4	125.7587	0.390	4	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5,6,6]	C[6]	6:3:3:	3:3:3:3:2:2:	3:3:1:	Ga[5,5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|S<4>,4|H<1>,5|C<3>}	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2{4|O<1>,6|H<1>,8|C<3>}	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<3>}	125.4975	0.500	2	125.4975	0.250	2	125.4975	0.250	2	125.4975	0.250	2	125.4975	0.250	2	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5,6]	C[6]	6:3:3:	3:3:3:3:2:2:	3:3:1:	Ga[5,5,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5,6](N[5,6]C[5,6]C[6])4(O[6]C[6,6a])(O[6]C[6,6])	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,9|C<3>}	Ga[5,5,6](N[5,6]C[5,6]C[6])4(O[6]C[6,6a])(O[6]C[6,6]){11|C<3>,4|H<1>}	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	125.4180	0.868	4	125.4180	0.753	4	125.4180	0.753	4	125.4180	0.753	4	125.4180	0.753	4	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[6]	3:6:3:	3:3:3:3:1:1:	3:3:1:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2{4|H<1>,8|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	127.9315	0.598	2	127.9315	0.357	2	127.6643	0.393	3	127.6643	0.393	3	126.1434	1.450	9	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[6]	3:6:3:	3:3:3:3:1:1:	3:3:1:	C[5,6,6a]-3:Ga[5,5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:Cl-1:Cl-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H)	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5,5]N[5,6a]N[5,6]2Cl2)(C[6]C[6]H){1|H<1>,8|C<3>}	Ga[5,5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])3(Cl)2{4|H<1>,8|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	127.1300	0.000	1	127.1300	0.000	1	127.6643	0.393	3	127.6643	0.393	3	126.1434	1.450	9	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[6]	6:3:3:	3:3:3:1:1:1:	3:3:1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Br-1:Br-1:Br-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3{2|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|H<1>,2|C<3>,2|N<3>}	125.4835	0.472	2	125.4835	0.222	2	125.4835	0.222	2	125.3830	0.081	6	126.1434	1.450	9	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[6]	6:3:3:	3:3:3:1:1:1:	3:3:1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Cl-1:Cl-1:Cl-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3{2|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	125.2625	0.360	2	125.2625	0.130	2	125.2625	0.130	2	125.3830	0.081	6	126.1434	1.450	9	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[6]	6:3:3:	3:3:3:1:1:1:	3:3:1:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:F-1:F-1:F-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3{2|H<1>,6|C<3>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|F<1>}	125.4030	0.066	2	125.4030	0.004	2	125.4030	0.004	2	125.3830	0.081	6	126.1434	1.450	9	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5,6]	C[6]	3:6:3:	3:3:2:2:3:2:	3:3:1:	C[5,6,6a]-3:Ga[5,6]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:O-3:O-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H)	Ga[5,6](N[5,6]C[5,6,6a]C[6])2(O[6]C[6,6a])(O[6]C[6,6])(OCH)(ON)	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6,6a]C[6,6a])(Ga[5,6]N[5,6]O[6]2OO)(C[6]C[6]H){1|H<1>,6|C<3>}	Ga[5,6](N[5,6]C[5,6,6a]C[6])2(O[6]C[6,6a])(O[6]C[6,6])(OCH)(ON){2|H<1>,7|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	127.7698	0.559	4	127.7698	0.313	4	127.7698	0.313	4	127.7698	0.313	4	127.7698	0.313	4	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5]	C[6]	3:6:3:	3:3:3:1:1:1:	3:3:1:	C[5,6,6a]-3:Ga[5]-6:C[6]-3:	N[5,6a]-3:N[5,6]-3:O-3:F-1:F-1:F-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H)	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OHH)(F)3	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6,6a]C[5,6a,6a]C[6,6a])(Ga[5]N[5,6a]F3O)(C[6]C[6]H){1|H<1>,4|C<3>}	Ga[5](N[5,6a]C[5,6a,6a]C[6a])(N[5,6]C[5,6,6a]C[6])(OHH)(F)3{2|H<1>,4|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	128.0480	0.000	1	128.0480	0.000	1	128.0480	0.000	1	125.8870	3.513	3	125.8870	3.513	3	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5]	C[6]	3:6:3:	3:3:3:1:1:1:	3:3:1:	C[5,6]-3:Ga[5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:O-3:F-1:F-1:F-1:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H)	Ga[5](N[5,6]C[5,6]C[6])2(OHH)(F)3	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H){2|H<1>,3|C<3>}	Ga[5](N[5,6]C[5,6]C[6])2(OHH)(F)3{2|H<1>,4|C<3>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	124.8065	0.146	2	124.8065	0.021	2	124.8065	0.021	2	125.8870	3.513	3	125.8870	3.513	3	126.6374	3.223	40
542	578	762	0:SP2_SP2_SPD6	N[5,6]	Ga[5x5]	C[6]	6:3:3:	4:4:3:3:2:2:	3:3:1:	Ga[5x5]-6:C[5,6]-3:C[6]-3:	N[3x5]-4:N[3x5]-4:N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:	N[5,6]-3:C[6]-3:H-1:	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[5x5](N[3x5]C[5,6]C[5]2)2(N[5,6]C[5,6]C[6])2(O[5]C[5])2	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H)	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>,5|C<4>}	Ga[5x5](N[3x5]C[5,6]C[5]2)2(N[5,6]C[5,6]C[6])2(O[5]C[5])2{12|H<1>,2|C<4>,2|O<1>,4|C<3>}	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>,2|O<2>}	128.3940	0.000	1	128.3940	0.000	1	128.3940	0.000	1	128.3940	0.000	1	128.3940	0.000	1	126.6374	3.223	40
542	578	762	6:SP2_SP2_SPD6	N[5,6]	Ga[3x5,6,6]	C[6]	6:4:3:	3:3:4:4:2:2:	3:3:4:	Ga[3x5,6,6]-6:C[5]-4:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-4:N[5,5]-4:O[6]-2:O[6]-2:	N[5,6]-3:C[6]-3:C-4:	N[5,6](Ga[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[5]C[5]HH)(C[6]C[6]C)	Ga[3x5,6,6](N[5,6]C[5]C[6])2(N[5,5]C[5]2H)2(O[6]C[6])2	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3)	N[5,6](Ga[3x5,6,6]N[5,5]2N[5,6]O[6]2)(C[5]C[5]HH)(C[6]C[6]C){3|C<3>,4|C<4>,5|H<1>}	Ga[3x5,6,6](N[5,6]C[5]C[6])2(N[5,5]C[5]2H)2(O[6]C[6])2{12|H<1>,2|C<3>,4|C<4>}	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>,2|N<4>,2|O<2>}	124.9470	0.000	1	124.9470	0.000	1	124.9470	0.000	1	124.9470	0.000	1	124.9470	0.000	1	124.9470	0.000	1
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[5,6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Br-1:Br-1:Br-1:	N[5,5,6]-3:C[5,6]-3:C[6]-3:	N[5,5,6](Ga[5,5]N[5,6]2Br3)(C[5,6]C[5,6]C[6])2	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,5,6](Ga[5,5]N[5,6]2Br3)(C[5,6]C[5,6]C[6])2{2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3{2|H<1>,6|C<3>}	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){3|Br<1>,1|N<3>,2|H<1>,4|C<3>}	118.7755	0.135	2	118.7755	0.018	2	118.7755	0.018	2	118.7443	0.018	6	118.7443	0.018	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[5,6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Cl-1:Cl-1:Cl-1:	N[5,5,6]-3:C[5,6]-3:C[6]-3:	N[5,5,6](Ga[5,5]N[5,6]2Cl3)(C[5,6]C[5,6]C[6])2	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,5,6](Ga[5,5]N[5,6]2Cl3)(C[5,6]C[5,6]C[6])2{2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3{2|H<1>,6|C<3>}	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){3|Cl<1>,1|N<3>,2|H<1>,4|C<3>}	118.7385	0.240	2	118.7385	0.057	2	118.7385	0.057	2	118.7443	0.018	6	118.7443	0.018	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[5,6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:F-1:F-1:F-1:	N[5,5,6]-3:C[5,6]-3:C[6]-3:	N[5,5,6](Ga[5,5]N[5,6]2F3)(C[5,6]C[5,6]C[6])2	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,5,6](Ga[5,5]N[5,6]2F3)(C[5,6]C[5,6]C[6])2{2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3{2|H<1>,6|C<3>}	C[5,6](N[5,5,6]Ga[5,5]C[5,6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){1|N<3>,2|H<1>,3|F<1>,4|C<3>}	118.7190	0.109	2	118.7190	0.012	2	118.7190	0.012	2	118.7443	0.018	6	118.7443	0.018	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5x5]	C[5,6]	6:3:3:	3:3:4:3:2:2:	3:3:3:	Ga[5x5]-6:C[5,6]-3:C[5,6]-3:	N[5,5,6]-3:N[5,5,6]-3:N[5,5]-4:N[5,5]-3:O[5]-2:O[5]-2:	N[5,5,6]-3:C[5]-3:C[6]-3:	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]O[5]O)(C[6]C[6]H)	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2{1|O<1>,3|C<4>,4|C<3>,5|H<1>}	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2{2|O<1>,4|C<3>,8|H<1>}	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]O[5]O)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|N<4>,1|O<2>,2|N<3>}	116.4720	0.253	2	116.4720	0.064	2	116.4720	0.064	2	116.4720	0.064	2	118.4758	5.375	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5x5]	C[5,6]	6:3:3:	3:3:4:3:2:2:	3:4:3:	Ga[5x5]-6:C[5,6]-3:C[5,6]-3:	N[5,5,6]-3:N[5,5,6]-3:N[5,5]-4:N[5,5]-3:O[5]-2:O[5]-2:	N[5,5,6]-3:C[5]-4:C[6]-3:	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]N[5,5]HH)(C[6]C[6]H)	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2{1|O<1>,3|C<4>,4|C<3>,5|H<1>}	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2{2|O<1>,4|C<3>,8|H<1>}	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]N[5,5]HH)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,1|N<4>,2|C<3>,2|O<2>}	120.4780	0.000	1	120.4795	0.000	2	120.4795	0.000	2	120.4795	0.000	2	118.4758	5.375	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5,6]	Ga[5x5]	C[5,6]	6:3:3:	3:3:4:3:2:2:	3:4:3:	Ga[5x5]-6:C[5,6]-3:C[5,6]-3:	N[5,5,6]-3:N[5,5,6]-3:N[5,5]-4:N[5,5]-3:O[5]-2:O[5]-2:	N[5,5,6]-3:C[5]-4:C[6]-3:	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]N[5,5]HH)(C[6]C[6]H)	N[5,5,6](Ga[5x5]N[5,5,6]N[5,5]2O[5]2)(C[5,6]C[5]C[6])2{1|O<1>,3|C<4>,4|C<3>,5|H<1>}	Ga[5x5](N[5,5,6]C[5,6]2)2(N[5,5]C[5]2H)(N[5,5]C[5]2)(O[5]C[5])2{2|O<1>,4|C<3>,8|H<1>}	C[5,6](N[5,5,6]Ga[5x5]C[5,6])(C[5]N[5,5]HH)(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>,2|N<3>,2|O<2>}	120.4810	0.000	1	120.4795	0.000	2	120.4795	0.000	2	120.4795	0.000	2	118.4758	5.375	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5]	Ga[4x5]	C[5]	6:3:2:	3:3:3:3:2:2:	3:3:3:	Ga[4x5]-6:C[5]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,5]-3:C[5,6]-3:C[6a]-3:	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C[6a])(N[5]C[5])	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[5](N[5,5]Ga[4x5]N[5])(C[5,6]N[5,6]C[6])(C[6a]C[6a]2)	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C[6a])(N[5]C[5]){1|N<2>,1|N<3>,8|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|H<1>,2|N<3>,6|C<3>}	C[5](N[5,5]Ga[4x5]N[5])(C[5,6]N[5,6]C[6])(C[6a]C[6a]2){2|N<3>,2|S<2>,3|H<1>,5|C<3>}	118.1565	0.131	2	118.1565	0.017	2	118.1565	0.017	2	118.1565	0.017	2	118.6680	0.470	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,5]	Ga[4x5]	C[5]	6:3:2:	3:3:3:3:2:2:	3:3:4:	Ga[4x5]-6:C[5]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,5]-3:C[5,6]-3:C-4:	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C)(N[5]C[5])	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[5](N[5,5]Ga[4x5]N[5])(C[5,6]N[5,6]C[6])(CH3)	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C)(N[5]C[5]){1|N<2>,1|N<3>,6|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|C<4>,2|H<1>,2|N<3>,4|C<3>}	C[5](N[5,5]Ga[4x5]N[5])(C[5,6]N[5,6]C[6])(CH3){1|H<1>,2|N<3>,2|S<2>,3|C<3>}	119.1795	0.589	2	119.1795	0.347	2	119.1795	0.347	2	119.1795	0.347	2	118.6680	0.470	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[3x5,6,6]	C[5,6]	6:3:3:	3:4:4:4:2:2:	3:4:3:	Ga[3x5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-4:N[5,6]-4:N[3x5]-4:O[6]-2:O[6]-2:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[3x5,6,6](N[5,6]C[5,6]C[6])(N[5,6]C[5]C[6]H)2(N[3x5]C[5]3)(O[6]C[6,6a])2	C[5,6](N[5,6]Ga[3x5,6,6]C[6])(C[5]N[3x5]HH)(C[6]C[6]H)	N[5,6](Ga[3x5,6,6]N[3x5]N[5,6]2O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,6|C<4>,6|H<1>}	Ga[3x5,6,6](N[5,6]C[5,6]C[6])(N[5,6]C[5]C[6]H)2(N[3x5]C[5]3)(O[6]C[6,6a])2{15|H<1>,6|C<3>}	C[5,6](N[5,6]Ga[3x5,6,6]C[6])(C[5]N[3x5]HH)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>,2|N<4>,2|O<2>}	114.0485	0.630	2	114.0485	0.397	2	114.0485	0.397	2	114.0485	0.397	2	114.0485	0.397	2	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[5,6]	3:6:3:	3:3:3:3:3:3:	3:3:3:	C[5,6]-3:Ga[3x5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:	N[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6]C[6])6	C[5,6](N[5,6]Ga[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[3x5]N[5,6]5)(C[6]C[6]H){11|C<3>,2|H<1>}	Ga[3x5](N[5,6]C[5,6]C[6])6{12|C<3>,6|H<1>}	C[5,6](N[5,6]Ga[3x5]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){3|C<3>,3|H<1>,4|N<3>}	114.2918	0.603	6	114.2918	0.364	6	114.2918	0.364	6	114.2918	0.364	6	114.2569	0.279	8	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[3x5]	C[5,6]	6:3:3:	3:3:4:4:1:1:	3:4:3:	Ga[3x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-4:N[5,5]-4:Cl-1:Cl-1:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[3x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]2H)2(Cl)2	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H)	N[5,6](Ga[3x5]N[5,5]2N[5,6]Cl2)(C[5,6]C[5]C[6])(C[6]C[6]H){3|C<3>,3|C<4>,6|H<1>}	Ga[3x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]2H)2(Cl)2{10|H<1>,4|C<3>}	C[5,6](N[5,6]Ga[3x5]C[6])(C[5]N[5,5]HH)(C[6]C[6]H){2|Cl<1>,1|C<3>,1|C<4>,1|N<3>,1|N<4>,3|H<1>}	114.1520	0.321	2	114.1520	0.103	2	114.1520	0.103	2	114.1520	0.103	2	114.2569	0.279	8	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[4x5]	C[5,6]	6:3:3:	3:3:3:3:2:2:	3:3:3:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,2|N<2>,6|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|C<4>,2|H<1>,2|N<3>,4|C<3>}	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C)(C[6]C[6]H){1|C<3>,1|N<2>,2|H<1>,2|N<3>,2|S<2>}	114.6350	0.585	2	114.6350	0.343	2	114.2248	0.591	4	114.2248	0.591	4	114.2248	0.591	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[4x5]	C[5,6]	6:3:3:	3:3:3:3:2:2:	3:3:3:	Ga[4x5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,6]-3:C[5]-3:C[6]-3:	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]H)	N[5,6](Ga[4x5]N[5,5]2N[5,6]S[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){2|H<1>,2|N<2>,7|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|H<1>,2|N<3>,6|C<3>}	C[5,6](N[5,6]Ga[4x5]C[6])(C[5]N[5,5]C[6a])(C[6]C[6]H){1|N<2>,2|H<1>,2|N<3>,2|S<2>,3|C<3>}	113.8145	0.870	2	113.8145	0.758	2	114.2248	0.591	4	114.2248	0.591	4	114.2248	0.591	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5,6,6]	C[5,6]	6:3:3:	3:3:3:3:2:2:	3:4:3:	Ga[5,5,6,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2	C[5,6](N[5,6]Ga[5,5,6,6]C[6])(C[5]N[5,6]HH)(C[6]C[6]H)	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(C[5,6]C[5]C[6])(C[6]C[6]H){1|C<4>,2|S<4>,4|H<1>,5|C<3>}	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2{4|O<1>,6|H<1>,8|C<3>}	C[5,6](N[5,6]Ga[5,5,6,6]C[6])(C[5]N[5,6]HH)(C[6]C[6]H){1|C<3>,1|S<4>,2|H<1>,2|N<3>,2|O<2>}	114.6885	0.473	2	114.6885	0.224	2	114.6885	0.224	2	114.6885	0.224	2	114.6885	0.224	2	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5,6]	C[5,6]	6:3:3:	3:3:3:3:2:2:	3:3:3:	Ga[5,5,6]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:	N[5,6]-3:C[5,6]-3:C[6]-3:	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5,6](N[5,6]C[5,6]C[6])4(O[6]C[6,6a])(O[6]C[6,6])	C[5,6](N[5,6]Ga[5,5,6]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H)	N[5,6](Ga[5,5,6]N[5,6]3O[6]2)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,9|C<3>}	Ga[5,5,6](N[5,6]C[5,6]C[6])4(O[6]C[6,6a])(O[6]C[6,6]){11|C<3>,4|H<1>}	C[5,6](N[5,6]Ga[5,5,6]C[6])(C[5,6]N[5,6]C[6])(C[6]C[6]H){2|N<3>,2|O<2>,3|C<3>,3|H<1>}	115.1805	1.287	4	115.1805	1.655	4	115.1805	1.655	4	115.1805	1.655	4	115.1805	1.655	4	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Br-1:Br-1:Br-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Br3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Br)3{2|H<1>,6|C<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){3|Br<1>,1|N<3>,3|C<3>,3|H<1>}	115.1070	0.020	2	115.1070	0.000	2	115.1070	0.000	2	115.4272	0.131	6	115.4272	0.131	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:Cl-1:Cl-1:Cl-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]Cl3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(Cl)3{2|H<1>,6|C<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){3|Cl<1>,1|N<3>,3|C<3>,3|H<1>}	115.4695	0.224	2	115.4695	0.050	2	115.4695	0.050	2	115.4272	0.131	6	115.4272	0.131	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5,5]	C[5,6]	6:3:3:	3:3:3:1:1:1:	3:3:3:	Ga[5,5]-6:C[5,6]-3:C[6]-3:	N[5,6]-3:N[5,6]-3:N[5,5,6]-3:F-1:F-1:F-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H)	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H)	N[5,6](Ga[5,5]N[5,5,6]N[5,6]F3)(C[5,6]C[5,6]C[6])(C[6]C[6]H){2|H<1>,5|C<3>}	Ga[5,5](N[5,6]C[5,6]C[6])2(N[5,5,6]C[5,6]2)(F)3{2|H<1>,6|C<3>}	C[5,6](C[5,6]N[5,5,6]C[6])(N[5,6]Ga[5,5]C[6])(C[6]C[6]H){1|N<3>,3|C<3>,3|F<1>,3|H<1>}	115.7050	0.494	2	115.7050	0.244	2	115.7050	0.244	2	115.4272	0.131	6	115.4272	0.131	6	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5]	C[5,6]	3:6:3:	3:3:3:1:1:1:	3:3:3:	C[5,6]-3:Ga[5]-6:C[6]-3:	N[5,6]-3:N[5,6]-3:O-3:F-1:F-1:F-1:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H)	Ga[5](N[5,6]C[5,6]C[6])2(OHH)(F)3	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5,6]C[6])(Ga[5]N[5,6]F3O)(C[6]C[6]H){2|H<1>,3|C<3>}	Ga[5](N[5,6]C[5,6]C[6])2(OHH)(F)3{2|H<1>,4|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ga[5]C[6])(C[6]C[6]H){1|O<3>,3|C<3>,3|F<1>,3|H<1>}	115.4255	0.716	2	115.4255	0.513	2	115.4255	0.513	2	115.4255	0.513	2	115.4255	0.513	2	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5,6]	Ga[5x5]	C[5,6]	6:3:3:	4:4:3:3:2:2:	3:4:3:	Ga[5x5]-6:C[5,6]-3:C[6]-3:	N[3x5]-4:N[3x5]-4:N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:	N[5,6]-3:C[5]-4:C[6]-3:	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H)	Ga[5x5](N[3x5]C[5,6]C[5]2)2(N[5,6]C[5,6]C[6])2(O[5]C[5])2	C[5,6](N[5,6]Ga[5x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]H)	N[5,6](Ga[5x5]N[3x5]2N[5,6]O[5]2)(C[5,6]C[5]C[6])(C[6]C[6]H){4|H<1>,5|C<3>,5|C<4>}	Ga[5x5](N[3x5]C[5,6]C[5]2)2(N[5,6]C[5,6]C[6])2(O[5]C[5])2{12|H<1>,2|C<4>,2|O<1>,4|C<3>}	C[5,6](N[5,6]Ga[5x5]C[6])(C[5]N[3x5]HH)(C[6]C[6]H){1|C<3>,1|N<3>,1|N<4>,2|C<4>,2|H<1>,2|O<2>}	111.9660	0.000	1	111.9660	0.000	1	111.9660	0.000	1	111.9660	0.000	1	111.9660	0.000	1	115.2222	6.077	53
542	578	818	5:SP2_SP2_SPD6	N[5]	Ga[3x5]	C[5,5]	3:6:3:	3:3:3:3:3:3:	3:3:3:	C[5,5]-3:Ga[3x5]-6:C[6a]-3:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5,6a]-3:C[5,5]-3:N[5]-3:	N[5](C[5,5]C[5,6a]C[5,5])(Ga[3x5]N[5]5)(C[6a]C[6a]2)	Ga[3x5](N[5]C[5,5]C[6a])6	C[5,5](C[5,6a]C[5,6a,6a]C[6a])(C[5,5]C[5,6a]N[5])(N[5]Ga[3x5]C[6a])	N[5](C[5,5]C[5,6a]C[5,5])(Ga[3x5]N[5]5)(C[6a]C[6a]2){14|C<3>,2|H<1>}	Ga[3x5](N[5]C[5,5]C[6a])6{18|C<3>}	C[5,5](C[5,6a]C[5,6a,6a]C[6a])(C[5,5]C[5,6a]N[5])(N[5]Ga[3x5]C[6a]){1|H<1>,4|N<3>,6|C<3>}	112.1206	0.438	10	112.1206	0.192	10	112.1206	0.192	10	112.1206	0.192	10	112.1206	0.192	10	115.2222	6.077	53
542	578	960	5:SP2_SP2_SPD6	N[5,5]	Ga[4x5]	N[5]	6:3:2:	3:3:3:3:2:2:	3:3:	Ga[4x5]-6:C[5]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,5]-3:C[5]-3:	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C)(N[5]C[5])	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	N[5](N[5,5]Ga[4x5]C[5])(C[5]S[5]N)	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C)(N[5]C[5]){1|N<2>,1|N<3>,6|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|C<4>,2|H<1>,2|N<3>,4|C<3>}	N[5](N[5,5]Ga[4x5]C[5])(C[5]S[5]N){1|C<3>,1|C<4>,1|S<2>,3|N<3>}	122.0520	0.441	2	122.0520	0.195	2	122.2097	0.099	4	122.2097	0.099	4	122.2097	0.099	4	122.2097	0.099	4
542	578	960	5:SP2_SP2_SPD6	N[5,5]	Ga[4x5]	N[5]	6:3:2:	3:3:3:3:2:2:	3:3:	Ga[4x5]-6:C[5]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:N[5,5]-3:N[5,5]-3:S[5]-2:S[5]-2:	N[5,5]-3:C[5]-3:	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C[6a])(N[5]C[5])	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2	N[5](N[5,5]Ga[4x5]C[5])(C[5]S[5]N)	N[5,5](Ga[4x5]N[5,5]N[5,6]2S[5]2)(C[5]C[5,6]C[6a])(N[5]C[5]){1|N<2>,1|N<3>,8|C<3>}	Ga[4x5](N[5,6]C[5,6]C[6])2(N[5,5]C[5]N[5])2(S[5]C[5])2{2|H<1>,2|N<3>,6|C<3>}	N[5](N[5,5]Ga[4x5]C[5])(C[5]S[5]N){1|S<2>,2|C<3>,3|N<3>}	122.3675	0.046	2	122.3675	0.002	2	122.2097	0.099	4	122.2097	0.099	4	122.2097	0.099	4	122.2097	0.099	4
542	578	961	6:SP3_SP3_SPD6	N[5,6]	Ga[5,5,6,6]	S[6]	6:4:4:	3:3:3:3:2:2:	3:3:1:1:	Ga[5,5,6,6]-6:S[6]-4:C[5]-4:	N[5,6]-3:N[5,6]-3:N[5,6]-3:N[5,6]-3:O[6]-2:O[6]-2:	N[5,6]-3:C[6,6a]-3:O-1:O-1:	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(S[6]C[6,6a]OO)(C[5]C[5,6]HH)	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2	S[6](N[5,6]Ga[5,5,6,6]C[5])(C[6,6a]C[6,6a]C[6a])(O)2	N[5,6](Ga[5,5,6,6]N[5,6]3O[6]2)(S[6]C[6,6a]OO)(C[5]C[5,6]HH){1|C<4>,1|S<4>,7|C<3>}	Ga[5,5,6,6](N[5,6]C[5,6]C[6])2(N[5,6]C[5]S[6])2(O[6]C[6,6a])2{4|O<1>,6|H<1>,8|C<3>}	S[6](N[5,6]Ga[5,5,6,6]C[5])(C[6,6a]C[6,6a]C[6a])(O)2{2|O<2>,3|C<3>,3|H<1>,3|N<3>}	120.4720	0.099	2	120.4720	0.010	2	120.4720	0.010	2	120.4720	0.010	2	120.4720	0.010	2	120.4720	0.010	2
542	594	643	0:SP2_SP-NON_SP2	N[5]	Ga[5]	C[6a]	3:3:2:	3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:Ga[5]-2:	N[5]-3:N[5]-3:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(Ga[5]N[5])	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5])	C[6a](N[5]C[5,6a]Ga[5])(C[6a]C[6a]C)2	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(Ga[5]N[5]){1|H<1>,2|C<4>,5|C<3>}	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5]){2|N<3>,4|C<3>}	C[6a](N[5]C[5,6a]Ga[5])(C[6a]C[6a]C)2{1|N<3>,2|H<1>,3|C<3>}	123.4400	0.000	1	123.4400	0.000	1	123.4400	0.000	1	123.4400	0.000	1	123.4400	0.000	1	123.4400	0.000	1
542	594	727	5:SP2_SP-NON_SP2	N[5]	Ga[5]	C[5,6a]	3:3:2:	3:3:	3:3:3:	C[5,6a]-3:C[5]-3:Ga[5]-2:	N[5]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]2)(Ga[5]N[5])	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5])	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Ga[5]C[5])(C[6a]C[6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]2)(Ga[5]N[5]){1|H<1>,2|C<4>,5|C<3>}	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5]){2|N<3>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5]Ga[5]C[5])(C[6a]C[6a]H){2|C<3>,2|H<1>,2|N<3>}	113.4240	0.000	1	113.4240	0.000	1	113.4240	0.000	1	115.4795	8.450	2	115.4795	8.450	2	115.4795	8.450	2
542	594	727	5:SP2_SP-NON_SP2	N[5]	Ga[5]	C[5,6a]	3:3:2:	3:3:	3:3:3:	C[5,6a]-3:C[6a]-3:Ga[5]-2:	N[5]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(Ga[5]N[5])	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5])	C[5,6a](C[5,6a]C[6a]N[5])(N[5]C[6a]Ga[5])(C[6a]C[6a]H)	N[5](C[5,6a]C[5,6a]C[6a])(C[6a]C[6a]2)(Ga[5]N[5]){1|H<1>,2|C<4>,5|C<3>}	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5]){2|N<3>,4|C<3>}	C[5,6a](C[5,6a]C[6a]N[5])(N[5]C[6a]Ga[5])(C[6a]C[6a]H){2|H<1>,4|C<3>}	117.5350	0.000	1	117.5350	0.000	1	117.5350	0.000	1	115.4795	8.450	2	115.4795	8.450	2	115.4795	8.450	2
542	594	818	0:SP2_SP-NON_SP2	N[5]	Ga[5]	C[5]	3:3:2:	3:3:	3:3:3:	C[5,6a]-3:C[5]-3:Ga[5]-2:	N[5]-3:N[5]-3:	N[5]-3:N[5]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]2)(Ga[5]N[5])	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5])	C[5](N[5]C[5,6a]Ga[5])(N[5]C[5]C)2	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]2)(Ga[5]N[5]){1|H<1>,2|C<4>,5|C<3>}	Ga[5](N[5]C[5,6a]C[6a])(N[5]C[5,6a]C[5]){2|N<3>,4|C<3>}	C[5](N[5]C[5,6a]Ga[5])(N[5]C[5]C)2{1|N<3>,2|C<3>,2|C<4>}	124.8070	0.000	1	124.8070	0.000	1	124.8070	0.000	1	124.8070	0.000	1	124.8070	0.000	1	124.8070	0.000	1
542	606	643	0:SP2_SP2_SP3	N[5]	Ge[5]	C[6a]	4:3:3:	3:3:1:1:	3:3:3:	Ge[5]-4:C[6a]-3:C[5]-3:	N[5]-3:N[5]-3:Cl-1:Cl-1:	N[5]-3:C[6a]-3:C[6a]-3:	N[5](Ge[5]N[5]Cl2)(C[6a]C[6a]2)(C[5]C[5]H)	Ge[5](N[5]C[6a]C[5])2(Cl)2	C[6a](N[5]Ge[5]C[5])(C[6a]C[6a]C)2	N[5](Ge[5]N[5]Cl2)(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,3|C<3>}	Ge[5](N[5]C[6a]C[5])2(Cl)2{2|H<1>,4|C<3>}	C[6a](N[5]Ge[5]C[5])(C[6a]C[6a]C)2{2|Cl<1>,1|N<3>,2|C<3>,3|H<1>}	129.5780	0.000	1	129.5780	0.000	1	129.5780	0.000	1	129.5780	0.000	1	129.5780	0.000	1	129.5780	0.000	1
542	606	727	5:SP2_SP2_SP3	N[5,6]	Ge[5,5,6]	C[5,6a]	4:3:4:	3:3:3:3:	3:3:3:	Ge[5,5,6]-4:C[5,6a]-3:C[6]-4:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	N[5,6]-3:C[5,6a]-3:C[6a]-3:	N[5,6](Ge[5,5,6]N[5,6]N[5]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]HH)	Ge[5,5,6](N[5,6]C[5,6a]C[6])2(N[5]C[5,6a]C)2	C[5,6a](N[5,6]Ge[5,5,6]C[6])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H)	N[5,6](Ge[5,5,6]N[5,6]N[5]2)(C[5,6a]C[5,6a]C[6a])(C[6]C[6]HH){1|H<1>,4|C<3>,5|C<4>}	Ge[5,5,6](N[5,6]C[5,6a]C[6])2(N[5]C[5,6a]C)2{1|C<4>,4|C<3>,4|H<1>}	C[5,6a](N[5,6]Ge[5,5,6]C[6])(C[5,6a]C[6a]N[5])(C[6a]C[6a]H){1|C<3>,2|C<4>,2|N<3>,4|H<1>}	110.3635	0.145	2	110.3635	0.021	2	110.3635	0.021	2	110.3635	0.021	2	110.3635	0.021	2	110.3615	0.136	4
542	606	727	5:SP2_SP2_SP3	N[5]	Ge[5,5,6]	C[5,6a]	4:3:4:	3:3:3:3:	3:3:3:	Ge[5,5,6]-4:C[5,6a]-3:C-4:	N[5,6]-3:N[5,6]-3:N[5]-3:N[5]-3:	C[5,6a]-3:N[5]-3:C[6a]-3:	N[5](Ge[5,5,6]N[5,6]2N[5])(C[5,6a]C[5,6a]C[6a])(CCHH)	Ge[5,5,6](N[5,6]C[5,6a]C[6])2(N[5]C[5,6a]C)2	C[5,6a](C[5,6a]N[5,6]C[6a])(N[5]Ge[5,5,6]C)(C[6a]C[6a]H)	N[5](Ge[5,5,6]N[5,6]2N[5])(C[5,6a]C[5,6a]C[6a])(CCHH){1|H<1>,3|C<4>,4|C<3>}	Ge[5,5,6](N[5,6]C[5,6a]C[6])2(N[5]C[5,6a]C)2{1|C<4>,4|C<3>,4|H<1>}	C[5,6a](C[5,6a]N[5,6]C[6a])(N[5]Ge[5,5,6]C)(C[6a]C[6a]H){1|C<3>,1|C<4>,2|H<1>,2|N<3>}	110.3595	0.622	2	110.3595	0.386	2	110.3595	0.386	2	110.3595	0.386	2	110.3595	0.386	2	110.3615	0.136	4
542	606	762	0:SP2_SP2_SP3	N[5,6]	Ge[5]	C[6]	3:4:3:	3:3:4:4:	3:3:1:	C[5,6]-3:Ge[5]-4:C[6]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	N[5,6]-3:C[6]-3:H-1:	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H)	Ge[5](N[5,6]C[5,6]C[6])2(CH3)2	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H){2|H<1>,3|C<3>}	Ge[5](N[5,6]C[5,6]C[6])2(CH3)2{2|H<1>,4|C<3>}	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	124.4895	0.682	2	124.4895	0.466	2	124.4895	0.466	2	124.4895	0.466	2	124.4895	0.466	2	124.4895	0.466	2
542	606	818	5:SP2_SP2_SP3	N[5,6]	Ge[5]	C[5,6]	3:4:3:	3:3:4:4:	3:3:3:	C[5,6]-3:Ge[5]-4:C[6]-3:	N[5,6]-3:N[5,6]-3:C-4:C-4:	C[5,6]-3:N[5,6]-3:C[6]-3:	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H)	Ge[5](N[5,6]C[5,6]C[6])2(CH3)2	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H)	N[5,6](C[5,6]C[5,6]C[6])(Ge[5]N[5,6]CC)(C[6]C[6]H){2|H<1>,3|C<3>}	Ge[5](N[5,6]C[5,6]C[6])2(CH3)2{2|H<1>,4|C<3>}	C[5,6](C[5,6]N[5,6]C[6])(N[5,6]Ge[5]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,3|H<1>}	114.9200	0.098	2	114.9200	0.010	2	114.9200	0.010	2	114.9200	0.010	2	114.9200	0.010	2	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:3:	3:3:1:1:	3:3:1:	Ge[5]-4:C[6a]-3:C[5]-3:	N[5]-3:N[5]-3:Cl-1:Cl-1:	N[5]-3:C[5]-3:H-1:	N[5](Ge[5]N[5]Cl2)(C[6a]C[6a]2)(C[5]C[5]H)	Ge[5](N[5]C[6a]C[5])2(Cl)2	C[5](N[5]C[6a]Ge[5])(C[5]N[5]H)(H)	N[5](Ge[5]N[5]Cl2)(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,2|C<4>,3|C<3>}	Ge[5](N[5]C[6a]C[5])2(Cl)2{2|H<1>,4|C<3>}	C[5](N[5]C[6a]Ge[5])(C[5]N[5]H)(H){2|Cl<1>,3|C<3>}	107.5710	0.000	1	107.5710	0.000	1	107.5710	0.000	1	107.5710	0.000	1	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:1:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:Br-1:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]BrS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(Br)(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]BrS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(Br)(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Br<1>,1|C<4>,1|S<1>}	113.9290	0.255	2	113.9290	0.065	2	113.9290	0.065	2	113.2952	0.858	6	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:1:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:Br-1:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]BrSe)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(Br)(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]BrSe)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(Br)(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Br<1>,1|Se<1>,1|C<4>}	113.8380	0.078	2	113.8380	0.006	2	113.8380	0.006	2	113.2952	0.858	6	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:1:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:F-1:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]FS)(C[5]C[5]C)(CC3)	Ge[5](N[5]C[5]C)2(F)(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]FS)(C[5]C[5]C)(CC3){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(F)(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|F<1>,1|S<1>}	112.1185	0.235	2	112.1185	0.055	2	112.1185	0.055	2	113.2952	0.858	6	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:Cl-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]ClO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OB)(Cl)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]ClO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OB)(Cl){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Cl<1>,1|C<4>,1|O<2>}	112.8505	0.107	2	112.8505	0.011	2	112.8505	0.011	2	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CC3)	Ge[5](N[5]C[5]C)2(OC)(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CC3){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OC)(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|O<2>,1|S<1>}	112.4190	0.065	2	112.4190	0.004	2	113.3257	1.762	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CC3)	Ge[5](N[5]C[5]C)2(OGe[5])(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CC3){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OGe[5])(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|O<2>,1|S<1>}	111.8875	0.491	2	111.8875	0.242	2	113.3257	1.762	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OSi)(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OSi)(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|O<2>,1|S<1>}	114.4982	0.520	4	114.4982	0.270	4	113.3257	1.762	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CC3)	Ge[5](N[5]C[5]C)2(OC)(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CC3){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OC)(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|O<2>}	111.9980	0.540	2	111.9980	0.292	2	113.1739	2.041	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CC3)	Ge[5](N[5]C[5]C)2(OGe[5])(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CC3){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OGe[5])(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|O<2>}	111.7310	0.321	2	111.7310	0.103	2	113.1739	2.041	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OC)(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OC)(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|O<2>}	114.4325	0.261	2	114.4325	0.068	2	113.1739	2.041	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OSi)(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OSi)(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|O<2>}	114.5340	0.173	2	114.5340	0.030	2	113.1739	2.041	8	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:S-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SC[6a])(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SC[6a])(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|S<1>,1|S<2>}	114.3785	0.443	2	114.3785	0.197	2	114.2308	0.124	6	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:S-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SGe[5])(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SGe[5])(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|S<1>,1|S<2>}	114.1570	0.345	4	114.1570	0.119	4	114.2308	0.124	6	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:S-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SC[6a])(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SC[6a])(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|S<2>}	114.2535	0.531	2	114.2535	0.282	2	114.2535	0.282	2	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:Se-2:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SeC[6a])(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SeC[6a])(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<2>,1|C<4>,1|S<1>}	114.1950	0.064	2	114.1950	0.004	2	114.1950	0.004	2	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:Se-2:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]Se2)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SeC[6a])(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]Se2)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SeC[6a])(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|Se<2>,1|C<4>}	114.4280	0.249	2	114.4280	0.062	2	114.4280	0.062	2	113.6279	1.244	30	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:C-2:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]CO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(CC)(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]CO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(CC)(OB){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<2>,1|C<4>,1|O<2>}	113.0690	0.232	2	113.0690	0.054	2	113.0690	0.054	2	112.7628	0.550	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OB)(OC)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OB)(OC){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,2|O<2>}	112.3658	0.529	4	112.3658	0.279	4	112.2982	0.199	6	112.7628	0.550	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:O-2:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(OSi)(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(OSi)(OB){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,2|O<2>}	112.1630	0.317	2	112.1630	0.100	2	112.2982	0.199	6	112.7628	0.550	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:2:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:S-2:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(SC[6a])(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]OS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(SC[6a])(OB){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|O<2>,1|S<2>}	113.8505	0.233	2	113.8505	0.054	2	113.8505	0.054	2	112.7628	0.550	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	C[6a]-3:N[5]-3:N[5]-3:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]C[6a]N[5]S)(C[5]C[5]C)(CC3)	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]C[6a]N[5]S)(C[5]C[5]C)(CC3){1|C<4>,3|C<3>}	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(S){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<3>,1|C<4>,1|S<1>}	112.2650	0.628	2	112.2650	0.394	2	112.2650	0.394	2	113.7345	2.029	12	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	C[6a]-3:N[5]-3:N[5]-3:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]C[6a]N[5]Se)(C[5]C[5]C)(CC3)	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]C[6a]N[5]Se)(C[5]C[5]C)(CC3){1|C<4>,3|C<3>}	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(Se){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<3>,1|C<4>}	111.5595	0.045	2	111.5595	0.002	2	111.5595	0.002	2	113.7345	2.029	12	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:N-3:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]NS)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(NSi2)(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]NS)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(NSi2)(S){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|N<3>,1|S<1>}	114.8625	0.286	2	114.8625	0.082	2	114.8625	0.082	2	113.7345	2.029	12	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:N-3:Se-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeN)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(NSi2)(Se)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeN)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(NSi2)(Se){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<1>,1|C<4>,1|N<3>}	115.0170	0.041	2	115.0170	0.002	2	115.0170	0.002	2	113.7345	2.029	12	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:1:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5a]-3:N[5]-3:N[5]-3:S-1:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5a]N[5]S)(C[5]C[5]C)(CCHH)	Ge[5](N[5a]C[5a]2)(N[5]C[5]C)2(S)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5a]N[5]S)(C[5]C[5]C)(CCHH){1|C<4>,3|C<3>}	Ge[5](N[5a]C[5a]2)(N[5]C[5]C)2(S){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|N<3>,1|S<1>}	114.3515	0.485	4	114.3515	0.236	4	114.3515	0.236	4	113.7345	2.029	12	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	C[6a]-3:N[5]-3:N[5]-3:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]C[6a]N[5]O)(C[5]C[5]C)(CCHH)	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]C[6a]N[5]O)(C[5]C[5]C)(CCHH){1|C<4>,3|C<3>}	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(OB){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<3>,1|C<4>,1|O<2>}	113.2195	0.450	2	113.2195	0.203	2	113.2195	0.203	2	112.6170	0.497	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	C[6a]-3:N[5]-3:N[5]-3:S-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]C[6a]N[5]S)(C[5]C[5]C)(CC3)	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(SAg)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]C[6a]N[5]S)(C[5]C[5]C)(CC3){1|C<4>,3|C<3>}	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(SAg){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<3>,1|C<4>,1|S<2>}	112.1120	0.853	2	112.1120	0.727	2	112.1120	0.727	2	112.6170	0.497	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	C[6a]-3:N[5]-3:N[5]-3:Se-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]C[6a]N[5]Se)(C[5]C[5]C)(CC3)	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(SeAg)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]C[6a]N[5]Se)(C[5]C[5]C)(CC3){1|C<4>,3|C<3>}	Ge[5](C[6a]C[6a]2)(N[5]C[5]C)2(SeAg){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<2>,1|C<3>,1|C<4>}	112.5205	0.224	2	112.5205	0.050	2	112.5205	0.050	2	112.6170	0.497	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:N-3:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]NO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(NSiB)(OSi)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]NO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(NSiB)(OSi){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|N<3>,1|O<2>}	113.1515	0.542	2	113.1515	0.294	2	113.1515	0.294	2	112.6170	0.497	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:3:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5a]-3:N[5]-3:N[5]-3:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5a]N[5]O)(C[5]C[5]C)(CCHH)	Ge[5](N[5a]C[5a]2)(N[5]C[5]C)2(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5a]N[5]O)(C[5]C[5]C)(CCHH){1|C<4>,3|C<3>}	Ge[5](N[5a]C[5a]2)(N[5]C[5]C)2(OB){2|H<1>,4|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|C<4>,1|N<3>,1|O<2>}	112.0815	0.893	2	112.0815	0.798	2	112.0815	0.798	2	112.6170	0.497	10	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:4:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:C-4:O-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]CO)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(CH3)(OB)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]CO)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(CH3)(OB){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|O<2>,2|C<4>}	113.4925	0.537	2	113.4925	0.288	2	113.4925	0.288	2	113.7960	0.411	4	113.2873	1.669	73	113.3309	1.694	75
542	606	818	5:SP2_SP2_SP3	N[5]	Ge[5]	C[5]	4:3:4:	3:3:4:2:	3:3:3:	Ge[5]-4:C[5]-3:C-4:	N[5]-3:N[5]-3:C-4:Se-2:	N[5]-3:C[5]-3:C-3:	N[5](Ge[5]N[5]SeC)(C[5]C[5]C)(CCHH)	Ge[5](N[5]C[5]C)2(CCCH)(SeZn)	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH)	N[5](Ge[5]N[5]SeC)(C[5]C[5]C)(CCHH){1|C<3>,1|C<4>}	Ge[5](N[5]C[5]C)2(CCCH)(SeZn){2|C<3>}	C[5](N[5]Ge[5]C)(C[5]N[5]C)(CCH){1|Se<2>,2|C<4>}	114.0995	0.759	2	114.0995	0.576	2	114.0995	0.576	2	113.7960	0.411	4	113.2873	1.669	73	113.3309	1.694	75
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:1:1:1:	3:3:3:	C[5,6a]-3:N[5]-2:B-4:	N[5]-3:H-1:H-1:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(BH3)	B(N[5]C[5,6a]N[5])(H)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5])(BH3){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]N[5])(H)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]N[5]B){1|C<3>,1|C<4>,2|H<1>}	127.7700	0.000	1	127.7700	0.000	1	127.7700	0.000	1	128.6852	0.715	5	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:1:1:1:	3:3:3:	C[5,6a]-3:Se[5]-2:B-4:	N[5]-3:Br-1:Br-1:Br-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BBr3)	B(N[5]C[5,6a]Se[5])(Br)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BBr3){1|H<1>,2|C<3>}	B(N[5]C[5,6a]Se[5])(Br)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	129.5020	0.000	1	129.5020	0.000	1	129.5020	0.000	1	128.6852	0.715	5	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:1:1:1:	3:3:3:	C[5,6a]-3:Se[5]-2:B-4:	N[5]-3:Cl-1:Cl-1:Cl-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3)	B(N[5]C[5,6a]Se[5])(Cl)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3){1|B<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]Se[5])(Cl)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|B<4>,1|C<3>,2|H<1>}	129.3910	0.000	1	128.5960	1.264	2	128.5960	1.264	2	128.6852	0.715	5	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:1:1:1:	3:3:3:	C[5,6a]-3:Se[5]-2:B-4:	N[5]-3:Cl-1:Cl-1:Cl-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3)	B(N[5]C[5,6a]Se[5])(Cl)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BCl3){1|H<1>,2|C<3>}	B(N[5]C[5,6a]Se[5])(Cl)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	127.8010	0.000	1	128.5960	1.264	2	128.5960	1.264	2	128.6852	0.715	5	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:1:1:1:	3:3:3:	C[5,6a]-3:Se[5]-2:B-4:	N[5]-3:F-1:F-1:F-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BF3)	B(N[5]C[5,6a]Se[5])(F)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BF3){1|H<1>,2|C<3>}	B(N[5]C[5,6a]Se[5])(F)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	128.9620	0.000	1	128.9620	0.000	1	128.9620	0.000	1	128.6852	0.715	5	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:S[5]-2:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(S[5]N[5])(BC[6a]3)	B(N[5]C[5,6a]S[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]S[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(S[5]N[5])(BC[6a]3){1|H<1>,2|C<3>}	B(N[5]C[5,6a]S[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]S[5]B){1|Br<1>,1|C<3>,1|H<1>}	126.6140	0.000	1	126.6140	0.000	1	126.6140	0.000	1	128.8545	10.040	2	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:2:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:Se[5]-2:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BC[6a]3)	B(N[5]C[5,6a]Se[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(Se[5]N[5])(BC[6a]3){1|H<1>,2|C<3>}	B(N[5]C[5,6a]Se[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]Se[5]B){1|C<3>,2|H<1>}	131.0950	0.000	1	131.0950	0.000	1	131.0950	0.000	1	128.8545	10.040	2	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:2:1:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:F-2:F-1:F-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BF3)	B(N[5]C[5,6a]C[5])(FLi)(F)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BF3){1|B<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(FLi)(F)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|B<4>,1|C<3>,3|H<1>}	127.5995	0.530	2	127.5995	0.281	2	127.5995	0.281	2	127.5995	0.281	2	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:1:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	127.8992	1.248	4	127.8992	1.558	4	125.6538	7.946	8	125.6538	7.946	8	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:1:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]HH){2|C<3>,2|H<1>}	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|S<2>,3|H<1>}	124.9160	1.148	2	124.9160	1.319	2	125.6538	7.946	8	125.6538	7.946	8	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:1:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]HH){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])2(H)2	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|S<2>,2|H<1>}	121.9005	0.441	2	121.9005	0.194	2	125.6538	7.946	8	125.6538	7.946	8	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Ni)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]Ni)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|Ni<4>,1|C<3>,1|C<4>,2|H<1>}	130.6084	0.403	11	130.6084	0.162	11	123.4993	32.594	30	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	123.9090	0.000	1	123.9090	0.000	1	123.4993	32.594	30	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,1|S<1>,2|H<1>}	118.9617	0.939	6	119.9122	1.807	12	123.4993	32.594	30	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	120.8627	0.962	6	119.9122	1.807	12	123.4993	32.594	30	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5,6a](C[5,6a]C[6a]S[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|S<2>,2|H<1>}	117.5722	0.700	6	117.5722	0.490	6	123.4993	32.594	30	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Cu)(BN[5]2H)	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(N[5]N[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Cu)(BN[5]2H){1|C<4>,1|F<1>,2|C<3>}	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(N[5]N[5]B){1|Cu<4>,1|C<3>,1|C<4>,2|F<1>}	129.6353	0.484	3	129.6353	0.234	3	130.3894	2.609	18	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Fe)(BN[5]2H)	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]N[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Fe)(BN[5]2H){2|C<3>,2|H<1>}	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]N[5]B){1|Fe<6>,1|C<3>,3|H<1>}	133.5710	0.716	3	133.5710	0.513	3	130.3894	2.609	18	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Mg)(BN[5]2H)	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(N[5]N[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Mg)(BN[5]2H){1|F<1>,3|C<3>}	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]F)(N[5]N[5]B){1|Mg<4>,2|C<3>,2|F<1>}	129.5908	0.699	9	129.5908	0.488	9	130.3894	2.609	18	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:1:	3:3:3:	C[5,6a]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Rh)(BN[5]2H)	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]N[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(N[5]C[5]Rh)(BN[5]2H){2|C<3>,2|H<1>}	B(N[5]C[5,6a]N[5])3(H)	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]N[5]B){1|Rh<9>,1|C<3>,3|H<1>}	130.3577	0.755	3	130.3577	0.570	3	130.3894	2.609	18	126.0831	32.418	48	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(BC[6a]3){2|C<3>,3|H<1>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]C[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,5|H<1>}	124.6240	0.000	1	124.6240	0.000	1	121.3987	15.579	7	121.3987	15.579	7	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]N[5])(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]N[5])(BC[6a]3){1|B<4>,1|H<1>,4|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|B<4>,2|C<3>,2|H<1>}	118.3208	0.971	4	118.3208	0.942	4	121.3987	15.579	7	121.3987	15.579	7	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]3){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,3|H<1>}	125.9420	1.032	2	125.9420	1.066	2	121.3987	15.579	7	121.3987	15.579	7	125.9034	26.317	73	125.9034	26.317	73
542	610	727	0:SP2_SP2_SP3	N[5]	B	C[5,6a]	3:3:4:	3:3:3:4:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C-4:	C[5,6a]-3:C[6a]-3:N[5]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]2C)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]2C){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CCHH)	C[5,6a](C[5,6a]C[6a]N[5])(C[6a]C[6a]H)(N[5]C[5]B){1|C<3>,1|C<4>,3|H<1>}	127.6060	0.000	1	127.6060	0.000	1	127.6060	0.000	1	127.6060	0.000	1	125.9034	26.317	73	125.9034	26.317	73
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5,5]	3:3:4:	3:3:3:1:	3:4:3:	C[5,5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5,5]-3:C[5]-4:N[5]-3:	N[5](C[5,5]C[5,5]C[5])(N[5]C[5]Co)(BN[5]2H)	B(N[5]C[5,5]N[5])3(H)	C[5,5](C[5,5]C[5]2)(C[5]C[5]HH)(N[5]N[5]B)	N[5](C[5,5]C[5,5]C[5])(N[5]C[5]Co)(BN[5]2H){2|H<1>,3|C<4>}	B(N[5]C[5,5]N[5])3(H)	C[5,5](C[5,5]C[5]2)(C[5]C[5]HH)(N[5]N[5]B){1|Co<6>,1|C<4>,4|H<1>}	130.3380	0.828	3	130.3380	0.686	3	130.3380	0.686	3	130.3380	0.686	3	130.3380	0.686	3	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:1:1:	3:3:1:	C[5]-3:N[5]-2:B-4:	N[5]-3:C[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5]N[5]S)(N[5]N[5])(BC[5]HH)	B(N[5]C[5]N[5])(C[5]N[5]2)(H)2	C[5](N[5]C[6a]N[5])(N[5]N[5]B)(S)	N[5](C[5]N[5]S)(N[5]N[5])(BC[5]HH){1|C<3>}	B(N[5]C[5]N[5])(C[5]N[5]2)(H)2	C[5](N[5]C[6a]N[5])(N[5]N[5]B)(S){2|C<3>}	128.2430	0.000	1	128.2430	0.000	1	128.2430	0.000	1	128.2430	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:1:1:	3:3:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](N[5]C[5]C)(N[5]N[5]B)(SRh)	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]HH){2|C<4>}	B(N[5]C[5]N[5])2(H)2	C[5](N[5]C[5]C)(N[5]N[5]B)(SRh){1|C<4>}	129.2935	2.019	2	129.2935	4.076	2	129.2935	4.076	2	129.2935	4.076	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:2:1:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-1:	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(S)	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(S){1|C<4>}	123.8083	1.712	4	124.0259	1.637	7	124.0259	1.637	7	124.0259	1.637	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:2:1:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-1:	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(S)	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(S){1|H<1>}	124.3160	0.540	3	124.0259	1.637	7	124.0259	1.637	7	124.0259	1.637	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:2:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(SBi)	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(SBi){1|C<4>}	128.1150	4.004	7	128.1150	16.036	7	127.4754	17.018	8	127.4754	17.018	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:2:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(SFe)	N[5](C[5]S[5]S)(N[5]C[5])(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(S[5]C[5])(SFe){1|C<4>}	122.9980	0.000	1	122.9980	0.000	1	127.4754	17.018	8	127.4754	17.018	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(S)	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(S){1|C<4>}	127.4360	1.661	6	127.4360	2.759	6	127.4360	2.759	6	127.4360	2.759	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:3:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(SRh)	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(SRh){1|C<4>}	130.4469	3.646	13	130.4469	13.296	13	131.4793	11.455	19	131.4793	11.455	19	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:3:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(SSn)	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[5]C)(N[5]N[5]B)(SSn){1|C<4>}	133.1857	0.397	3	133.1857	0.158	3	131.4793	11.455	19	131.4793	11.455	19	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:1:	3:3:2:	C[5]-3:N[5]-2:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[6a]C[5])(N[5]N[5]B)(SCu)	N[5](C[5]N[5]S)(N[5]C[5])(BN[5]2H){1|C<3>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]C[6a]C[5])(N[5]N[5]B)(SCu){1|C<4>,2|C<3>}	134.2463	0.616	3	134.2463	0.379	3	131.4793	11.455	19	131.4793	11.455	19	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:3:	3:2:1:	C[5]-3:C[5]-2:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	N[5]-3:N[5]-2:H-1:	N[5](C[5]N[5]H)(C[5]C[5])(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5])(H)	N[5](C[5]N[5]H)(C[5]C[5])(BN[5a]3){1|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5])(H){1|H<1>}	127.7180	0.000	1	127.7180	0.000	1	127.7180	0.000	1	127.7180	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:2:4:	3:3:3:3:	3:3:1:	C[5]-3:N[5]-2:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]H)(N[5]C[5])(BC[6a]3)	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](N[5]C[6a]C[5])(N[5]N[5]B)(H)	N[5](C[5]N[5]H)(N[5]C[5])(BC[6a]3){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](N[5]C[6a]C[5])(N[5]N[5]B)(H){1|H<1>,2|C<3>}	129.7890	0.000	1	129.7890	0.000	1	129.7890	0.000	1	129.7890	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:1:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:Cl-1:Cl-1:Cl-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BCl3)	B(N[5]C[5]2)(Cl)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BCl3){2|H<1>}	B(N[5]C[5]2)(Cl)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){2|H<1>}	125.6320	0.000	1	125.6320	0.000	1	125.6320	0.000	1	126.2760	0.829	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:1:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:Cl-1:Cl-1:Cl-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BCl3)	B(N[5]C[5]2)(Cl)3	C[5](N[5]C[5]B)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BCl3){2|H<1>}	B(N[5]C[5]2)(Cl)3	C[5](N[5]C[5]B)(N[5]C[5]H)(H){2|H<1>}	126.9200	0.000	1	126.9200	0.000	1	126.9200	0.000	1	126.2760	0.829	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:2:1:1:	3:3:1:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:F-2:F-1:F-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BF3)	B(N[5]C[5,6a]C[5])(FLi)(F)2	C[5](N[5]C[5,6a]B)2(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BF3){1|B<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(FLi)(F)2	C[5](N[5]C[5,6a]B)2(H){2|C<3>}	126.0345	0.332	2	126.0345	0.110	2	126.0345	0.110	2	126.0345	0.110	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Cu)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Cu)(C[5]N[5]H)(BN[5]HH){1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Cu<4>,1|H<1>}	129.7130	0.719	4	129.7130	0.517	4	129.9351	1.120	8	129.9351	1.120	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Ru)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Ru)(C[5]N[5]H)(BN[5]HH){1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Ru<6>,1|H<1>}	129.0365	0.711	2	130.1573	1.965	4	129.9351	1.120	8	129.9351	1.120	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Ru)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Ru)(C[5]N[5]H)(BN[5]HH){1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Ru<9>,1|H<1>}	131.2780	0.604	2	130.1573	1.965	4	129.9351	1.120	8	129.9351	1.120	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:2:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SRu)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]HH){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SRu){2|C<3>}	124.6870	1.144	2	124.6870	1.309	2	124.6870	1.309	2	125.4479	3.562	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:2:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5]C[5]C)(C[5]S[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(S[5]C[5])(SBi)	N[5](C[5]C[5]C)(C[5]S[5]S)(BN[5]HH){1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(S[5]C[5])(SBi){1|C<4>,1|H<1>}	125.7015	2.102	6	125.7015	4.416	6	125.7015	4.416	6	125.4479	3.562	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:F-1:F-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(BN[5]FF)	B(N[5]C[5]2)2(F)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(BN[5]FF){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(F)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Rh<4>,1|C<4>}	125.7905	0.603	2	125.7905	0.364	2	125.7905	0.364	2	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|Ag<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ag<4>,1|H<1>}	126.4160	1.902	2	126.8657	0.818	9	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|H<1>}	127.2807	0.532	3	126.8657	0.818	9	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	126.7792	0.686	4	126.8657	0.818	9	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|O<2>}	127.1942	0.425	4	126.0074	1.903	8	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|O<3>}	124.8205	0.709	4	126.0074	1.903	8	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<1>}	124.2554	1.628	5	122.9783	1.503	51	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	122.8395	1.110	46	122.9783	1.503	51	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<4>,1|C<4>}	120.9821	1.754	17	120.9821	3.078	17	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Ir)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Ir)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ir<4>,1|C<4>}	126.6660	0.847	2	126.6660	0.718	2	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Li)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Li)(C[5]C[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Li<3>,1|C<3>}	126.6230	0.000	1	126.6230	0.000	1	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Ni)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Ni)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ni<4>,1|C<4>}	127.6560	0.272	2	127.6560	0.074	2	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Rh)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Rh)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Rh<4>,1|C<4>}	126.5515	0.859	2	126.5515	0.738	2	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Se<2>,1|C<4>}	122.9513	0.678	4	122.9513	0.459	4	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Ta)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Ta)(C[5]C[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ta<7>,1|C<3>}	124.8140	1.512	4	124.8140	2.287	4	123.5787	5.236	100	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]C)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]C)(C[5]N[5]H)(BN[5]HH){2|C<4>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|C<4>}	123.8760	0.123	2	123.8760	0.015	2	126.0980	3.182	11	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]Ag)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|Ag<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]Ag)(N[5]C[5]B)(H){2|H<1>}	128.7785	1.720	2	128.7785	2.960	2	126.0980	3.182	11	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	126.5058	0.712	4	126.5058	0.507	4	126.0980	3.182	11	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H){2|C<3>,2|H<1>}	125.2487	0.356	3	125.2487	0.127	3	126.0980	3.182	11	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(S)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(S){2|H<1>}	127.7124	1.293	5	127.7124	1.673	5	127.7124	1.673	5	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|W<8>}	127.6390	0.069	2	127.6390	0.005	2	127.6390	0.005	2	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:F-1:F-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]FF)	B(N[5]C[5]N[5])2(F)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]FF){2|H<1>}	B(N[5]C[5]N[5])2(F)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	125.5295	0.047	2	125.5295	0.002	2	125.5295	0.002	2	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]HH){1|H<1>,1|N<3>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|N<3>}	127.7025	0.097	2	128.7877	0.871	6	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|H<1>}	129.3303	0.520	4	128.7877	0.871	6	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|C<3>}	130.0470	0.215	2	127.8554	1.471	66	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	127.7869	1.166	64	127.8554	1.471	66	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mg)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mg)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mg<5>,1|H<1>}	130.9959	1.189	8	130.9959	1.413	8	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<8>,1|H<1>}	126.8975	1.028	4	126.8975	1.058	4	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<5>,1|H<1>}	134.4390	0.000	1	134.4390	0.000	1	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Pt)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Pt)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pt<4>,1|H<1>}	129.0480	0.209	2	129.0480	0.044	2	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	128.6913	0.827	6	128.6913	0.684	6	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]C)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]HH){1|C<2>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]C)(N[5]N[5]B)(H){1|Rh<6>,1|H<1>}	129.9290	0.031	2	129.9290	0.001	2	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	127.2952	0.831	6	127.2952	0.691	6	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zr)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zr)(C[5]C[5]H)(BN[5]HH){2|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zr<11>,1|H<1>}	129.4040	0.238	2	129.4040	0.056	2	128.2899	2.490	103	126.0235	8.742	225	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:O-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(OGa)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(OGa){2|C<3>}	125.2482	1.226	4	125.2482	1.504	4	125.2482	1.504	4	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]H)(SBi)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]HH){2|C<3>,2|H<1>}	B(N[5]C[5,6a]C[5])2(H)2	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]H)(SBi){2|C<3>}	127.7085	0.995	2	127.7085	0.990	2	127.7085	0.990	2	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:O-2:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(OLi)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(OLi){2|H<1>}	125.0475	0.369	4	125.0475	0.136	4	125.0475	0.136	4	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SAl)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SAl){2|H<1>}	129.7533	0.436	3	129.7533	0.190	3	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SC)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SC){2|H<1>}	127.6230	0.646	2	127.6230	0.418	2	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SCd)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SCd){2|H<1>}	128.9430	1.025	4	128.9430	1.051	4	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SGa)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SGa){2|H<1>}	129.3300	0.691	9	129.3300	0.477	9	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SHg)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SHg){2|H<1>}	129.8582	0.790	4	129.8582	0.624	4	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn){2|H<1>}	129.4840	0.726	10	129.4840	0.528	10	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn[4])	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn[4]){2|H<1>}	129.6013	0.861	3	129.6013	0.742	3	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe){2|H<1>}	130.7054	3.276	5	130.7054	10.734	5	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn){2|H<1>}	129.3637	0.458	4	129.3637	0.210	4	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SZr)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SZr){2|H<1>}	129.5605	2.739	2	129.5605	7.500	2	129.5093	1.857	46	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SeZn)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(SeZn){2|H<1>}	129.7742	0.584	4	129.7742	0.341	4	129.7742	0.341	4	128.8854	3.833	60	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:3:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:O-3:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(OLi2)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](N[5]C[5]B)(N[5]C[5]C)(OLi2){2|H<1>}	127.4465	0.677	4	127.4465	0.458	4	127.4465	0.458	4	127.4465	0.458	4	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(C[5]N[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]C)(N[5]C[5]B)(CH3)	N[5](C[5]C[5]C)(C[5]N[5]H)(BN[5]HH){2|C<4>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]C)(N[5]C[5]B)(CH3){1|C<4>,1|H<1>}	128.3540	0.626	2	128.3540	0.392	2	122.8935	15.115	8	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(C[5]S[5]S)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]S[5]H)(N[5]C[5]B)(CH3)	N[5](C[5]C[5]C)(C[5]S[5]S)(BN[5]HH){1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]S[5]H)(N[5]C[5]B)(CH3){1|S<2>}	121.0733	2.276	6	121.0733	5.180	6	122.8935	15.115	8	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5a]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5a]HH)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3)	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5a]HH){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3){1|C<4>,1|H<1>}	133.5700	0.000	1	133.5700	0.000	1	133.5700	0.000	1	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Co<4>,1|C<4>}	131.7450	0.214	4	131.7450	0.046	4	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Cr<4>,1|C<4>}	134.4605	0.262	2	133.6450	0.910	4	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Cr<5>,1|C<4>}	132.8295	0.043	2	133.6450	0.910	4	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<6>,1|C<4>}	126.9700	0.304	2	126.9700	0.092	2	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<5>,1|C<4>}	133.8080	0.000	1	133.8080	0.000	1	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pt<4>,1|C<4>}	132.8745	1.961	2	132.8745	3.845	2	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:1:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]HH)	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(H)2	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<4>,1|C<4>}	132.7920	2.496	2	132.7920	6.230	2	132.0427	5.768	15	129.0566	28.024	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HAg)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HAg)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	122.1393	0.624	4	122.1393	0.389	4	122.9710	1.503	8	122.9710	1.503	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HMo)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HMo)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	123.7675	1.002	2	123.7675	1.004	2	122.9710	1.503	8	122.9710	1.503	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HRh)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HRh)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	123.8380	1.676	2	123.8380	2.808	2	122.9710	1.503	8	122.9710	1.503	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HAg)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SAg)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HAg)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SAg){2|H<1>}	130.7030	0.786	4	130.7030	0.617	4	129.4582	2.938	8	129.4582	2.938	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HMo)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMo)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HMo)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMo){2|H<1>}	128.2020	1.566	2	128.2020	2.451	2	129.4582	2.938	8	129.4582	2.938	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:2:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HRh)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]HH){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(HRh)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh){2|H<1>}	128.2250	1.967	2	128.2250	3.870	2	129.4582	2.938	8	129.4582	2.938	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H){1|Mo<7>,1|H<1>}	129.2550	0.000	1	129.2550	0.000	1	129.9938	1.461	4	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H){1|Re<7>,1|H<1>}	131.0110	0.298	2	131.0110	0.089	2	129.9938	1.461	4	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(H){1|Ru<6>,1|H<1>}	128.6980	0.000	1	128.6980	0.000	1	129.9938	1.461	4	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Cu)(C[5]N[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Cu)(C[5]N[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Cu<4>,1|H<1>}	131.0262	0.480	6	131.0262	0.230	6	131.9766	1.501	14	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Fe)(C[5]N[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Fe)(C[5]N[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Fe<6>,1|H<1>}	133.9977	0.273	3	133.9977	0.074	3	131.9766	1.501	14	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:H-1:	N[5](N[5]C[5]Ni)(C[5]N[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H)	N[5](N[5]C[5]Ni)(C[5]N[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(H){1|Ni<6>,1|H<1>}	131.9044	0.359	5	131.9044	0.129	5	131.9766	1.501	14	131.5359	2.125	18	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SBi)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SBi){2|C<3>}	128.9457	1.354	3	128.9457	1.832	3	128.7368	0.857	6	128.7368	0.857	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SHg)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]S[5]S)(BN[5]2H){1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(S[5]C[5,6a])(SHg){2|C<3>}	128.5280	0.425	3	128.5280	0.180	3	128.7368	0.857	6	128.7368	0.857	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(C[5]C[5])(CH3){1|Ni<7>,1|C<4>}	132.0820	0.000	1	132.0820	0.000	1	132.0820	0.000	1	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Co)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Co)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Co<6>,1|C<3>}	130.1595	0.013	2	130.1595	0.000	2	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Cu)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CF3)	N[5](N[5]C[5]Cu)(C[5]N[5]C)(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CF3){1|Cu<4>,1|C<4>}	132.3783	0.974	3	132.3783	0.948	3	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Fe)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Fe)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Fe<6>,1|C<3>}	130.2710	0.011	2	130.2710	0.000	2	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Mn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Mn)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Mn<6>,1|C<3>}	130.0805	0.012	2	130.0805	0.000	2	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Ni)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Ni)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Ni<5>,1|C<3>}	131.0147	0.423	3	130.0884	1.086	10	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Ni)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Ni)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Ni<6>,1|C<3>}	129.6914	0.978	7	130.0884	1.086	10	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CC3)	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CC3){1|Zn<4>,1|C<4>}	135.0610	0.000	1	135.0610	0.000	1	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Zn<4>,1|C<3>}	131.6120	1.306	6	130.6754	0.973	30	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Zn<5>,1|C<3>}	130.7457	0.576	3	130.6754	0.973	30	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H){1|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Zn<6>,1|C<3>}	130.3785	0.011	4	130.6754	0.973	30	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:2:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](N[5]C[5]Zn)(C[5]N[5]C)(BN[5]2H){1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Zn<4>,1|C<4>}	130.4023	0.871	17	130.6754	0.973	30	130.6873	1.486	50	130.7146	1.495	51	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(S)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(S){2|C<3>}	132.8178	0.937	6	132.8178	0.877	6	132.8178	0.877	6	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:Cl-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2Cl)	B(N[5]C[5]2)3(Cl)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2Cl){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(Cl)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	120.8445	0.019	2	120.8445	0.000	2	120.8445	0.000	2	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:F-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F)	B(N[5]C[5]2)3(F)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(F)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	120.0437	1.051	9	120.0437	1.105	9	120.0437	1.105	9	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|O<2>}	123.5057	0.013	3	123.5057	0.000	3	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|S<1>}	119.0128	0.856	6	119.6801	6.801	265	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|S<2>}	119.3479	2.235	49	119.6801	6.801	265	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<1>}	123.6538	3.517	20	119.6801	6.801	265	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	119.3686	2.271	190	119.6801	6.801	265	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	120.0658	2.938	6	120.0658	8.635	6	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	118.6812	1.150	9	118.6812	1.324	9	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Ca)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Ca)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ca<5>,1|C<4>}	122.2587	0.346	3	122.2587	0.120	3	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Se<2>,1|C<3>}	118.1639	1.142	10	118.4951	1.026	16	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Se<2>,1|C<4>}	119.0472	0.383	6	118.4951	1.026	16	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Sr)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Sr)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Sr<7>,1|C<4>}	120.7260	0.209	3	120.7260	0.044	3	119.6693	6.462	305	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(S)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(S){2|H<1>}	127.8534	3.664	20	127.8534	13.422	20	128.9388	14.421	26	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(S)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(S){2|C<3>,2|H<1>}	132.5572	0.823	6	132.5572	0.677	6	128.9388	14.421	26	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:Br-1:	N[5](C[5]C[5]Br)(N[5]C[5]Cu)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br)	N[5](C[5]C[5]Br)(N[5]C[5]Cu)(BN[5]2H){2|Br<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br){1|Br<1>,1|Cu<4>}	130.0273	0.585	6	130.0273	0.343	6	129.6954	0.564	9	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:Br-1:	N[5](C[5]C[5]Br)(N[5]C[5]Mo)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br)	N[5](C[5]C[5]Br)(N[5]C[5]Mo)(BN[5]2H){2|Br<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br){1|Br<1>,1|Mo<8>}	129.0317	0.637	3	129.0317	0.406	3	129.6954	0.564	9	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]U)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]U)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|U<11>,1|H<1>}	128.4255	0.145	2	128.4255	0.021	2	129.4944	1.123	162	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]V)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]V)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|V<6>}	130.4000	0.771	9	130.4000	0.594	9	129.4944	1.123	162	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|W<7>}	129.8750	0.000	1	129.4546	1.108	151	129.4944	1.123	162	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|W<6>}	130.5666	0.965	12	129.4546	1.108	151	129.4944	1.123	162	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|W<7>}	129.3548	1.009	138	129.4546	1.108	151	129.4944	1.123	162	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:Cl-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2Cl)	B(N[5]C[5]N[5])3(Cl)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2Cl){2|H<1>}	B(N[5]C[5]N[5])3(Cl)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	130.8095	0.928	6	130.8095	0.861	6	130.8095	0.861	6	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Be)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Be)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Be<4>,1|H<1>}	133.1901	0.645	9	133.1901	0.416	9	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ca)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ca)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ca<6>,1|H<1>}	127.2640	0.000	1	127.3448	0.036	4	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ca)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ca)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ca<9>,1|H<1>}	127.3717	0.222	3	127.3448	0.036	4	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<5>,1|C<3>}	130.0597	0.972	6	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<6>,1|C<3>}	131.2235	4.315	6	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<5>,1|C<4>}	129.2318	0.883	12	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<6>,1|C<4>}	128.0873	1.203	6	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<6>,1|H<1>}	129.8246	0.661	12	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<8>,1|H<1>}	130.4200	0.542	2	129.6759	3.554	44	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[6a]C[5])(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[6a]C[5])(N[5]N[5]B)(H){1|Co<6>,1|C<4>,2|C<3>}	128.0940	0.453	6	128.0940	0.205	6	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cr<8>,1|H<1>}	122.4170	0.000	1	122.4170	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H){1|Br<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H){1|Cr<5>,1|C<4>}	127.8620	1.911	2	127.8620	3.650	2	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cr)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cr<6>,1|H<1>}	131.7681	1.045	9	131.7681	1.092	9	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|C<3>}	130.5082	0.263	6	129.5959	1.720	24	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<5>,1|C<3>}	128.7502	0.757	6	129.5959	1.720	24	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H){1|H<1>,1|N<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|N<3>}	127.4180	0.175	3	129.5959	1.720	24	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|H<1>}	129.8128	0.564	6	129.5959	1.720	24	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Cu)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<5>,1|H<1>}	131.2070	1.248	3	129.5959	1.720	24	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Eu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Eu)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Eu<8>,1|H<1>}	128.5207	0.915	12	128.5207	0.837	12	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2H){1|Br<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H){1|Fe<4>,1|C<4>}	129.2905	0.368	2	129.2905	0.136	2	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	132.0957	0.575	55	132.0957	0.331	55	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<6>,1|C<3>}	129.9243	1.841	10	130.5618	3.982	48	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<7>,1|C<3>}	128.8761	1.865	8	130.5618	3.982	48	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<6>,1|H<1>}	131.1451	1.553	18	130.5618	3.982	48	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<7>,1|H<1>}	131.3418	2.155	12	130.5618	3.982	48	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mg)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mg)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mg<6>,1|H<1>}	128.5300	0.000	1	128.5300	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mn<6>,1|H<1>}	122.0100	0.000	1	122.0100	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H){1|Br<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H){1|Mn<4>,1|C<4>}	128.3300	0.035	2	128.3300	0.001	2	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mn)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mn<6>,1|H<1>}	131.6493	0.415	3	131.6493	0.173	3	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<6>,1|C<4>}	129.6260	1.194	69	129.7312	1.226	190	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<6>,1|H<1>}	130.2116	0.686	54	129.7312	1.226	190	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<7>,1|H<1>}	129.6305	1.037	46	129.7312	1.226	190	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Mo)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<8>,1|H<1>}	129.0623	1.386	21	129.7312	1.226	190	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Nd)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Nd)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Nd<12>,1|C<3>}	128.3533	0.071	3	128.3533	0.005	3	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<4>,1|C<3>}	130.0566	0.583	9	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<5>,1|C<3>}	129.6045	0.756	6	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<6>,1|C<3>}	126.8153	1.710	3	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<5>,1|C<4>}	129.7243	0.494	3	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<6>,1|C<4>}	129.1734	0.661	9	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<5>,1|H<1>}	130.4838	0.725	16	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ni)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ni<6>,1|H<1>}	130.6363	0.826	20	130.0119	1.321	66	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<6>}	132.5090	0.000	1	130.9632	1.770	71	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<5>,1|H<1>}	130.0983	0.858	6	130.9632	1.770	71	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<6>,1|H<1>}	131.5665	1.093	43	130.9632	1.770	71	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<7>,1|H<1>}	129.8294	1.140	12	130.9632	1.770	71	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<8>,1|H<1>}	129.9970	1.082	9	130.9632	1.770	71	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Pd)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Pd)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pd<6>,1|H<1>}	131.3420	0.730	3	131.3420	0.532	3	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Pu)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Pu)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pu<9>,1|H<1>}	127.8345	0.844	2	127.8345	0.712	2	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	126.5720	0.202	2	126.5720	0.041	2	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|C<3>}	129.0360	0.010	2	129.8035	0.812	28	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<7>,1|H<1>}	129.8508	0.925	25	129.8035	0.812	28	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<9>,1|H<1>}	130.1560	0.000	1	129.8035	0.812	28	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<5>,1|H<1>}	129.6497	1.032	3	129.4928	1.438	15	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<6>,1|H<1>}	129.4671	1.334	8	129.4928	1.438	15	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<7>,1|H<1>}	129.4265	1.348	4	129.4928	1.438	15	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	130.5835	1.199	235	130.5590	1.482	250	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<7>,1|H<1>}	130.2978	1.486	12	130.5590	1.482	250	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<8>,1|H<1>}	129.6840	1.612	3	130.5590	1.482	250	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Sm)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Sm)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Sm<6>,1|C<3>}	124.7913	0.944	3	124.7913	0.892	3	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Sr)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Sr)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Sr<6>,1|H<1>}	126.1095	0.421	12	126.1095	0.177	12	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ti)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ti)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ti<6>,1|C<3>}	128.0740	0.453	2	129.7066	1.631	13	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ti)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ti)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ti<6>,1|H<1>}	130.0035	1.143	11	129.7066	1.631	13	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<4>,1|H<1>}	124.0180	0.000	1	124.0180	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<4>,1|H<1>}	127.3543	0.642	16	127.3543	0.412	16	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<5>,1|C<3>}	129.0675	0.647	6	129.7018	0.701	12	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<6>,1|H<1>}	130.3360	0.399	6	129.7018	0.701	12	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]N[5]Co)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H)	N[5](N[5]N[5]Co)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H){1|Co<6>}	131.1947	0.011	3	131.1947	0.000	3	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]N[5]Fe)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H)	N[5](N[5]N[5]Fe)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H){1|Fe<6>}	132.2860	0.000	1	132.2860	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]N[5]Ni)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H)	N[5](N[5]N[5]Ni)(C[5]C[5]H)(BN[5]2H){1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]N[5]H)(N[5]N[5]B)(H){1|Ni<6>}	130.9390	0.000	1	130.9390	0.000	1	130.1349	2.779	915	127.7598	21.954	1440	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:O-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(ORe)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]O)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(ORe){2|C<3>}	127.6750	0.000	1	127.6750	0.000	1	127.6750	0.000	1	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(SRe)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])3(H)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(SRe){2|C<3>}	131.3547	0.727	6	131.3547	0.528	6	131.3547	0.528	6	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:Cl-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2Cl)	B(N[5]C[5]2)3(Cl)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2Cl){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(Cl)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi){2|H<1>}	130.2873	0.013	3	130.2873	0.000	3	130.2873	0.000	3	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:F-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F)	B(N[5]C[5]2)3(F)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(F)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi){2|H<1>}	132.9430	0.012	3	132.9430	0.000	3	131.5816	1.153	9	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:F-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F)	B(N[5]C[5]2)3(F)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2F){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(F)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh){2|H<1>}	130.9008	0.419	6	130.9008	0.176	6	131.5816	1.153	9	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:O-2:	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(ORe)	N[5](C[5]C[5]H)(C[5]N[5]O)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(ORe){2|H<1>}	128.0827	0.016	3	128.0827	0.000	3	128.0827	0.000	3	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SGa)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SGa){2|H<1>,3|C<4>}	133.5350	0.259	6	133.5350	0.067	6	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SIn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SIn){2|H<1>,3|C<4>}	133.4493	0.251	3	133.4493	0.063	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[3x6]C[5])(N[5]C[5]B)(SZn){2|H<1>,3|C<4>}	133.6477	0.016	3	133.6477	0.000	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SAg)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SAg){2|H<1>}	133.7920	0.014	3	133.7920	0.000	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SBi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SBi){2|H<1>}	133.1213	0.399	6	133.1213	0.159	6	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SC)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SC){2|H<1>}	130.5575	4.755	2	130.5575	22.613	2	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCd)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCd){2|H<1>}	133.4430	2.096	41	133.4430	4.392	41	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCo)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCo){2|H<1>}	131.8962	3.434	14	131.8962	11.792	14	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCu){2|H<1>}	133.8880	0.023	2	133.8880	0.001	2	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SFe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SFe){2|H<1>}	131.5885	0.719	4	131.5885	0.516	4	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SGa)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SGa){2|H<1>}	133.0770	1.704	22	133.0770	2.902	22	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SHg)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SHg){2|H<1>}	133.7034	0.586	21	133.7034	0.344	21	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SIn){2|H<1>}	131.3271	4.075	8	131.3271	16.604	8	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMo)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMo){2|H<1>}	131.4873	0.405	9	131.4873	0.164	9	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNb)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNb){2|H<1>}	131.5633	1.517	3	131.5633	2.302	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi){2|H<1>}	132.1867	0.441	9	132.1867	0.195	9	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh){2|H<1>}	125.4108	3.063	4	125.4108	9.384	4	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu){2|H<1>}	131.5953	0.729	3	131.5953	0.531	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(STe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(STe){2|H<1>}	127.8030	3.886	4	127.8030	15.104	4	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn){2|H<1>}	133.2589	0.426	18	133.2589	0.182	18	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZr)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZr){2|H<1>}	131.4727	0.585	6	131.4727	0.342	6	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCd)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCd){2|C<3>,2|H<1>}	133.4577	0.315	3	133.4577	0.099	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCo)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCo){2|C<3>,2|H<1>}	133.4300	0.377	8	133.4300	0.142	8	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SCu){2|C<3>,2|H<1>}	125.5537	1.521	3	125.5537	2.313	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SFe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SFe){2|C<3>,2|H<1>}	132.3670	1.014	4	132.3670	1.027	4	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SMn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SMn){2|C<3>,2|H<1>}	133.2955	0.718	4	133.2955	0.515	4	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SNi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SNi){2|C<3>,2|H<1>}	132.7527	0.021	3	132.7527	0.000	3	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SZn){2|C<3>,2|H<1>}	132.5745	0.847	24	132.5745	0.717	24	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCr)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCr){2|H<1>}	132.2580	3.627	2	132.2580	13.158	2	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SMn){2|H<1>}	130.9890	3.298	2	130.9890	10.876	2	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn){2|H<1>}	132.9165	3.598	2	132.9165	12.949	2	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe){2|H<1>}	131.5110	0.000	1	131.5110	0.000	1	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H)	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(N[5]C[5]2)(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SZn){2|H<1>}	134.4706	0.459	8	134.4706	0.211	8	132.5934	5.234	255	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SeRe)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SeRe){2|H<1>}	133.2032	0.490	6	133.2032	0.240	6	133.2603	1.256	17	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeCo)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeCo){2|C<3>,2|H<1>}	133.4570	0.000	1	133.4570	0.000	1	133.2603	1.256	17	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeHg)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeHg){2|C<3>,2|H<1>}	134.3290	0.000	1	134.3290	0.000	1	133.2603	1.256	17	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeRe)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeRe){2|C<3>,2|H<1>}	132.4477	0.393	3	132.4477	0.154	3	133.2603	1.256	17	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:Se-2:	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeZn)	N[5](C[5]N[5]Se)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]2)3(H)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SeZn){2|C<3>,2|H<1>}	133.5128	1.733	6	133.5128	3.005	6	133.2603	1.256	17	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:2:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:N[5]-3:N[5]-2:	N[5](C[5]C[6a]N[5])(N[5]C[5]Ni)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(N[5]N[5]B)(N[5]C[5])	N[5](C[5]C[6a]N[5])(N[5]C[5]Ni)(BN[5]2H){1|C<4>,2|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(N[5]N[5]B)(N[5]C[5]){1|Ni<6>,1|C<4>,2|C<3>,2|H<1>}	132.1080	0.000	1	132.1080	0.000	1	132.1080	0.000	1	132.4881	5.053	295	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Co)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Co)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Co<5>,1|C<4>,2|C<3>,2|H<1>}	130.0530	0.000	1	129.9539	0.856	16	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Co)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Co)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Co<5>,2|H<1>,3|C<3>}	129.9473	0.958	15	129.9539	0.856	16	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Cu)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Cu)(BN[5]2H){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Cu<4>,1|C<4>,2|C<3>,2|H<1>}	129.9655	0.012	2	129.5799	0.542	8	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Cu)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Cu)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Cu<5>,2|H<1>,3|C<3>}	129.4513	0.825	6	129.5799	0.542	8	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Fe<5>,2|H<1>,3|C<3>}	129.8820	1.068	47	129.8315	1.494	54	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Fe<6>,2|H<1>,3|C<3>}	129.4403	2.266	6	129.8315	1.494	54	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Fe)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Fe<7>,2|H<1>,3|C<3>}	129.8030	0.000	1	129.8315	1.494	54	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Mn)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Mn)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Mn<6>,2|H<1>,3|C<3>}	127.7153	1.003	3	127.7153	1.005	3	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]Br)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H){2|Br<1>,2|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]Br)(N[5]N[5]B){1|Br<1>,1|Ni<6>,2|C<3>,2|H<1>}	129.7715	0.358	6	129.7715	0.128	6	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Ni<4>,2|H<1>,3|C<3>}	127.5980	0.013	2	130.0416	2.300	11	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Ni)(BN[5]2H){1|H<1>,3|C<3>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Ni<5>,2|H<1>,3|C<3>}	130.5847	1.025	9	130.0416	2.300	11	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:3:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:C[5]-3:N[5]-3:	N[5](C[5]C[6a]C[5])(N[5]C[5]Ti)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B)	N[5](C[5]C[6a]C[5])(N[5]C[5]Ti)(BN[5]2H){2|C<3>,2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[6a]C[6a]2)(C[5]C[5]H)(N[5]N[5]B){1|Ti<6>,1|H<1>,2|C<3>,2|C<4>}	131.1190	0.000	1	131.1190	0.000	1	129.7995	1.405	99	129.7995	1.405	99	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2H)	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3)	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3){1|C<4>,1|H<1>}	134.9340	0.000	1	134.9340	0.000	1	134.9340	0.000	1	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){2|C<4>}	127.0880	0.000	1	127.0880	0.000	1	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]H)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|H<1>}	131.7718	1.994	6	131.7718	3.975	6	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]U)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]U)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|U<8>}	126.6020	1.179	3	126.6020	1.389	3	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|C<4>,1|W<7>}	129.1520	0.560	12	129.1520	0.314	12	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|Cl<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3){1|C<4>,1|W<7>}	129.7660	0.000	1	129.7660	0.000	1	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|C<1>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<1>,1|W<7>}	130.1380	0.000	1	130.1121	0.845	491	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|W<6>}	130.1358	0.927	394	130.1121	0.845	491	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|W<7>}	130.0116	0.898	93	130.1121	0.845	491	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|W<8>}	130.1067	0.762	3	130.1121	0.845	491	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]Y)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]Y)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Y<12>,1|C<4>}	127.3115	0.333	2	127.3115	0.111	2	130.0713	1.027	516	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|Co<6>,1|C<4>}	130.9062	0.510	6	130.9062	0.260	6	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Co<3>,1|C<4>}	132.0610	0.470	2	131.4421	0.680	14	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Co<4>,1|C<4>}	131.3389	0.838	12	131.4421	0.680	14	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Co<5>,1|C<3>}	130.5045	0.842	23	130.4259	0.706	39	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Co<4>,1|C<4>}	129.9317	1.242	3	130.4259	0.706	39	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Co<5>,1|C<4>}	130.4362	0.851	6	130.4259	0.706	39	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Co)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Co<6>,1|C<4>}	130.3704	0.779	7	130.4259	0.706	39	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|Br<1>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(CCCH){1|Cr<5>,1|H<1>}	132.8040	0.000	1	132.8040	0.000	1	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Cr<5>,1|C<4>}	130.2006	1.433	9	130.7916	1.045	29	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Cr<6>,1|C<4>}	131.0576	0.660	20	130.7916	1.045	29	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Cr<4>,1|C<4>}	128.9422	0.425	6	129.0684	1.173	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Cr<5>,1|C<4>}	128.5874	1.004	9	129.0684	1.173	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Cr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Cr<6>,1|C<4>}	130.7637	0.294	3	129.0684	1.173	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(CF3)	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H){1|Br<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(CF3){1|Cu<4>,1|C<4>}	131.3430	0.432	3	131.3430	0.187	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Cu<4>,1|C<3>}	130.1528	0.241	6	130.3974	0.308	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Cu)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Cu<4>,1|C<4>}	130.5198	0.633	12	130.3974	0.308	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Eu)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Eu)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Eu<6>,1|C<4>}	127.9020	0.000	1	127.9020	0.000	1	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|Fe<6>,1|C<4>}	130.7563	0.380	3	130.7563	0.144	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<3>,1|C<3>}	130.1020	0.000	1	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<4>,1|C<3>}	129.3127	0.791	3	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<5>,1|C<3>}	129.6370	0.964	9	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<6>,1|C<3>}	127.9127	0.211	3	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<5>,1|C<4>}	130.5917	0.754	3	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Fe)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Fe<6>,1|C<4>}	130.9154	0.957	64	130.5888	1.332	83	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ir<6>,1|C<4>}	130.3501	1.012	150	130.2082	1.467	162	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ir<7>,1|C<4>}	128.2910	2.169	9	130.2082	1.467	162	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ir)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ir<8>,1|C<4>}	128.8657	1.492	3	130.2082	1.467	162	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Li)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Li)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Li<4>,1|C<4>}	129.7453	0.352	3	129.7453	0.124	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mg)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mg)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mg<4>,1|C<4>}	128.2368	0.517	16	128.2368	0.267	16	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mn<3>,1|C<3>}	129.3550	0.000	1	129.8358	1.802	20	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mn<4>,1|C<3>}	128.5953	1.093	7	129.8358	1.802	20	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mn<5>,1|C<3>}	129.3217	0.626	3	129.8358	1.802	20	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mn)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mn<6>,1|C<4>}	131.0254	0.469	9	129.8358	1.802	20	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|Mo<6>,1|C<4>}	131.0728	0.455	5	131.0728	0.207	5	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mo<6>,1|C<4>}	129.9429	1.014	146	129.8549	1.059	170	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mo<7>,1|C<4>}	129.4620	0.949	21	129.8549	1.059	170	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Mo)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Mo<8>,1|C<4>}	128.3220	0.458	3	129.8549	1.059	170	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|Ni<6>,1|C<4>}	131.1987	0.132	3	131.1987	0.017	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|Cl<1>,1|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3){1|Ni<6>,1|C<4>}	129.5642	0.223	5	129.5642	0.050	5	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Ni<5>,1|C<3>}	132.2520	0.000	1	132.1090	0.114	5	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Ni<3>,1|C<4>}	131.7895	0.265	2	132.1090	0.114	5	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Ni<5>,1|C<4>}	132.3570	0.191	2	132.1090	0.114	5	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<3>,1|C<3>}	130.8220	0.000	1	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<4>,1|C<3>}	130.5110	0.801	21	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<5>,1|C<3>}	130.6083	1.043	30	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<6>,1|C<3>}	127.8529	0.386	8	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<4>,1|C<4>}	131.6372	0.622	6	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<5>,1|C<4>}	131.3041	1.394	14	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<6>,1|C<4>}	131.3546	1.293	18	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ni)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<7>,1|C<4>}	131.3732	0.971	5	130.6986	1.873	103	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Pd)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Pd)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pd<6>,1|C<4>}	129.1022	0.565	6	129.1022	0.319	6	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pt<4>,1|C<4>}	128.9613	1.472	10	129.3778	1.479	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pt<5>,1|C<4>}	129.6130	0.472	2	129.3778	1.479	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Pt)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pt<6>,1|C<4>}	129.9935	0.509	6	129.3778	1.479	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Re)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Re)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Re<6>,1|C<4>}	131.8287	0.121	3	131.8287	0.015	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<4>,1|C<4>}	126.4450	0.629	2	129.2155	1.313	142	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<5>,1|C<4>}	128.9345	1.293	6	129.2155	1.313	142	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<6>,1|C<4>}	129.2695	1.097	134	129.2155	1.313	142	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ru)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Ru)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Ru<6>,1|C<4>}	130.0297	2.630	3	130.0297	6.918	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H){2|C<4>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]C)(N[5]N[5]B)(CH3){1|Sm<6>,1|C<4>}	128.5263	0.459	3	128.5263	0.211	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Sm<8>,1|C<4>}	128.4357	0.269	3	128.4357	0.072	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Sm<6>,1|C<4>}	128.3610	0.000	1	128.0663	0.914	7	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Sm)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Sm<7>,1|C<4>}	128.0172	1.038	6	128.0663	0.914	7	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Sr)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCHH)	N[5](N[5]C[5]Sr)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCHH){1|Sr<6>,1|C<4>}	127.9607	0.439	6	127.9607	0.193	6	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ta<6>,1|C<4>}	129.8107	1.224	9	129.3899	1.105	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ta<7>,1|C<4>}	129.1982	0.672	6	129.3899	1.105	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ta)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ta<8>,1|C<4>}	128.5110	0.459	3	129.3899	1.105	18	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Ti)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Ti)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ti<6>,1|C<4>}	130.2660	0.405	3	130.2660	0.164	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Zn<4>,1|C<4>}	131.1487	0.731	6	131.1487	0.535	6	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CF3)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CF3){1|Zn<5>,1|C<4>}	130.5797	0.386	3	130.5797	0.149	3	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zn<3>,1|C<3>}	130.3610	0.000	1	129.5874	1.264	137	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zn<4>,1|C<3>}	129.7276	0.782	42	129.5874	1.264	137	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zn<5>,1|C<3>}	129.6834	1.316	77	129.5874	1.264	137	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Zn)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zn<4>,1|C<4>}	128.7610	0.314	17	129.5874	1.264	137	129.9645	1.651	1065	130.0024	1.464	1582	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	4:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-4:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]HH)(N[5]N[5]B)(CH3)	N[5](C[5]C[5]C)(N[5]C[5]W)(BN[5]2H){1|C<4>,2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]HH)(N[5]N[5]B)(CH3){1|C<4>,1|W<6>}	129.6810	0.000	1	129.6810	0.000	1	129.6810	0.000	1	129.6810	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-2:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CN)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CN)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<1>}	125.6630	0.000	1	123.2637	4.416	3	123.2637	4.416	3	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-2:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CN)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CN)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	122.0640	0.444	2	123.2637	4.416	3	123.2637	4.416	3	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-2:	N[5]-3:N[5]-3:S-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CN)	C[5](N[5]C[5]B)(N[5]C[5]C)(S)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CN)	C[5](N[5]C[5]B)(N[5]C[5]C)(S){2|H<1>}	126.0800	0.000	1	126.0800	0.000	1	126.0800	0.000	1	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N-2:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N)	B(N[5]C[5]2)3(NC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(NC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	121.6581	1.074	9	121.6581	1.154	9	121.6581	1.154	9	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:O-2:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O)	B(N[5]C[5]2)3(OC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(OC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<1>}	125.1555	0.271	2	121.6592	7.764	6	121.6592	7.764	6	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:O-2:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O)	B(N[5]C[5]2)3(OC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(OC)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	119.9110	0.831	4	121.6592	7.764	6	121.6592	7.764	6	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:O-2:	N[5]-3:N[5]-3:S-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O)	B(N[5]C[5]2)3(OC)	C[5](N[5]C[5]B)(N[5]C[5]C)(S)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(OC)	C[5](N[5]C[5]B)(N[5]C[5]C)(S){2|H<1>}	125.9365	0.308	2	125.9365	0.095	2	125.9365	0.095	2	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-2:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CC)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CC)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<6>,1|H<1>}	130.6223	1.101	3	130.6223	1.213	3	130.6223	1.213	3	123.5204	12.224	24	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-2:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CN)	C[5](N[5]C[5]B)(N[5]C[5]C)(SPd)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CN)	C[5](N[5]C[5]B)(N[5]C[5]C)(SPd){2|H<1>}	130.0390	0.274	2	130.0390	0.075	2	130.0390	0.075	2	130.8171	1.920	15	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N-2:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N)	B(N[5]C[5]2)3(NC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(NC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SNi){2|H<1>}	131.7820	0.496	3	131.7820	0.246	3	130.3753	1.776	9	130.8171	1.920	15	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N-2:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N)	B(N[5]C[5]2)3(NC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(NC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu){2|H<1>}	129.6720	0.981	6	129.6720	0.963	6	130.3753	1.776	9	130.8171	1.920	15	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:O-2:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O)	B(N[5]C[5]2)3(OC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SPd)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2O){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(OC)	C[5](N[5]C[5]B)(N[5]C[5]C)(SPd){2|H<1>}	132.2003	0.812	4	132.2003	0.659	4	132.2003	0.659	4	130.8171	1.920	15	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:2:	3:3:4:	C[5]-3:N[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C-2:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2C)	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(CC)	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3)	N[5](C[5]C[5]C)(N[5]C[5]H)(BC[6a]2C){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(CC)	C[5](C[5]C[5]H)(N[5]N[5]B)(CC3){1|C<4>,1|H<1>}	140.3550	0.000	1	140.3550	0.000	1	140.3550	0.000	1	140.3550	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]3){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(H){2|C<3>}	127.4050	1.158	2	127.4050	1.342	2	127.4050	1.342	2	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|B<4>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|B<4>,1|H<1>}	126.5335	3.198	4	127.0020	6.885	6	126.0155	3.448	17	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|H<1>}	127.1920	0.000	1	127.0020	6.885	6	126.0155	3.448	17	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	128.6860	0.000	1	127.0020	6.885	6	126.0155	3.448	17	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5a]S[5])(C[5]C[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]S[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5a]S[5])(C[5]C[5]H)(BC[6a]3){1|H<1>,2|C<3>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]S[5]H)(N[5]C[5]B)(H){1|C<3>}	124.7470	0.000	1	124.7470	0.000	1	126.0155	3.448	17	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[6a]N[5])(C[5]C[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[6a]N[5])(C[5]C[5]H)(BC[6a]3){1|B<4>,1|H<1>,2|C<3>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|B<4>,1|C<3>}	125.5505	1.112	10	125.5505	1.237	10	126.0155	3.448	17	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]C)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]C)(C[5]N[5]H)(BC[6a]3){2|C<4>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|C<4>}	125.4690	0.000	1	125.4690	0.000	1	125.9650	4.897	7	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	124.4040	0.000	1	124.4040	0.000	1	125.9650	4.897	7	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)2(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|B<4>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)2(H){2|H<1>}	126.5480	2.902	4	126.5480	8.422	4	125.9650	4.897	7	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC[6a]3){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H){2|C<3>,2|H<1>}	125.6900	0.000	1	125.6900	0.000	1	125.9650	4.897	7	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N)	B(N[5]C[5]2)3(NCH)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(NCH)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	122.5205	0.870	6	122.5205	0.757	6	122.5205	0.757	6	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]3)	B(N[5]C[5]2)4	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]3){1|C<4>,1|H<1>}	B(N[5]C[5]2)4	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	122.3670	0.000	1	122.3670	0.000	1	122.0650	3.863	4	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]3)	B(N[5]C[5]2)4	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]3){1|C<3>,1|H<1>}	B(N[5]C[5]2)4	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|S<2>}	121.9643	2.395	3	121.9643	5.734	3	122.0650	3.863	4	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]3)	B(N[5]C[5]2)4	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5]3){1|C<4>,1|H<1>}	B(N[5]C[5]2)4	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	129.3770	0.000	1	129.3770	0.000	1	129.3770	0.000	1	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]C)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){1|C<4>,1|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]C)(N[5]C[5]B)(H){2|H<1>}	127.5840	0.000	1	127.5840	0.000	1	126.8167	7.311	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){1|Li<5>,1|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Li<5>,1|H<1>}	129.0540	0.000	1	126.4330	13.739	2	126.8167	7.311	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){2|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){2|H<1>}	123.8120	0.000	1	126.4330	13.739	2	126.8167	7.311	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){1|C<4>,1|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]H)(H){1|C<4>,1|H<1>}	126.1100	0.000	1	127.3940	3.297	2	127.0143	2.081	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]H)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){2|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]H)(H){2|H<1>}	128.6780	0.000	1	127.3940	3.297	2	127.0143	2.081	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5a]-3:N[5a]-3:N[5a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3)	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]Li)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BN[5a]3){1|Li<5>,1|H<1>}	B(N[5a]C[5a]2)3(N[5]C[5]2)	C[5](N[5]C[5]Li)(N[5]C[5]B)(H){2|H<1>}	126.2550	0.000	1	126.2550	0.000	1	127.0143	2.081	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5,6a]-3:N[5]-3:H-1:	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(BC[6a]3)	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5]B)(H)	N[5](C[5]C[5,6a]H)(N[5]C[5,6a]H)(BC[6a]3){2|C<3>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](C[5,6a]C[5,6a]C[6a])(N[5]N[5]B)(H){2|C<3>,2|H<1>}	132.8850	0.000	1	132.8850	0.000	1	132.8850	0.000	1	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]H)(BC[6a]3)	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]H)(BC[6a]3){2|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){2|H<1>}	133.2000	0.000	1	133.2000	0.000	1	133.2000	0.000	1	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:O-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Re)(C[5]C[5]H)(BC[6a]2O)	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(OReC)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Re)(C[5]C[5]H)(BC[6a]2O){2|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(OReC)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	130.0125	0.378	2	130.0125	0.143	2	130.6067	1.131	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:O-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC[6a]2O)	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(ORhH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC[6a]2O){2|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)2(ORhH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<8>,1|H<1>}	131.7950	0.000	1	131.7950	0.000	1	130.6067	1.131	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CCH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Os)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CCH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Os<6>,1|H<1>}	129.4410	1.704	3	129.4410	2.902	3	129.4410	2.902	3	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]3)	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Co)(C[5]C[5]H)(BN[5]3){2|H<1>}	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<4>,1|H<1>}	128.2700	0.430	2	128.2700	0.185	2	127.3732	1.476	12	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Pd)(C[5]C[5]H)(BN[5]3)	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Pd)(C[5]C[5]H)(BN[5]3){2|H<1>}	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pd<4>,1|H<1>}	128.2320	0.532	2	128.2320	0.283	2	127.3732	1.476	12	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]3)	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]3){2|H<1>}	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<6>,1|H<1>}	127.3037	1.188	6	127.3037	1.412	6	127.3732	1.476	12	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]3)	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Zn)(C[5]C[5]H)(BN[5]3){2|H<1>}	B(N[5]C[5]N[5])4	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<4>,1|H<1>}	125.8260	0.899	2	125.8260	0.809	2	127.3732	1.476	12	126.4728	8.167	63	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:2:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5a]-3:N[5]-3:S[5]-2:	N[5](C[5]C[5a]S[5])(C[5]C[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5a]C[5a,5a]C[5a])(N[5]C[5]B)(S[5]C[5])	N[5](C[5]C[5a]S[5])(C[5]C[5]H)(BC[6a]3){1|H<1>,2|C<3>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5a]C[5a,5a]C[5a])(N[5]C[5]B)(S[5]C[5]){1|N<3>,2|H<1>,3|C<3>}	124.0030	0.000	1	124.0030	0.000	1	124.0030	0.000	1	128.9575	4.995	10	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N-3:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N)	B(N[5]C[5]2)3(NCH)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2N){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(NCH)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu){2|H<1>}	129.5902	0.639	6	129.5902	0.408	6	129.5902	0.408	6	128.9575	4.995	10	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]3)	B(N[5]C[5]2)4	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SRu)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]3){1|C<3>,1|H<1>}	B(N[5]C[5]2)4	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(SRu){2|C<3>,2|H<1>}	129.3437	2.786	3	129.3437	7.760	3	129.3437	7.760	3	128.9575	4.995	10	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:3:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	N[5]-3:N[5]-3:C[6a]-3:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]N[5])(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](N[5]C[5,6a]B)2(C[6a]C[6a]2)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[6a]N[5])(BC[6a]3){1|B<4>,1|H<1>,4|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](N[5]C[5,6a]B)2(C[6a]C[6a]2){2|H<1>,4|C<3>}	134.7138	0.717	4	134.7138	0.514	4	134.7138	0.514	4	129.9168	10.488	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:3:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[6a]-3:N[5]-3:N[5]-3:	N[5](C[5]C[6a]N[5])(C[5]C[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[6a]C[6a]2)(N[5]C[5]B)2	N[5](C[5]C[6a]N[5])(C[5]C[5]H)(BC[6a]3){1|B<4>,1|H<1>,2|C<3>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[6a]C[6a]2)(N[5]C[5]B)2{2|C<3>,4|H<1>}	127.9980	0.812	10	127.9980	0.660	10	127.9980	0.660	10	129.9168	10.488	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	3:3:4:	C[5]-3:C[5]-3:B-4:	C[6a]-3:C[6a]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:C-4:	N[5](C[5]C[5]C)(C[5]N[5]H)(BC[6a]3)	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]C)(N[5]C[5]B)(CH3)	N[5](C[5]C[5]C)(C[5]N[5]H)(BC[6a]3){2|C<4>}	B(C[6a]C[6a]2)3(N[5]C[5]2)	C[5](C[5]N[5]C)(N[5]C[5]B)(CH3){1|C<4>,1|H<1>}	127.9670	0.000	1	127.9670	0.000	1	127.9670	0.000	1	127.9670	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:3:	4:3:1:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	C[5]-4:N[5]-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(BC[6a]3)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](C[5]C[5,6a]HH)(N[5]C[5,6a]B)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(BC[6a]3){2|C<3>,3|H<1>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[5](C[5]C[5,6a]HH)(N[5]C[5,6a]B)(H){2|C<3>}	126.7000	0.000	1	126.7000	0.000	1	126.7000	0.000	1	126.7000	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	C[5,6a]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C[6a]-3:C-4:	N[5]-3:N[5]-3:H-1:	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]2C)	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CCHH)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(H)	N[5](C[5,6a]C[5,6a]C[6a])(C[5]N[5]H)(BC[6a]2C){1|C<4>,1|H<1>,2|C<3>}	B(N[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CCHH)	C[5](N[5]C[5,6a]B)(N[5]C[5,6a]C)(H){2|C<3>}	126.2650	0.000	1	126.2650	0.000	1	126.2650	0.000	1	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CH3)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CH3)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	120.3943	1.051	6	120.3943	1.104	6	120.3943	1.104	6	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C[6]-3:O-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6]CO)	B(N[5]C[5]N[5])(C[6]C[6]2)(OFeH)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6]CO){2|H<1>}	B(N[5]C[5]N[5])(C[6]C[6]2)(OFeH)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<5>,1|H<1>}	130.2770	0.000	1	130.2770	0.000	1	130.2770	0.000	1	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|C<4>}	131.8240	0.149	3	132.6200	0.577	7	131.6373	0.648	46	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	133.2170	0.173	4	132.6200	0.577	7	131.6373	0.648	46	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CCHH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CCHH)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	131.5407	0.436	6	131.5407	0.190	6	131.6373	0.648	46	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CH3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CH3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	131.5164	0.628	30	131.5164	0.394	30	131.6373	0.648	46	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2C)	B(N[5]C[5]N[5])3(CH3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ru)(C[5]C[5]H)(BN[5]2C){2|H<1>}	B(N[5]C[5]N[5])3(CH3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	130.7460	1.352	3	130.7460	1.828	3	131.6373	0.648	46	130.2634	13.620	54	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:4:	3:3:2:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:C-4:	N[5]-3:N[5]-3:S-2:	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C)	B(N[5]C[5]2)3(CH3)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe)	N[5](C[5]C[5]H)(C[5]N[5]S)(BN[5]2C){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(CH3)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRe){2|H<1>}	131.9050	0.935	6	131.9050	0.874	6	131.9050	0.874	6	131.9050	0.874	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]U)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]U)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|U<8>}	120.0566	2.406	10	120.0566	5.789	10	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Al)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Al)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Al<5>,1|C<4>}	123.3045	3.384	2	123.3045	11.448	2	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Cu)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Cu)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Cu<2>,1|C<4>}	121.9770	1.728	3	121.9770	2.987	3	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<4>,1|C<4>}	125.9895	2.088	4	122.6812	15.346	12	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<5>,1|C<4>}	121.3727	5.314	4	122.6812	15.346	12	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Fe)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<6>,1|C<4>}	120.6813	1.210	4	122.6812	15.346	12	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Pd)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Pd)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Pd<4>,1|C<4>}	126.4930	3.024	2	126.4930	9.142	2	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Th)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Th)(C[5]C[5]H)(BN[5]CC){1|C<4>,1|H<1>}	B(N[5]C[5]2)2(CH3)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Th<8>,1|C<4>}	121.9273	0.850	8	121.9273	0.722	8	121.9915	9.436	37	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6a]CC)	B(N[5]C[5]N[5])(C[6a]C[6a]2)(CHHP)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6a]CC){2|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)(CHHP)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<4>,1|H<1>}	130.1950	1.300	2	129.5893	1.945	3	129.5893	1.945	3	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C[6a]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6a]CC)	B(N[5]C[5]N[5])(C[6a]C[6a]2)(CHHP)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Fe)(C[5]C[5]H)(BC[6a]CC){2|H<1>}	B(N[5]C[5]N[5])(C[6a]C[6a]2)(CHHP)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<5>,1|H<1>}	128.3780	0.000	1	129.5893	1.945	3	129.5893	1.945	3	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]N[5])2(CCHH)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]CC){2|H<1>}	B(N[5]C[5]N[5])2(CCHH)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<6>,1|H<1>}	129.1030	0.577	4	129.1030	0.333	4	129.3781	1.010	8	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Pt)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]N[5])2(CCHH)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Pt)(C[5]C[5]H)(BN[5]CC){2|H<1>}	B(N[5]C[5]N[5])2(CCHH)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pt<4>,1|H<1>}	130.3570	0.485	2	130.3570	0.235	2	129.3781	1.010	8	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]CC)	B(N[5]C[5]N[5])2(CCHH)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BN[5]CC){2|H<1>}	B(N[5]C[5]N[5])2(CCHH)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<7>,1|H<1>}	128.9495	1.802	2	128.9495	3.249	2	129.3781	1.010	8	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:O-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Li)(C[5]C[5]H)(BN[5]CO)	B(N[5]C[5]N[5])2(OLi2H)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Li)(C[5]C[5]H)(BN[5]CO){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(OLi2H)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Li<4>,1|C<4>}	131.1635	3.775	2	131.1635	14.252	2	131.1635	14.252	2	123.9961	19.223	50	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:4:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:C-4:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC3)	B(N[5]C[5]2)(CCHH)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC3){1|C<4>,1|H<1>}	B(N[5]C[5]2)(CCHH)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	124.7690	0.000	1	124.7690	0.000	1	124.7690	0.000	1	128.0593	2.680	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:4:4:4:	3:3:1:	C[5]-3:C[5]-3:B-4:	N[5]-3:C-4:C-4:C-4:	N[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(C[5]N[5]H)(BC3)	B(N[5]C[5]2)(CCHH)3	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](C[5]C[5]H)(C[5]N[5]H)(BC3){1|C<4>,1|H<1>}	B(N[5]C[5]2)(CCHH)3	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	128.7670	0.000	1	128.7670	0.000	1	128.7670	0.000	1	128.0593	2.680	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:4:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C-4:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BC3)	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BC3){2|H<1>}	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<8>,1|H<1>}	128.7300	0.000	1	128.7300	0.000	1	128.7050	0.135	4	128.0593	2.680	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:4:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C-4:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC3)	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC3){2|H<1>}	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<4>,1|H<1>}	128.1840	0.000	1	128.6967	0.201	3	128.7050	0.135	4	128.0593	2.680	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:4:4:4:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:C-4:C-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC3)	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Rh)(C[5]C[5]H)(BC3){2|H<1>}	B(N[5]C[5]N[5])(CCHH)2(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<5>,1|H<1>}	128.9530	0.093	2	128.6967	0.201	3	128.7050	0.135	4	128.0593	2.680	6	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:4:2:	3:3:1:1:	3:2:4:	C[5]-3:B-4:N[5]-2:	N[5a]-3:N[5]-3:H-1:H-1:	N[5]-3:C[5]-2:C-4:	N[5](C[5]C[5]C)(BN[5a]HH)(N[5]C[5])	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](N[5]N[5]B)(C[5]C[5])(CF3)	N[5](C[5]C[5]C)(BN[5a]HH)(N[5]C[5]){1|C<4>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](N[5]N[5]B)(C[5]C[5])(CF3){1|C<4>}	132.9340	0.000	1	132.9340	0.000	1	132.9340	0.000	1	132.9340	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:4:2:	3:3:1:1:	3:3:1:	C[5]-3:B-4:N[5]-2:	N[5a]-3:N[5]-3:H-1:H-1:	N[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]H)(BN[5a]HH)(N[5]C[5])	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](N[5]C[5]Mn)(N[5]N[5]B)(H)	N[5](C[5]N[5]H)(BN[5a]HH)(N[5]C[5]){1|Mn<6>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(H)2	C[5](N[5]C[5]Mn)(N[5]N[5]B)(H){1|H<1>}	130.1390	0.000	1	130.1390	0.000	1	130.1390	0.000	1	130.1390	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:4:2:	3:3:3:1:	3:2:1:	C[5]-3:B-4:N[5]-2:	N[5a]-3:N[5a]-3:N[5]-3:H-1:	N[5]-3:C[5]-2:H-1:	N[5](C[5]C[5]H)(BN[5a]2H)(N[5]C[5])	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])(H)	C[5](N[5]N[5]B)(C[5]C[5])(H)	N[5](C[5]C[5]H)(BN[5a]2H)(N[5]C[5]){1|H<1>}	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])(H)	C[5](N[5]N[5]B)(C[5]C[5])(H){1|H<1>}	132.5970	0.000	1	132.5970	0.000	1	132.5970	0.000	1	132.5970	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	3:4:3:	3:3:3:1:	3:3:2:	C[5]-3:B-4:N[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[6a]-3:N[5]-3:N[5]-2:	N[5](C[5]C[6a]N[5])(BN[5a]N[5]H)(N[5]C[5]Ru)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[6a]C[6a]2)(N[5]N[5]B)(N[5]C[5])	N[5](C[5]C[6a]N[5])(BN[5a]N[5]H)(N[5]C[5]Ru){1|C<4>,2|C<3>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[6a]C[6a]2)(N[5]N[5]B)(N[5]C[5]){1|Ru<9>,1|C<4>,2|C<3>,2|H<1>}	129.1100	0.000	1	129.1100	0.000	1	129.1100	0.000	1	129.1100	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:2:	3:3:3:3:	3:2:1:	B-4:C[5]-3:N[5]-2:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(C[5]P[5]H)(N[5]C[5])	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(C[5]P[5]H)(N[5]C[5]){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|H<1>}	126.9987	2.474	3	126.9987	6.122	3	126.9987	6.122	3	126.9987	6.122	3	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:2:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]N[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]N[5]C){1|C<3>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Ru<9>,1|C<3>}	127.3960	0.000	1	130.7063	3.372	7	130.7063	3.372	7	130.7063	3.372	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:2:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-2:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]N[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]N[5]C){1|C<4>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](N[5]N[5]B)(N[5]C[5])(CH3){1|Ru<9>,1|C<4>}	131.2580	1.221	6	130.7063	3.372	7	130.7063	3.372	7	130.7063	3.372	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:C[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S)	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<1>}	125.5900	0.798	2	126.0392	0.232	10	126.0392	0.232	10	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:C[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S)	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	126.1515	0.368	8	126.0392	0.232	10	126.0392	0.232	10	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:C[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-1:	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S)	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(S)	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(S){2|H<1>}	126.1725	0.889	2	126.1725	0.790	2	126.1725	0.790	2	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:Br-1:	N[5](BN[5a]N[5]H)(C[5]C[5]Br)(N[5]C[5]Pd)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br)	N[5](BN[5a]N[5]H)(C[5]C[5]Br)(N[5]C[5]Pd){2|Br<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(Br){1|Br<1>,1|Pd<5>}	130.5600	0.617	2	130.5600	0.380	2	130.5600	0.380	2	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Be)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Be)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Be<4>,1|H<1>}	126.1290	0.042	2	126.1290	0.002	2	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Cr)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Cr)(C[5]C[5]H){1|Br<1>,1|C<4>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Br)(N[5]N[5]B)(H){1|Cr<5>,1|C<4>}	133.0910	0.083	2	133.0910	0.007	2	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Re)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Re)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	130.6950	0.000	1	130.6950	0.000	1	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Rh<4>,1|H<1>}	132.0760	1.608	2	132.0760	2.586	2	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<9>,1|H<1>}	130.3065	0.473	2	130.3065	0.224	2	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]H)(N[5]C[5]Ti)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]H)(N[5]C[5]Ti)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ti<6>,1|H<1>}	128.5805	0.847	4	128.5805	0.717	4	129.8632	5.929	13	128.2251	6.785	27	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:2:	B-4:C[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S)	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCr)	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SCr){2|H<1>}	126.0470	0.424	3	126.0470	0.180	3	125.8287	0.117	7	125.8287	0.117	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:2:	B-4:C[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	N[5]-3:N[5]-3:S-2:	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S)	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu)	N[5](BN[5a]N[5]H)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]2)2(H)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRu){2|H<1>}	125.6650	0.175	4	125.6650	0.031	4	125.8287	0.117	7	125.8287	0.117	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]H){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|H<1>}	132.8550	0.000	1	132.8550	0.000	1	128.5714	17.651	5	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]U)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]U){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|U<8>}	124.0805	0.202	2	124.0805	0.041	2	128.5714	17.651	5	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]W)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(C[5]C[5]C)(N[5]C[5]W){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|C<4>,1|W<8>}	130.9205	0.917	2	130.9205	0.841	2	128.5714	17.651	5	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Cr)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](BN[5a]N[5]H)(N[5]C[5]Cr)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Cr<6>,1|C<4>}	123.9110	0.240	2	123.9110	0.058	2	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Ir)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Ir)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ir<6>,1|C<4>}	129.5390	1.632	2	129.5390	2.663	2	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C){1|C<3>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<4>,1|C<3>}	128.2226	1.388	10	128.6419	2.571	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C){1|C<3>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<5>,1|C<3>}	130.7385	0.626	2	128.6419	2.571	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH)	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CCCH){1|Pd<4>,1|C<4>}	130.0011	1.322	12	130.0011	1.747	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pd<4>,1|C<4>}	129.6871	1.852	8	130.0017	3.114	10	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Pd)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pd<5>,1|C<4>}	131.2600	0.242	2	130.0017	3.114	10	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Pt)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Pt)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Pt<4>,1|C<4>}	130.1299	2.402	7	130.1299	5.769	7	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C){1|Cl<1>,1|C<4>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]Cl)(N[5]N[5]B)(CH3){1|Rh<4>,1|C<4>}	129.9360	0.218	2	129.9360	0.047	2	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C){1|C<3>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<4>,1|C<3>}	126.6610	0.198	2	128.7048	1.993	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<4>,1|C<4>}	129.1799	1.201	8	128.7048	1.993	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Rh)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<6>,1|C<4>}	128.8485	1.258	2	128.7048	1.993	12	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BN[5a]N[5]H)(N[5]C[5]Zr)(C[5]C[5]C)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BN[5a]N[5]H)(N[5]C[5]Zr)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])2(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zr<11>,1|C<4>}	126.5795	0.515	2	126.5795	0.266	2	129.1644	3.881	61	129.1195	4.694	66	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Cd)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Cd)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Cd<6>,1|H<1>}	126.1740	1.370	6	126.1740	1.877	6	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Co)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Co)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Co<6>,1|H<1>}	127.3838	1.601	6	127.3838	2.562	6	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Fe<6>,1|H<1>}	128.7890	1.602	6	128.7890	2.567	6	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Mo)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Mo)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Mo<8>,1|H<1>}	125.9290	2.467	3	125.9290	6.087	3	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Ni)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Ni)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Ni<6>,1|H<1>}	127.7025	1.642	6	127.7025	2.698	6	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Pd)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Pd)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Pd<4>,1|H<1>}	128.7420	0.245	2	128.7420	0.060	2	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:2:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	N[5]-3:P[5]-2:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Ti)(C[5]P[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Ti)(C[5]P[5]H){1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](N[5]N[5]B)(P[5]C[5])(H){1|Ti<6>,1|H<1>}	127.7135	2.164	2	127.7135	4.685	2	127.4514	3.226	31	127.4514	3.226	31	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<3>,1|H<1>}	129.5340	0.000	1	127.9915	4.759	2	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	126.4490	0.000	1	127.9915	4.759	2	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ir<4>,1|C<3>}	126.3120	0.000	1	127.1683	0.629	4	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ir<5>,1|C<3>}	126.8340	0.000	1	127.1683	0.629	4	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Ir)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ir<6>,1|C<3>}	127.7635	0.576	2	127.1683	0.629	4	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Rh<4>,1|C<3>}	126.0790	0.000	1	127.4613	2.375	3	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Rh<6>,1|C<3>}	129.1230	0.000	1	127.4613	2.375	3	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Rh)(C[5]C[5]H){1|C<4>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Rh<6>,1|C<4>}	127.1820	0.000	1	127.4613	2.375	3	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]N[5]Zn)(C[5]C[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]N[5]Zn)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Zn<4>,1|C<3>}	126.1285	0.220	2	126.1285	0.048	2	127.2088	1.520	11	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	127.4390	0.000	1	127.4390	0.000	1	125.6165	6.643	2	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[5]-3:C[5]-3:C[6a]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H)	N[5](BC[6a]C[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<3>,1|H<1>}	B(C[5]N[5]O[5])2(C[6a]C[6a]2)(N[5]C[5]2)	C[5](N[5]C[6a]C[5])(N[5]C[5]B)(H){2|C<3>,2|H<1>}	123.7940	0.000	1	123.7940	0.000	1	125.6165	6.643	2	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6]N[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[6]C[6]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6]N[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[6]C[6]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	126.6470	0.742	3	126.6470	0.551	3	126.6470	0.551	3	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](BC[6]N[5]2)(C[5]C[5]H)(C[5]N[5]H)	B(C[6]C[6]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](BC[6]N[5]2)(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[6]C[6]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	126.0273	0.534	3	126.0273	0.285	3	126.0273	0.285	3	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(C[5]C[5]H)(C[5]N[5]H)	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]2N[5])(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|H<1>}	125.6150	0.000	1	125.6150	0.000	1	125.6089	0.501	7	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]2N[5])(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<4>,1|C<4>}	125.9203	0.755	4	125.6078	0.601	6	125.6089	0.501	7	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]2N[5])(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<5>,1|C<4>}	124.9830	0.355	2	125.6078	0.601	6	125.6089	0.501	7	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(C[5]C[5]H)(C[5]N[5]H)	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H)	N[5](BC[6a]2N[5])(C[5]C[5]H)(C[5]N[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)2(N[5]C[5]2)2	C[5](N[5]C[5]B)(N[5]C[5]C)(H){2|H<1>}	127.6160	0.000	1	127.6160	0.000	1	127.6160	0.000	1	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	121.1747	1.971	6	121.1747	3.886	6	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]C)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H){2|C<4>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]C)(N[5]C[5]B)(H){1|Fe<6>,1|C<4>}	129.4180	1.405	3	129.4180	1.975	3	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<4>,1|C<3>}	131.0826	2.461	15	130.1508	5.467	27	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<6>,1|C<3>}	129.7867	1.030	3	130.1508	5.467	27	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<8>,1|C<3>}	128.8993	1.436	3	130.1508	5.467	27	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Fe)(C[5]C[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Fe<4>,1|C<4>}	128.6292	1.955	6	130.1508	5.467	27	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Mn)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Mn)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Mn<4>,1|C<3>}	128.5557	1.993	12	128.5704	3.346	15	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Mn)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Mn)(C[5]C[5]H){1|C<3>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Mn<6>,1|C<3>}	128.6293	1.256	3	128.5704	3.346	15	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(C[5]N[5]Ni)(C[5]C[5]H)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BC[6a]N[5]2)(C[5]N[5]Ni)(C[5]C[5]H){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|Ni<4>,1|C<4>}	128.8497	1.811	3	128.8497	3.280	3	128.6015	11.639	54	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:N[6]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5]2N[6])(C[5]C[5]H)(C[5]N[5]S)	B(N[5]C[5]2)3(N[6]C[6]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](BN[5]2N[6])(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(N[6]C[6]2)	C[5](C[5]N[5]H)(N[5]C[5]B)(H){1|C<4>,1|S<2>}	123.3313	2.111	3	123.3313	4.455	3	123.3313	4.455	3	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5a]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5a]2)(C[5]C[5]H)(N[5]C[5]H)	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5a]2)(C[5]C[5]H)(N[5]C[5]H){1|C<4>,1|H<1>}	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|C<4>,1|H<1>}	131.5710	0.000	1	131.5710	0.000	1	131.5710	0.000	1	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[6]N[5])(N[5]C[5]Co)(C[5]C[5]H)	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]C[6]N[5])(N[5]C[5]Co)(C[5]C[5]H){2|H<1>}	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<6>,1|H<1>}	130.5023	1.752	4	130.5023	3.069	4	130.9712	3.562	40	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[6]N[5])(N[5]C[5]Fe)(C[5]C[5]H)	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]C[6]N[5])(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>}	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<5>,1|H<1>}	129.6583	1.409	4	131.0766	3.785	28	130.9712	3.562	40	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[6]N[5])(N[5]C[5]Fe)(C[5]C[5]H)	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]C[6]N[5])(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>}	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	131.3130	1.943	24	131.0766	3.785	28	130.9712	3.562	40	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[6]N[5])(N[5]C[5]Li)(C[5]C[5]H)	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]C[6]N[5])(N[5]C[5]Li)(C[5]C[5]H){2|H<1>}	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Li<4>,1|H<1>}	129.9183	0.498	4	129.9183	0.248	4	130.9712	3.562	40	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]C[6]N[5])(N[5]C[5]Sc)(C[5]C[5]H)	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]C[6]N[5])(N[5]C[5]Sc)(C[5]C[5]H){2|H<1>}	B(C[6]C[6]N[6])(N[5]C[5]N[5])2(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Sc<8>,1|H<1>}	131.7548	2.497	4	131.7548	6.234	4	130.9712	3.562	40	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(N[5]C[5]Co)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]2N[5])(N[5]C[5]Co)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Co<5>,1|H<1>}	128.2165	0.349	2	128.2165	0.122	2	127.7385	2.569	17	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|H<1>}	126.8888	1.181	5	126.8888	1.395	5	127.7385	2.569	17	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(N[5]C[5]Pt)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]2N[5])(N[5]C[5]Pt)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Pt<4>,1|H<1>}	128.3053	1.994	8	128.3053	3.975	8	127.7385	2.569	17	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(N[5]C[5]Ru)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]2N[5])(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<9>,1|H<1>}	127.1180	0.414	2	127.1180	0.172	2	127.7385	2.569	17	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|C<4>}	130.2894	1.656	33	130.6645	3.362	42	130.6865	3.448	48	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	132.0401	1.886	9	130.6645	3.362	42	130.6865	3.448	48	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Li)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Li)(C[5]C[5]H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Li<3>,1|C<4>}	129.7080	1.192	3	129.7080	1.421	3	130.6865	3.448	48	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]2)(N[5]C[5]Ru)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5]2)(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])3(C[6a]C[6a]2)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<6>,1|H<1>}	131.9727	2.599	3	131.9727	6.753	3	130.6865	3.448	48	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]2)(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<6>,1|H<1>}	133.1892	1.514	9	133.1892	2.293	9	132.6668	2.559	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]2)(N[5]C[5]Mn)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]2)(N[5]C[5]Mn)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mn<6>,1|H<1>}	132.8953	1.842	3	132.8953	3.393	3	132.6668	2.559	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]N[5]2)(N[5]C[5]Re)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]N[5]2)(N[5]C[5]Re)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	131.7688	1.478	6	131.7688	2.185	6	132.6668	2.559	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|H<1>}	127.1465	1.213	2	127.1465	1.471	2	127.6964	2.435	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]2N[5])(N[5]C[5]Ir)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]2N[5])(N[5]C[5]Ir)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<6>,1|H<1>}	127.1660	0.444	2	127.1660	0.197	2	127.6964	2.435	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5a]-3:N[5a]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]2N[5])(N[5]C[5]Re)(C[5]C[5]H)	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BN[5a]2N[5])(N[5]C[5]Re)(C[5]C[5]H){2|H<1>}	B(N[5a]C[5a]N[5a])2(N[5]C[5]N[5])2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Re<6>,1|H<1>}	127.8507	1.715	14	127.8507	2.941	14	127.6964	2.435	18	129.3423	8.621	226	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:2:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:S-2:	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(SCu)	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(SCu){2|H<1>}	131.3080	2.123	3	131.3080	4.507	3	131.0075	3.437	6	130.3746	3.801	9	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:2:	B-4:C[5]-3:C[5]-3:	C[6a]-3:N[5]-3:N[5]-3:N[5]-3:	N[5]-3:N[5]-3:S-2:	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S)	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(SMn)	N[5](BC[6a]N[5]2)(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(C[6a]C[6a]2)(N[5]C[5]2)3	C[5](N[5]C[5]B)(N[5]C[5]C)(SMn){2|H<1>}	130.7070	1.953	3	130.7070	3.815	3	131.0075	3.437	6	130.3746	3.801	9	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:2:	B-4:C[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:N[6]-3:	N[5]-3:N[5]-3:S-2:	N[5](BN[5]2N[6])(C[5]C[5]H)(C[5]N[5]S)	B(N[5]C[5]2)3(N[6]C[6]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh)	N[5](BN[5]2N[6])(C[5]C[5]H)(C[5]N[5]S){1|C<4>,1|H<1>}	B(N[5]C[5]2)3(N[6]C[6]2)	C[5](N[5]C[5]B)(N[5]C[5]C)(SRh){2|H<1>}	129.1087	1.734	3	129.1087	3.007	3	129.1087	3.007	3	130.3746	3.801	9	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:4:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C-4:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]N[5]C)(N[5]C[5]Li)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]N[5]C)(N[5]C[5]Li)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)(CHHP)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Li<4>,1|H<1>}	126.8645	0.747	2	126.8645	0.559	2	126.8645	0.559	2	130.8755	6.351	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:4:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[5]-4:	C[5]-3:N[5]-3:H-1:	N[5](BC[5]N[5]2)(N[5]C[5]Mn)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[5]C[5]2Mn)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[5]N[5]2)(N[5]C[5]Mn)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])3(C[5]C[5]2Mn)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mn<6>,1|H<1>}	132.0737	1.705	6	132.0737	2.908	6	131.5440	4.042	12	130.8755	6.351	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:4:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[5]-4:	C[5]-3:N[5]-3:H-1:	N[5](BC[5]N[5]2)(N[5]C[5]Mo)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[5]C[5]2Fe)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[5]N[5]2)(N[5]C[5]Mo)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])3(C[5]C[5]2Fe)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Mo<8>,1|H<1>}	129.4727	1.755	3	129.4727	3.080	3	131.5440	4.042	12	130.8755	6.351	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:4:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:N[5]-3:C[5]-4:	C[5]-3:N[5]-3:H-1:	N[5](BC[5]N[5]2)(N[5]C[5]Zn)(C[5]C[5]H)	B(N[5]C[5]N[5])3(C[5]C[5]2Mn)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[5]N[5]2)(N[5]C[5]Zn)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])3(C[5]C[5]2Mn)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Zn<6>,1|H<1>}	132.5560	1.751	3	132.5560	3.065	3	131.5440	4.042	12	130.8755	6.351	14	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:1:	3:3:1:	B-4:C[5]-3:N[5]-3:	N[5]-3:N[5]-3:C[5]-4:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]B)	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H)	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]B){1|H<1>,1|I<1>}	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H){1|B<4>,1|H<1>}	127.7052	1.263	5	127.7052	1.595	5	128.2995	3.395	6	127.9743	3.570	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:1:	3:3:1:	B-4:C[5]-3:N[5]-3:	N[5]-3:N[5]-3:C[5]-4:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]H)	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H)	N[5](BC[5]N[5]H)(C[5]C[5]H)(N[5]C[5]H){1|H<1>,1|I<1>}	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H){2|H<1>}	131.2710	0.000	1	131.2710	0.000	1	128.2995	3.395	6	127.9743	3.570	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:1:	3:3:1:	B-4:C[5]-3:N[5]-3:	N[5a]-3:N[5]-3:C[5]-4:H-1:	C[5]-3:N[5]-3:H-1:	N[5](BN[5a]C[5]H)(C[5]C[5]H)(N[5]C[5]B)	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H)	N[5](BN[5a]C[5]H)(C[5]C[5]H)(N[5]C[5]B){1|H<1>,1|I<1>}	B(N[5a]C[5a]N[5a])(N[5]C[5]N[5])(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]I)(N[5]N[5]B)(H){1|B<4>,1|H<1>}	126.0230	0.000	1	126.0230	0.000	1	126.0230	0.000	1	127.9743	3.570	7	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[5]-4:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BC[5]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C)	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BC[5]N[5]H)(N[5]C[5]Ni)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Ni<4>,1|C<4>}	127.5667	2.167	4	127.5667	4.695	4	126.8681	2.703	8	126.8681	2.703	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:1:	3:3:4:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[5]-4:H-1:	C[5]-3:N[5]-3:C-4:	N[5](BC[5]N[5]H)(N[5]C[5]Zn)(C[5]C[5]C)	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](BC[5]N[5]H)(N[5]C[5]Zn)(C[5]C[5]C){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])2(C[5]C[5]2Fe)(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Zn<4>,1|C<4>}	126.1695	0.557	4	126.1695	0.310	4	126.8681	2.703	8	126.8681	2.703	8	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:4:4:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6]-4:C-4:	C[5]-3:N[5]-3:H-1:	N[5](BC[6]N[5]C)(N[5]C[5]Fe)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6]C[6]2Fe)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6]N[5]C)(N[5]C[5]Fe)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6]C[6]2Fe)(CC3)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Fe<5>,1|H<1>}	134.8330	0.355	2	134.8330	0.126	2	134.8330	0.126	2	134.8330	0.126	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:3:	4:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	C[6,6]-4:N[5]-3:N[5]-3:N[5]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6,6]N[5]2)(N[5]C[5]Ru)(C[5]C[5]H)	B(C[6,6]C[6,6]2H)(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6,6]N[5]2)(N[5]C[5]Ru)(C[5]C[5]H){2|H<1>}	B(C[6,6]C[6,6]2H)(N[5]C[5]N[5])3	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ru<9>,1|H<1>}	130.1523	1.523	3	130.1523	2.319	3	130.1523	2.319	3	130.1523	2.319	3	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:4:	3:3:1:1:	3:3:1:	C[5]-4:C[5]-3:B-4:	N[5]-3:N[5]-3:H-1:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]N[5]Li2)(C[5]C[5]H)(BN[5]HH)	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H)	N[5](C[5]N[5]Li2)(C[5]C[5]H)(BN[5]HH){1|C<3>,1|H<1>}	B(N[5]C[5]2)2(H)2	C[5](C[5]N[5]H)(N[5]C[5]B)(H){2|Li<3>,1|C<3>}	124.9300	0.000	1	124.9300	0.000	1	124.9300	0.000	1	124.9300	0.000	1	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP2_SP2_SP3	N[5]	B	C[5]	4:3:4:	3:3:2:1:	3:2:2:	C[5]-4:C[5]-3:B-4:	N[5]-3:N[5]-3:H-2:H-1:	N[5]-3:S[5]-2:S-2:	N[5](C[5]C[5]HH)(C[5]S[5]S)(BN[5]HH)	B(N[5]C[5]2)2(HAg)(H)	C[5](N[5]C[5]B)(S[5]C[5])(SAg)	N[5](C[5]C[5]HH)(C[5]S[5]S)(BN[5]HH){2|H<1>}	B(N[5]C[5]2)2(HAg)(H)	C[5](N[5]C[5]B)(S[5]C[5])(SAg){4|H<1>}	130.1235	0.521	2	130.1235	0.272	2	130.1235	0.272	2	130.1235	0.272	2	128.9770	12.740	4548	128.9779	12.733	4551
542	610	818	0:SP3_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	C[5]-3:N[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](C[5]C[5]H)(N[5]C[5]W)(BN[5]2H){2|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|H<1>,1|W<7>}	128.5810	0.000	1	128.5810	0.000	1	128.5810	0.000	1	129.3530	1.797	4	128.6315	4.015	6	128.6315	4.015	6
542	610	818	0:SP3_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<6>,1|C<3>}	129.1430	1.813	2	129.6103	2.299	3	129.6103	2.299	3	129.3530	1.797	4	128.6315	4.015	6	128.6315	4.015	6
542	610	818	0:SP3_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:1:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:H-1:	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](N[5]C[5]Ir)(C[5]C[5]H)(BN[5]2H){1|C<3>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Ir<7>,1|C<3>}	130.5450	0.000	1	129.6103	2.299	3	129.6103	2.299	3	129.3530	1.797	4	128.6315	4.015	6	128.6315	4.015	6
542	610	818	0:SP3_SP2_SP3	N[5]	B	C[5]	3:3:4:	3:3:3:1:	3:3:4:	N[5]-3:C[5]-3:B-4:	N[5]-3:N[5]-3:N[5]-3:H-1:	C[5]-3:N[5]-3:C-4:	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H)	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3)	N[5](N[5]C[5]Rh)(C[5]C[5]C)(BN[5]2H){1|C<4>,1|H<1>}	B(N[5]C[5]N[5])3(H)	C[5](C[5]C[5]H)(N[5]N[5]B)(CH3){1|Rh<6>,1|C<4>}	129.2420	0.000	1	129.2420	0.000	1	129.2420	0.000	1	129.2420	0.000	1	128.6315	4.015	6	128.6315	4.015	6
542	610	818	0:SP3_SP2_SP3	N[5]	B	C[5]	4:3:3:	3:3:3:3:	3:3:1:	B-4:N[5]-3:C[5]-3:	N[5]-3:N[5]-3:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:H-1:	N[5](BC[6a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H)	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H)	N[5](BC[6a]2N[5])(N[5]C[5]Cu)(C[5]C[5]H){2|H<1>}	B(N[5]C[5]N[5])2(C[6a]C[6a]2)2	C[5](C[5]C[5]H)(N[5]N[5]B)(H){1|Cu<4>,1|H<1>}	125.1350	0.000	1	125.1350	0.000	1	125.1350	0.000	1	125.1350	0.000	1	128.6315	4.015	6	128.6315	4.015	6