976	818	885	5:SP2_SP-NON_SP2	O[5]	C[5]	Ga[5]	4:3:	3:2:1:	3:2:2:2:	Ga[5]-4:C[5]-3:	C[5,6]-3:O[5]-2:O-1:	N[5,6]-3:O[5]-2:O-2:O-2:	O[5](Ga[5]N[5,6]OO)(C[5]C[5,6]O)	C[5](C[5,6]N[5,6]C[6])(O[5]Ga[5])(O)	Ga[5](N[5,6]C[5,6]C[6])(O[5]C[5])(OC)2	O[5](Ga[5]N[5,6]OO)(C[5]C[5,6]O){2|C<3>}	C[5](C[5,6]N[5,6]C[6])(O[5]Ga[5])(O){1|H<1>,2|C<3>,2|O<2>}	Ga[5](N[5,6]C[5,6]C[6])(O[5]C[5])(OC)2{1|C<4>,1|O<1>,2|C<3>}	116.9700	0.000	1	116.9700	0.000	1	116.9700	0.000	1	116.9700	0.000	1	115.9593	17.096	3	115.9593	17.096	3
976	818	885	5:SP2_SP-NON_SP2	O[5]	C[5]	Ga[5]	4:3:	4:2:1:	2:2:4:4:	Ga[5]-4:C[5]-3:	C[5]-4:O[5]-2:O-1:	O[5]-2:O[5]-2:C-4:C-4:	O[5](Ga[5]O[5]CC)(C[5]C[5]O)	C[5](C[5]O[5]CH)(O[5]Ga[5])(O)	Ga[5](O[5]C[5])2(CH3)2	O[5](Ga[5]O[5]CC)(C[5]C[5]O){1|C<4>,1|H<1>}	C[5](C[5]O[5]CH)(O[5]Ga[5])(O){2|C<4>}	Ga[5](O[5]C[5])2(CH3)2{1|C<4>,1|H<1>,1|O<1>}	111.4130	0.000	1	111.4130	0.000	1	111.4130	0.000	1	111.4130	0.000	1	115.9593	17.096	3	115.9593	17.096	3
976	818	885	5:SP2_SP-NON_SP2	O[5]	C[5]	Ga[5]	4:3:	4:2:1:	4:2:2:2:	Ga[5]-4:C[5]-3:	C[5]-4:O[5]-2:O-1:	N[5]-4:O[5]-2:O-2:O-2:	O[5](Ga[5]N[5]OO)(C[5]C[5]O)	C[5](C[5]N[5]CH)(O[5]Ga[5])(O)	Ga[5](N[5]C[5]CH)(O[5]C[5])(OC)2	O[5](Ga[5]N[5]OO)(C[5]C[5]O){2|C<4>,2|H<1>}	C[5](C[5]N[5]CH)(O[5]Ga[5])(O){1|C<4>,1|H<1>,2|O<2>}	Ga[5](N[5]C[5]CH)(O[5]C[5])(OC)2{1|C<4>,1|H<1>,1|O<1>}	119.4950	0.000	1	119.4950	0.000	1	119.4950	0.000	1	119.4950	0.000	1	115.9593	17.096	3	115.9593	17.096	3
976	818	894	5:SP2_SP2_SPD6	O[5]	C[5]	P[3x5]	6:3:	3:2:1:	3:3:3:2:2:2:	P[3x5]-6:C[5]-3:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:C[5,6a]-3:C[5,6a]-3:O[5]-2:O[5]-2:O[5]-2:	O[5](P[3x5]C[5,6a]3O[5]2)(C[5]C[5,6a]O)	C[5](C[5,6a]C[5,6a]C[6a])(O[5]P[3x5])(O)	P[3x5](C[5,6a]C[5,6a]C[6a])3(O[5]C[5])3	O[5](P[3x5]C[5,6a]3O[5]2)(C[5]C[5,6a]O){8|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(O[5]P[3x5])(O){1|H<1>,2|O<2>,4|C<3>}	P[3x5](C[5,6a]C[5,6a]C[6a])3(O[5]C[5])3{3|H<1>,3|O<1>,6|C<3>}	115.8793	0.577	6	115.8793	0.333	6	115.8793	0.333	6	115.8793	0.333	6	115.8793	0.333	6	115.8793	0.333	6
976	818	905	5:SP2_SP2_SPD5	O[5]	C[5]	I[5]	5:3:	3:2:1:	3:2:2:2:2:	I[5]-5:C[5]-3:	C[5,6a]-3:O[5]-2:O-1:	C[5,6a]-3:O[5]-2:O-2:O-2:O-2:	O[5](I[5]C[5,6a]O3)(C[5]C[5,6a]O)	C[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(O)	I[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OC)2(OS)	O[5](I[5]C[5,6a]O3)(C[5]C[5,6a]O){2|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(O[5]I[5])(O){1|H<1>,2|C<3>,3|O<2>}	I[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(OC)2(OS){1|H<1>,1|O<1>,2|C<3>}	115.8850	0.000	1	115.8850	0.000	1	115.8850	0.000	1	115.8850	0.000	1	115.8850	0.000	1	115.8850	0.000	1
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[3x5]	3:6:	3:2:2:	2:2:2:2:2:2:	C[5]-3:Si[3x5]-6:	C[6a]-3:O[5]-2:N[5]-2:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5](C[5]C[6a]N[5])(Si[3x5]O[5]5)	C[5](C[6a]C[6a]2)(O[5]Si[3x5])(N[5]O[5])	Si[3x5](O[5]C[5])3(O[5]N[5])3	O[5](C[5]C[6a]N[5])(Si[3x5]O[5]5){2|N<2>,4|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[3x5])(N[5]O[5]){2|C<3>,2|H<1>,4|O<2>}	Si[3x5](O[5]C[5])3(O[5]N[5])3{3|C<3>}	111.2981	0.561	9	111.2981	0.315	9	111.2981	0.315	9	111.2981	0.315	9	111.8949	2.639	15	112.4340	3.223	19
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[3x5]	6:3:	2:2:4:	2:2:2:2:2:2:	Si[3x5]-6:C[5]-3:	O[5]-2:N[5]-2:C-4:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5](Si[3x5]O[5]5)(C[5]N[5]C)	C[5](O[5]Si[3x5])(N[5]O[5])(CH3)	Si[3x5](O[5]C[5])3(O[5]N[5])3	O[5](Si[3x5]O[5]5)(C[5]N[5]C){2|C<3>,2|N<2>}	C[5](O[5]Si[3x5])(N[5]O[5])(CH3){4|O<2>}	Si[3x5](O[5]C[5])3(O[5]N[5])3{3|C<4>}	110.7913	0.382	3	110.7913	0.146	3	110.7913	0.146	3	110.7913	0.146	3	111.8949	2.639	15	112.4340	3.223	19
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[3x5]	6:3:	2:4:1:	2:2:2:2:2:2:	Si[3x5]-6:C[5]-3:	O[5]-2:C[5]-4:O-1:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5](Si[3x5]O[5]5)(C[5]C[5]O)	C[5](O[5]Si[3x5])(C[5]O[5]HH)(O)	Si[3x5](O[5]C[5])6	O[5](Si[3x5]O[5]5)(C[5]C[5]O){2|C<3>,2|C<4>,2|H<1>}	C[5](O[5]Si[3x5])(C[5]O[5]HH)(O){4|O<2>}	Si[3x5](O[5]C[5])6{3|O<1>,6|H<1>}	114.7887	1.037	3	114.7887	1.076	3	114.7887	1.076	3	114.7887	1.076	3	111.8949	2.639	15	112.4340	3.223	19
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[5,5]	6:3:	3:2:2:	4:4:2:2:1:1:	Si[5,5]-6:C[5]-3:	C[6a]-3:O[5]-2:N[5]-2:	N[5]-4:N[5]-4:O[5]-2:O[5]-2:F-1:F-1:	O[5](Si[5,5]N[5]2O[5]FF)(C[5]C[6a]N[5])	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5])	Si[5,5](N[5]N[5]CC)2(O[5]C[5])2(F)2	O[5](Si[5,5]N[5]2O[5]FF)(C[5]C[6a]N[5]){1|N<2>,3|C<3>,4|C<4>}	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5]){1|N<4>,1|O<2>,2|C<3>,2|C<4>,2|F<1>,2|H<1>}	Si[5,5](N[5]N[5]CC)2(O[5]C[5])2(F)2{2|C<3>}	114.0950	0.000	1	114.0950	0.000	1	114.0950	0.000	1	114.0950	0.000	1	114.4557	0.122	4	112.4340	3.223	19
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[5,5]	6:3:	3:2:3:	3:3:2:2:1:1:	Si[5,5]-6:C[5]-3:	C[6a]-3:O[5]-2:N[5]-3:	N[5]-3:N[5]-3:O[5]-2:O[5]-2:Br-1:Br-1:	O[5](Si[5,5]N[5]2O[5]Br2)(C[5]C[6a]N[5])	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5]H)	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(Br)2	O[5](Si[5,5]N[5]2O[5]Br2)(C[5]C[6a]N[5]){1|H<1>,1|N<3>,5|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5]H){2|Br<1>,1|N<3>,1|O<2>,2|H<1>,3|C<3>}	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(Br)2{2|C<3>,2|H<1>}	114.2580	0.000	1	114.2580	0.000	1	114.2580	0.000	1	114.2580	0.000	1	114.4557	0.122	4	112.4340	3.223	19
976	818	928	5:SP2_SP2_SPD6	O[5]	C[5]	Si[5,5]	6:3:	3:3:2:	3:3:2:2:2:2:	Si[5,5]-6:C[5]-3:	C[5,5a]-3:C[6a]-3:O[5]-2:	N[5,5a]-3:N[5,5a]-3:O[5]-2:O[5]-2:N-2:N-2:	O[5](Si[5,5]N[5,5a]2O[5]NN)(C[5]C[5,5a]C[6a])	C[5](C[5,5a]N[5,5a]C[5a])(C[6a]C[6a]2)(O[5]Si[5,5])	Si[5,5](N[5,5a]C[5,5a]C[5a])2(O[5]C[5])2(NC)2	O[5](Si[5,5]N[5,5a]2O[5]NN)(C[5]C[5,5a]C[6a]){7|C<3>}	C[5](C[5,5a]N[5,5a]C[5a])(C[6a]C[6a]2)(O[5]Si[5,5]){1|C<4>,1|N<3>,1|O<2>,2|H<1>,2|N<2>,4|C<3>}	Si[5,5](N[5,5a]C[5,5a]C[5a])2(O[5]C[5])2(NC)2{2|C<4>,6|C<3>}	114.7350	0.205	2	114.7350	0.042	2	114.7350	0.042	2	114.7350	0.042	2	114.4557	0.122	4	112.4340	3.223	19
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5,5]	5:3:	3:2:3:	4:4:2:2:4:	Si[5,5]-5:C[5,6]-3:	N[5,6]-3:O[5]-2:C[6]-3:	C[5]-4:C[5]-4:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6])	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H)	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3)	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6]){1|N<3>,3|C<3>,5|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3){4|C<3>}	114.6362	0.609	5	114.8534	0.403	7	114.7236	0.310	11	114.7236	0.310	11	114.7236	0.310	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5,5]	5:3:	3:2:3:	4:4:2:2:4:	Si[5,5]-5:C[5,6]-3:	N[5,6]-3:O[5]-2:C[6]-3:	C[5]-4:C[5]-4:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6])	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H)	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3)	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6]){1|N<3>,3|C<3>,5|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]H){1|Cl<1>,1|C<3>,1|O<2>,2|C<4>,3|H<1>}	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3){4|C<3>}	115.3965	0.326	2	114.8534	0.403	7	114.7236	0.310	11	114.7236	0.310	11	114.7236	0.310	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5,5]	5:3:	3:2:3:	4:4:2:2:4:	Si[5,5]-5:C[5,6]-3:	N[5,6]-3:O[5]-2:C[6]-3:	C[5]-4:C[5]-4:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6])	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]N)	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3)	O[5](Si[5,5]C[5]2O[5]C)(C[5,6]N[5,6]C[6]){2|N<3>,3|C<3>,4|H<1>}	C[5,6](N[5,6]C[5]C[6])(O[5]Si[5,5])(C[6]C[6]N){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	Si[5,5](C[5]N[5,6]HH)2(O[5]C[5,6])2(CH3){4|C<3>}	114.4965	0.347	4	114.4965	0.120	4	114.7236	0.310	11	114.7236	0.310	11	114.7236	0.310	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	2:2:2:4:4:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	O[5]-2:O[5]-2:O-2:C-4:C-4:	O[5](C[5,6]N[5,6]C[6])(Si[5]O[5]CCO)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	Si[5](O[5]C[5,6])(O[5]N[5,6])(ON[6a])(CC3)2	O[5](C[5,6]N[5,6]C[6])(Si[5]O[5]CCO){1|H<1>,2|C<3>}	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	Si[5](O[5]C[5,6])(O[5]N[5,6])(ON[6a])(CC3)2{2|C<3>}	113.6100	0.000	1	113.6100	0.000	1	113.6100	0.000	1	113.6100	0.000	1	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	2:2:4:4:1:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	O[5]-2:O[5]-2:C-4:C-4:Cl-1:	O[5](C[5,6]N[5,6]C[6])(Si[5]O[5]ClCC)	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5])	Si[5](O[5]C[5,6])(O[5]N[5,6])(CH3)2(Cl)	O[5](C[5,6]N[5,6]C[6])(Si[5]O[5]ClCC){1|H<1>,2|C<3>}	C[5,6](N[5,6]C[6]O[5])(C[6]C[6]H)(O[5]Si[5]){1|Cl<1>,1|C<3>,2|C<4>,2|H<1>}	Si[5](O[5]C[5,6])(O[5]N[5,6])(CH3)2(Cl){2|C<3>}	113.4500	0.000	1	113.4500	0.000	1	113.4500	0.000	1	113.4500	0.000	1	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	4:2:4:4:1:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:Cl-1:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]ClCC)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(Cl)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]ClCC){2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){2|Cl<1>,1|C<3>,2|C<4>,3|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(Cl){2|C<3>}	115.3885	0.271	2	115.3885	0.073	2	115.3885	0.073	2	114.9633	0.579	3	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	4:2:4:4:1:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:F-1:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCF)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(F)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCF){2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|F<1>,3|C<4>,3|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(F){2|C<3>}	114.1130	0.000	1	114.1130	0.000	1	114.1130	0.000	1	114.9633	0.579	3	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	4:2:4:4:3:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:O-3:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(OHH)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO){2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|C<3>,1|O<3>,3|C<4>,3|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(OHH){2|C<3>}	115.2310	0.000	1	115.2985	0.009	2	114.4070	2.389	3	114.4070	2.389	3	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	4:2:4:4:3:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:O-3:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(OHH)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO){2|C<3>,3|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]H)(O[5]Si[5]){1|Cl<1>,1|C<3>,1|O<3>,2|C<4>,3|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CClHH)(CH3)(OHH){2|C<3>}	115.3660	0.000	1	115.2985	0.009	2	114.4070	2.389	3	114.4070	2.389	3	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:3:2:	4:2:4:4:3:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:O-3:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO)	C[5,6](N[5,6]C[6,6a]C[5])(C[6]C[6]H)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CH3)2(OHH)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO){2|C<3>,3|H<1>}	C[5,6](N[5,6]C[6,6a]C[5])(C[6]C[6]H)(O[5]Si[5]){1|O<3>,2|C<3>,2|C<4>,3|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CH3)2(OHH){2|C<3>}	112.6240	0.000	1	112.6240	0.000	1	114.4070	2.389	3	114.4070	2.389	3	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:4:2:	4:2:1:1:1:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-4:O[5]-2:	C[5]-4:O[5]-2:F-1:F-1:F-1:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]F3)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(F)3	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]F3){1|C<3>,1|C<4>,4|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5]){1|C<4>,1|O<1>,3|F<1>,4|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(F)3{1|C<3>,1|C<4>}	114.2320	0.000	1	114.2320	0.000	1	114.2320	0.000	1	114.2320	0.000	1	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5,6]	Si[5]	3:5:	3:4:2:	4:2:4:4:2:	C[5,6]-3:Si[5]-5:	N[5,6]-3:C[6]-4:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:O-2:	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO)	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5])	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CH3)2(OS)	O[5](C[5,6]N[5,6]C[6])(Si[5]C[5]CCO){1|C<3>,1|C<4>,4|H<1>}	C[5,6](N[5,6]C[5]C[6])(C[6]C[6]HH)(O[5]Si[5]){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	Si[5](C[5]N[5,6]HH)(O[5]C[5,6])(CH3)2(OS){1|C<3>,1|C<4>}	114.2065	0.074	2	114.2065	0.006	2	114.2065	0.006	2	114.2065	0.006	2	114.3469	0.849	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC3)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC3){1|C<3>,1|C<4>,1|N<3>,1|O<2>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	116.6620	0.000	1	114.1570	12.550	2	113.5770	7.084	4	113.5770	7.084	4	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC3)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC3){1|N<3>,1|O<2>,2|C<4>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	111.6520	0.000	1	114.1570	12.550	2	113.5770	7.084	4	113.5770	7.084	4	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC[6a]HH)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC[6a]HH){1|C<3>,1|C<4>,1|N<3>,1|O<2>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	114.9150	0.000	1	112.9970	7.357	2	113.5770	7.084	4	113.5770	7.084	4	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC[6a]HH)	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5,6])(N[5]N[5,6])(CC[6a]HH){1|N<3>,1|O<2>,2|C<4>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CH3){6|C<4>}	111.0790	0.000	1	112.9970	7.357	2	113.5770	7.084	4	113.5770	7.084	4	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:3:2:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:C[6a]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5])	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6])	Si[5,5,6](N[5,6]C[5,6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5]){1|C<4>,1|N<2>,4|C<3>}	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6]){1|C<4>,1|N<3>,1|O<2>,2|H<1>,3|C<3>}	Si[5,5,6](N[5,6]C[5,6]N[5])2(O[5]C[5])2(CH3){2|C<3>,4|C<4>}	114.8870	0.000	1	113.3895	4.485	2	113.7978	5.574	6	113.7978	5.574	6	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:3:2:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:C[6a]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5])	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6])	Si[5,5,6](N[5,6]C[5,6]N[5])2(O[5]C[5])2(CH3)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5]){1|C<4>,1|N<2>,4|C<3>}	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6]){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	Si[5,5,6](N[5,6]C[5,6]N[5])2(O[5]C[5])2(CH3){2|C<3>,4|C<4>}	111.8920	0.000	1	113.3895	4.485	2	113.7978	5.574	6	113.7978	5.574	6	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:3:2:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:C[6a]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5])	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6])	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5]){1|C<4>,1|N<2>,4|C<3>}	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6]){1|C<4>,1|N<3>,1|O<2>,2|H<1>,3|C<3>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH){2|C<3>,4|C<4>}	116.3610	0.503	2	114.0020	7.629	4	113.7978	5.574	6	113.7978	5.574	6	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5,6]	5:3:	2:3:2:	3:3:2:2:4:	Si[5,5,6]-5:C[5]-3:	O[5]-2:C[6a]-3:N[5]-2:	N[5,6]-3:N[5,6]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5])	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6])	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH)	O[5](Si[5,5,6]N[5,6]2O[5]C)(C[5]C[6a]N[5]){1|C<4>,1|N<2>,4|C<3>}	C[5](O[5]Si[5,5,6])(C[6a]C[6a]2)(N[5]N[5,6]){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	Si[5,5,6](N[5,6]C[6]N[5])2(O[5]C[5])2(CCHH){2|C<3>,4|C<4>}	111.6430	0.611	2	114.0020	7.629	4	113.7978	5.574	6	113.7978	5.574	6	113.7095	5.471	10	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5]-3:N[5]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5]N[5]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5])(N[5]N[5])(CH3)	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(CH3)	O[5](Si[5,5]N[5]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5])(N[5]N[5])(CH3){1|C<3>,1|C<4>,1|N<3>,1|O<2>}	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(CH3){2|C<4>}	115.6525	0.030	2	114.1190	3.428	4	114.1190	3.428	4	114.1190	3.428	4	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:2:4:	3:3:2:2:4:	Si[5,5]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[5]-3:N[5]-3:O[5]-2:O[5]-2:C-4:	O[5](Si[5,5]N[5]2O[5]C)(C[5]N[5]C)	C[5](O[5]Si[5,5])(N[5]N[5])(CH3)	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(CH3)	O[5](Si[5,5]N[5]2O[5]C)(C[5]N[5]C){1|C<4>,1|N<2>,2|C<3>}	C[5](O[5]Si[5,5])(N[5]N[5])(CH3){1|N<3>,1|O<2>,2|C<4>}	Si[5,5](N[5]N[5]C)2(O[5]C[5])2(CH3){2|C<4>}	112.5855	0.936	2	114.1190	3.428	4	114.1190	3.428	4	114.1190	3.428	4	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:2:4:	3:4:4:2:2:	Si[5,5]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	C[6a]-3:N[5]-4:N[5]-4:O[5]-2:O[5]-2:	O[5](Si[5,5]C[6a]N[5]2O[5])(C[5]N[5]C)	C[5](O[5]Si[5,5])(N[5]N[5])(CH3)	Si[5,5](C[6a]C[6a]2)(N[5]N[5]CC)2(O[5]C[5])2	O[5](Si[5,5]C[6a]N[5]2O[5])(C[5]N[5]C){1|N<2>,3|C<3>,4|C<4>}	C[5](O[5]Si[5,5])(N[5]N[5])(CH3){1|C<3>,1|N<4>,1|O<2>,2|C<4>}	Si[5,5](C[6a]C[6a]2)(N[5]N[5]CC)2(O[5]C[5])2{2|C<3>,2|C<4>,2|H<1>}	113.6160	1.144	2	113.6160	1.309	2	113.6160	1.309	2	113.6160	1.309	2	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:2:4:	4:4:3:2:2:	Si[5,5]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	C[6]-4:N[5]-4:N[5]-3:O[5]-2:O[5]-2:	O[5](Si[5,5]C[6]N[5]2O[5])(C[5]N[5]C)	C[5](O[5]Si[5,5])(N[5]N[5])(CF3)	Si[5,5](C[6]C[6]2H)(N[5]N[5]CC)(N[5]N[5]C)(O[5]C[5])2	O[5](Si[5,5]C[6]N[5]2O[5])(C[5]N[5]C){1|C<3>,1|H<1>,1|N<2>,5|C<4>}	C[5](O[5]Si[5,5])(N[5]N[5])(CF3){1|N<3>,1|O<2>,3|C<4>}	Si[5,5](C[6]C[6]2H)(N[5]N[5]CC)(N[5]N[5]C)(O[5]C[5])2{4|C<4>,4|H<1>}	112.6900	0.000	1	111.3875	3.393	2	111.3875	3.393	2	111.3875	3.393	2	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:2:4:	4:4:3:2:2:	Si[5,5]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	C[6]-4:N[5]-4:N[5]-3:O[5]-2:O[5]-2:	O[5](Si[5,5]C[6]N[5]2O[5])(C[5]N[5]C)	C[5](O[5]Si[5,5])(N[5]N[5])(CF3)	Si[5,5](C[6]C[6]2H)(N[5]N[5]CC)(N[5]N[5]C)(O[5]C[5])2	O[5](Si[5,5]C[6]N[5]2O[5])(C[5]N[5]C){1|C<3>,1|H<1>,1|N<2>,5|C<4>}	C[5](O[5]Si[5,5])(N[5]N[5])(CF3){1|N<4>,1|O<2>,2|C<4>}	Si[5,5](C[6]C[6]2H)(N[5]N[5]CC)(N[5]N[5]C)(O[5]C[5])2{4|C<4>,4|H<1>}	110.0850	0.000	1	111.3875	3.393	2	111.3875	3.393	2	111.3875	3.393	2	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	2:4:3:	2:2:2:2:4:	Si[5,5]-5:C[5]-3:	O[5]-2:C[5]-4:N-3:	O[5]-2:O[5]-2:S[5]-2:S[5]-2:C-4:	O[5](Si[5,5]O[5]S[5]2C)(C[5]C[5]N)	C[5](O[5]Si[5,5])(C[5]S[5]HH)(NCC)	Si[5,5](O[5]C[5])2(S[5]C[5])2(CH3)	O[5](Si[5,5]O[5]S[5]2C)(C[5]C[5]N){1|C<3>,1|C<4>,2|H<1>}	C[5](O[5]Si[5,5])(C[5]S[5]HH)(NCC){1|C<4>,1|O<2>,1|S<2>}	Si[5,5](O[5]C[5])2(S[5]C[5])2(CH3){2|N<3>,4|H<1>}	121.4015	0.189	2	121.4015	0.036	2	121.4015	0.036	2	121.4015	0.036	2	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	3:2:2:	3:4:3:2:2:	Si[5,5]-5:C[5]-3:	C[6a]-3:O[5]-2:N[5]-2:	C[6a]-3:N[5]-4:N[5]-3:O[5]-2:O[5]-2:	O[5](Si[5,5]C[6a]N[5]2O[5])(C[5]C[6a]N[5])	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5])	Si[5,5](C[6a]C[6a]2)(N[5]C[5]CH)(N[5]N[5]C)(O[5]C[5])2	O[5](Si[5,5]C[6a]N[5]2O[5])(C[5]C[6a]N[5]){1|H<1>,3|C<4>,5|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[5,5])(N[5]N[5]){1|N<4>,1|O<2>,2|H<1>,4|C<3>}	Si[5,5](C[6a]C[6a]2)(N[5]C[5]CH)(N[5]N[5]C)(O[5]C[5])2{1|C<4>,4|C<3>,4|H<1>}	117.3080	0.000	1	117.3080	0.000	1	117.3080	0.000	1	117.3080	0.000	1	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	3:2:2:	5:2:2:4:2:	Si[5,5]-5:C[5]-3:	C[6a]-3:O[5]-2:O[5]-2:	Si[5,5]-5:O[5]-2:O[5]-2:C-4:O-2:	O[5](Si[5,5]Si[5,5]O[5]CO)(C[5]C[6a]O[5])	C[5](C[6a]C[6a]2)(O[5]Si[5,5])2	Si[5,5](Si[5,5]O[5]2CO)(O[5]C[5])2(CH3)(OC)	O[5](Si[5,5]Si[5,5]O[5]CO)(C[5]C[6a]O[5]){1|C<4>,2|O<2>,3|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[5,5])2{2|C<3>,4|C<4>,4|O<2>}	Si[5,5](Si[5,5]O[5]2CO)(O[5]C[5])2(CH3)(OC){2|C<3>}	118.6095	0.107	2	118.6095	0.011	2	118.6095	0.011	2	118.6095	0.011	2	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	3:3:2:	3:3:3:2:2:	Si[5,5]-5:C[5]-3:	C[5]-3:C[6a]-3:O[5]-2:	C[5,5]-3:C[6a]-3:C[6a]-3:O[5]-2:O[5]-2:	O[5](Si[5,5]C[5,5]C[6a]2O[5])(C[5]C[6a]C[5])	C[5](C[5]C[5,5]C[6a])(C[6a]C[6a]2)(O[5]Si[5,5])	Si[5,5](C[5,5]C[5]2)(C[6a]C[6a]2)2(O[5]C[5])2	O[5](Si[5,5]C[5,5]C[6a]2O[5])(C[5]C[6a]C[5]){9|C<3>}	C[5](C[5]C[5,5]C[6a])(C[6a]C[6a]2)(O[5]Si[5,5]){1|O<2>,2|H<1>,7|C<3>}	Si[5,5](C[5,5]C[5]2)(C[6a]C[6a]2)2(O[5]C[5])2{4|H<1>,8|C<3>}	113.6990	0.000	1	113.6990	0.000	1	113.6990	0.000	1	113.6990	0.000	1	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	4:2:1:	2:2:2:2:2:	Si[5,5]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	O-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5](Si[5,5]O[5]3O)(C[5]C[5]O)	C[5](C[5]C[6a]2O[5])(O[5]Si[5,5])(O)	Si[5,5](OSi[5,5])(O[5]C[5])4	O[5](Si[5,5]O[5]3O)(C[5]C[5]O){1|C<4>,3|C<3>}	C[5](C[5]C[6a]2O[5])(O[5]Si[5,5])(O){3|O<2>,4|C<3>}	Si[5,5](OSi[5,5])(O[5]C[5])4{2|O<1>,4|C<3>}	114.3235	0.476	4	114.3235	0.227	4	114.3235	0.227	4	114.4832	0.205	6	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	4:2:1:	2:2:2:2:2:	Si[5,5]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O-2:	O[5](Si[5,5]O[5]3O)(C[5]C[5]O)	C[5](C[5]C[6a]2O[5])(O[5]Si[5,5])(O)	Si[5,5](O[5]C[5])4(OH)	O[5](Si[5,5]O[5]3O)(C[5]C[5]O){1|C<4>,3|C<3>}	C[5](C[5]C[6a]2O[5])(O[5]Si[5,5])(O){3|O<2>,4|C<3>}	Si[5,5](O[5]C[5])4(OH){2|O<1>,4|C<3>}	114.8025	0.200	2	114.8025	0.040	2	114.8025	0.040	2	114.4832	0.205	6	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,5]	5:3:	4:2:1:	3:2:2:2:2:	Si[5,5]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	C[6a]-3:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5](Si[5,5]C[6a]O[5]3)(C[5]C[5]O)	C[5](C[5]C[5]O[5]H)(O[5]Si[5,5])(O)	Si[5,5](C[6a]C[6a]2)(O[5]C[5])4	O[5](Si[5,5]C[6a]O[5]3)(C[5]C[5]O){1|H<1>,2|C<4>,3|C<3>}	C[5](C[5]C[5]O[5]H)(O[5]Si[5,5])(O){1|H<1>,2|C<3>,3|O<2>}	Si[5,5](C[6a]C[6a]2)(O[5]C[5])4{2|C<3>,2|C<4>,2|O<1>,4|H<1>}	114.3603	0.197	4	114.3603	0.039	4	114.3603	0.039	4	114.3603	0.039	4	115.0772	7.276	24	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,6]	5:3:	2:2:4:	3:3:3:2:1:	Si[5,6]-5:C[5]-3:	O[5]-2:N[5]-2:C-4:	N[6]-3:N[6]-3:N[5]-3:O[5]-2:H-1:	O[5](Si[5,6]N[5]N[6]2H)(C[5]N[5]C)	C[5](O[5]Si[5,6])(N[5]N[5])(CH3)	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5])(H)	O[5](Si[5,6]N[5]N[6]2H)(C[5]N[5]C){5|C<3>}	C[5](O[5]Si[5,6])(N[5]N[5])(CH3){1|C<3>,1|H<1>,2|N<3>}	Si[5,6](N[6]C[6a]C[6])2(N[5]N[5]C)(O[5]C[5])(H){3|C<4>,5|C<3>}	114.4990	0.000	1	114.4990	0.000	1	114.4990	0.000	1	114.4990	0.000	1	117.8558	5.090	4	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5,6]	5:3:	4:2:1:	3:2:2:4:4:	Si[5,6]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	N[5,6]-3:O[5]-2:O[6]-2:C-4:C-4:	O[5](Si[5,6]N[5,6]O[6]CC)(C[5]C[5]O)	C[5](C[5]N[5,6]CH)(O[5]Si[5,6])(O)	Si[5,6](N[5,6]C[5]C[6])(O[5]C[5])(O[6]C[6])(CH3)2	O[5](Si[5,6]N[5,6]O[6]CC)(C[5]C[5]O){1|C<4>,1|H<1>,2|C<3>}	C[5](C[5]N[5,6]CH)(O[5]Si[5,6])(O){1|C<3>,1|O<2>,2|C<4>}	Si[5,6](N[5,6]C[5]C[6])(O[5]C[5])(O[6]C[6])(CH3)2{1|C<3>,1|H<1>,1|O<1>,3|C<4>}	118.9747	0.350	3	118.9747	0.123	3	118.9747	0.123	3	118.9747	0.123	3	117.8558	5.090	4	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	3:5:	3:2:2:	2:2:4:4:1:	C[5]-3:Si[5]-5:	C[6a]-3:O[5]-2:N[5]-2:	O[5]-2:O[5]-2:C-4:C-4:F-1:	O[5](C[5]C[6a]N[5])(Si[5]O[5]CCF)	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]O[5])	Si[5](O[5]C[5])(O[5]N[5])(CN[6]HH)(CH3)(F)	O[5](C[5]C[6a]N[5])(Si[5]O[5]CCF){2|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]O[5]){1|F<1>,2|C<3>,2|C<4>,2|H<1>}	Si[5](O[5]C[5])(O[5]N[5])(CN[6]HH)(CH3)(F){1|C<3>}	109.0430	0.000	1	109.0430	0.000	1	109.0430	0.000	1	109.0430	0.000	1	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	3:2:1:	2:2:4:4:1:	Si[5]-5:C[5]-3:	C[5]-3:O[5]-2:O-1:	O[5]-2:O[5]-2:C-4:C-4:F-1:	O[5](Si[5]O[5]CCF)(C[5]C[5]O)	C[5](C[5]O[5]O)(O[5]Si[5])(O)	Si[5](O[5]C[5])2(CHHN)(CH3)(F)	O[5](Si[5]O[5]CCF)(C[5]C[5]O){1|O<1>}	C[5](C[5]O[5]O)(O[5]Si[5])(O){1|F<1>,2|C<4>}	Si[5](O[5]C[5])2(CHHN)(CH3)(F){2|O<1>}	116.7845	3.084	2	116.7845	9.509	2	116.7890	4.615	4	116.7890	4.615	4	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	3:2:1:	2:2:4:4:1:	Si[5]-5:C[5]-3:	C[5]-3:O[5]-2:O-1:	O[5]-2:O[5]-2:C-4:C-4:F-1:	O[5](Si[5]O[5]CCF)(C[5]C[5]O)	C[5](C[5]O[5]O)(O[5]Si[5])(O)	Si[5](O[5]C[5])2(CN[6]HH)(CH3)(F)	O[5](Si[5]O[5]CCF)(C[5]C[5]O){1|O<1>}	C[5](C[5]O[5]O)(O[5]Si[5])(O){1|F<1>,2|C<4>}	Si[5](O[5]C[5])2(CN[6]HH)(CH3)(F){2|O<1>}	116.7935	2.082	2	116.7935	4.337	2	116.7890	4.615	4	116.7890	4.615	4	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	3:2:2:	3:4:2:2:1:	Si[5]-5:C[5]-3:	C[6a]-3:O[5]-2:N[5]-2:	C[6a]-3:N[5]-4:O[5]-2:O-2:H-1:	O[5](Si[5]C[6a]N[5]HO)(C[5]C[6a]N[5])	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]N[5])	Si[5](C[6a]C[6a]2)(N[5]N[5]CC)(O[5]C[5])(OC)(H)	O[5](Si[5]C[6a]N[5]HO)(C[5]C[6a]N[5]){2|C<4>,4|C<3>}	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]N[5]){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	Si[5](C[6a]C[6a]2)(N[5]N[5]CC)(O[5]C[5])(OC)(H){2|H<1>,3|C<3>}	112.5670	0.000	1	112.5670	0.000	1	112.5670	0.000	1	112.5670	0.000	1	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	3:2:2:	4:2:2:1:1:	Si[5]-5:C[5]-3:	C[6a]-3:O[5]-2:N[5]-2:	N[5]-4:O[5]-2:O-2:Br-1:Br-1:	O[5](Si[5]N[5]Br2O)(C[5]C[6a]N[5])	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]N[5])	Si[5](N[5]N[5]CC)(O[5]C[5])(OC)(Br)2	O[5](Si[5]N[5]Br2O)(C[5]C[6a]N[5]){2|C<3>,2|C<4>}	C[5](C[6a]C[6a]2)(O[5]Si[5])(N[5]N[5]){2|Br<1>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	Si[5](N[5]N[5]CC)(O[5]C[5])(OC)(Br)2{1|C<3>}	113.9300	0.000	1	113.9300	0.000	1	113.9300	0.000	1	113.9300	0.000	1	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	3:2:4:	4:2:4:4:1:	Si[5]-5:C[5]-3:	N[5]-3:O[5]-2:C-4:	C[5]-4:O[5]-2:C-4:C-4:Cl-1:	O[5](Si[5]C[5]ClCC)(C[5]N[5]C)	C[5](N[5]C[5]N)(O[5]Si[5])(CC[6a]HH)	Si[5](C[5]N[5]HH)(O[5]C[5])(CH3)2(Cl)	O[5](Si[5]C[5]ClCC)(C[5]N[5]C){1|N<2>,2|H<1>}	C[5](N[5]C[5]N)(O[5]Si[5])(CC[6a]HH){1|Cl<1>,2|C<4>,2|H<1>}	Si[5](C[5]N[5]HH)(O[5]C[5])(CH3)2(Cl){1|C<4>,1|N<2>}	112.8680	0.000	1	112.8680	0.000	1	112.8680	0.000	1	112.8680	0.000	1	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	4:2:1:	2:2:4:4:1:	Si[5]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	O[5]-2:O[5]-2:C-4:C-4:F-1:	O[5](Si[5]O[5]CCF)(C[5]C[5]O)	C[5](C[5]O[5]HH)(O[5]Si[5])(O)	Si[5](O[5]C[5])2(CHHN)(CH3)(F)	O[5](Si[5]O[5]CCF)(C[5]C[5]O){2|H<1>}	C[5](C[5]O[5]HH)(O[5]Si[5])(O){1|F<1>,2|C<4>}	Si[5](O[5]C[5])2(CHHN)(CH3)(F){1|O<1>,2|H<1>}	114.9220	0.000	1	114.9220	0.000	1	114.5580	0.265	2	114.5580	0.265	2	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	4:2:1:	2:2:4:4:1:	Si[5]-5:C[5]-3:	C[5]-4:O[5]-2:O-1:	O[5]-2:O[5]-2:C-4:C-4:F-1:	O[5](Si[5]O[5]CCF)(C[5]C[5]O)	C[5](C[5]O[5]HH)(O[5]Si[5])(O)	Si[5](O[5]C[5])2(CN[6]HH)(CH3)(F)	O[5](Si[5]O[5]CCF)(C[5]C[5]O){2|H<1>}	C[5](C[5]O[5]HH)(O[5]Si[5])(O){1|F<1>,2|C<4>}	Si[5](O[5]C[5])2(CN[6]HH)(CH3)(F){1|O<1>,2|H<1>}	114.1940	0.000	1	114.1940	0.000	1	114.5580	0.265	2	114.5580	0.265	2	114.3013	7.463	11	114.7530	5.344	71
976	818	931	5:SP2_SP2_SPD5	O[5]	C[5]	Si[5]	5:3:	4:3:2:	4:2:4:4:1:	Si[5]-5:C[5]-3:	C[5]-4:N[5]-3:O[5]-2:	C[5]-4:O[5]-2:C-4:C-4:F-1:	O[5](Si[5]C[5]CCF)(C[5]C[5]N[5])	C[5](C[5]C[5]N[5]H)(N[5]C[5]C)(O[5]Si[5])	Si[5](C[5]N[5]HH)(O[5]C[5])(CH3)2(F)	O[5](Si[5]C[5]CCF)(C[5]C[5]N[5]){1|N<3>,2|C<4>,3|H<1>}	C[5](C[5]C[5]N[5]H)(N[5]C[5]C)(O[5]Si[5]){1|F<1>,1|S<4>,4|C<4>,4|H<1>}	Si[5](C[5]N[5]HH)(O[5]C[5])(CH3)2(F){2|C<4>}	112.6340	0.000	1	112.6340	0.000	1	112.6340	0.000	1	112.6340	0.000	1	114.3013	7.463	11	114.7530	5.344	71
976	818	955	5:SP2_SP2_SP3	O[5]	C[5]	P[5,5]	4:3:	3:2:4:	3:2:2:2:	P[5,5]-4:C[5]-3:	C[5]-3:O[5]-2:C-4:	N[5,5]-3:O[5]-2:O[5]-2:N-2:	O[5](P[5,5]N[5,5]O[5]N)(C[5]C[5]C)	C[5](C[5]N[5,5]H)(O[5]P[5,5])(CC3)	P[5,5](N[5,5]C[5]2)(O[5]C[5])2(NC[6a])	O[5](P[5,5]N[5,5]O[5]N)(C[5]C[5]C){1|H<1>,2|C<3>}	C[5](C[5]N[5,5]H)(O[5]P[5,5])(CC3){1|C<3>,1|N<2>,1|O<2>}	P[5,5](N[5,5]C[5]2)(O[5]C[5])2(NC[6a]){2|C<4>,2|H<1>}	110.0025	0.579	2	110.0025	0.335	2	110.0025	0.335	2	110.0025	0.335	2	110.0025	0.335	2	110.4543	0.780	3
976	818	955	5:SP2_SP2_SP3	O[5]	C[5]	P[5,6]	4:3:	3:3:2:	4:4:2:1:	P[5,6]-4:C[5]-3:	C[5]-3:C[6a]-3:O[5]-2:	C[5,6]-4:C[6]-4:O[5]-2:S-1:	O[5](P[5,6]C[5,6]C[6]S)(C[5]C[6a]C[5])	C[5](C[5]C[5,6]H)(C[6a]C[6a]2)(O[5]P[5,6])	P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(O[5]C[5])(S)	O[5](P[5,6]C[5,6]C[6]S)(C[5]C[6a]C[5]){1|C<4>,3|H<1>,4|C<3>}	C[5](C[5]C[5,6]H)(C[6a]C[6a]2)(O[5]P[5,6]){1|S<1>,2|C<4>,2|H<1>,3|C<3>}	P[5,6](C[5,6]C[6a]C[5]C[6])(C[6]C[6]HH)(O[5]C[5])(S){1|C<4>,3|H<1>,4|C<3>}	111.3580	0.000	1	111.3580	0.000	1	111.3580	0.000	1	111.3580	0.000	1	111.3580	0.000	1	110.4543	0.780	3
976	818	959	5:SP2_SP2_SP3	O[5]	C[5]	S[5]	4:3:	3:2:1:	3:2:1:1:	S[5]-4:C[5]-3:	C[5,6a]-3:O[5]-2:N-1:	C[5,6a]-3:O[5]-2:O-1:O-1:	O[5](S[5]C[5,6a]OO)(C[5]C[5,6a]N)	C[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(N)	S[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(O)2	O[5](S[5]C[5,6a]OO)(C[5]C[5,6a]N){2|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(N){1|H<1>,2|C<3>,2|O<1>}	S[5](C[5,6a]C[5,6a]C[6a])(O[5]C[5])(O)2{1|H<1>,1|N<1>,2|C<3>}	115.1040	0.000	2	115.1040	0.000	2	115.1040	0.000	2	115.1040	0.000	2	113.1923	10.963	3	113.1923	10.963	3
976	818	959	5:SP2_SP2_SP3	O[5]	C[5]	S[5]	4:3:	3:2:3:	2:2:1:1:	S[5]-4:C[5]-3:	C[5]-3:O[5]-2:C-3:	N[5]-2:O[5]-2:O-1:O-1:	O[5](S[5]N[5]OO)(C[5]C[5]C)	C[5](C[5]C[6a]N[5])(O[5]S[5])(CC[6a]H)	S[5](N[5]C[5])(O[5]C[5])(O)2	O[5](S[5]N[5]OO)(C[5]C[5]C){1|C<3>}	C[5](C[5]C[6a]N[5])(O[5]S[5])(CC[6a]H){2|C<3>,2|O<1>}	S[5](N[5]C[5])(O[5]C[5])(O)2{2|C<3>}	109.3690	0.000	1	109.3690	0.000	1	109.3690	0.000	1	109.3690	0.000	1	113.1923	10.963	3	113.1923	10.963	3
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	2:2:1:	3:2:	C[5]-3:N[5]-2:	N[5]-2:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]N[5]O)(N[5]C[5])	C[5](N[5]C[5])(O[5]N[5])(O)	N[5](C[5]C[5a]N[5])(O[5]C[5])	O[5](C[5]N[5]O)(N[5]C[5]){1|C<3>}	C[5](N[5]C[5])(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[5a]N[5])(O[5]C[5]){1|C<3>,1|N<2>,1|O<1>}	107.2970	0.257	3	107.2970	0.066	3	107.1110	0.192	6	107.1110	0.192	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	2:2:1:	3:2:	C[5]-3:N[5]-2:	N[5]-2:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]N[5]O)(N[5]C[5])	C[5](N[5]C[5])(O[5]N[5])(O)	N[5](C[5]C[6a]N[5])(O[5]C[5])	O[5](C[5]N[5]O)(N[5]C[5]){1|C<3>}	C[5](N[5]C[5])(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]N[5])(O[5]C[5]){1|O<1>,2|C<3>}	107.4830	0.000	1	107.4830	0.000	1	107.1110	0.192	6	107.1110	0.192	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	2:2:1:	3:2:	C[5]-3:N[5]-2:	N[5]-2:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]N[5]O)(N[5]C[5])	C[5](N[5]C[5])(O[5]N[5])(O)	N[5](C[5]N[5]N)(O[5]C[5])	O[5](C[5]N[5]O)(N[5]C[5]){1|N<3>}	C[5](N[5]C[5])(O[5]N[5])(O){1|N<3>}	N[5](C[5]N[5]N)(O[5]C[5]){1|O<1>}	106.6460	0.389	2	106.6460	0.151	2	107.1110	0.192	6	107.1110	0.192	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]C)(O[5]N[5])(O)	N[5](C[5]C[5]C)(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,1|C<4>}	C[5](C[5]C[5]C)(O[5]N[5])(O){1|C<4>}	N[5](C[5]C[5]C)(O[5]C[5]){1|C<3>,1|O<1>}	109.7557	0.372	6	109.7557	0.138	6	109.6005	0.587	22	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]C)(O[5]N[5])(O)	N[5](C[5]C[5]H)(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,1|H<1>}	C[5](C[5]C[5]C)(O[5]N[5])(O){1|H<1>}	N[5](C[5]C[5]H)(O[5]C[5]){1|C<3>,1|O<1>}	109.1180	0.000	1	109.1180	0.000	1	109.6005	0.587	22	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]C)(O[5]N[5])(O)	N[5](C[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){2|C<3>}	C[5](C[5]C[5]C)(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]C[5])(O[5]C[5]){1|O<1>,3|C<3>}	109.8743	0.539	12	109.8743	0.290	12	109.6005	0.587	22	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]N)(O[5]N[5])(O)	N[5](C[5]C[5]C)(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<4>,1|N<2>}	C[5](C[5]C[5]N)(O[5]N[5])(O){1|C<4>}	N[5](C[5]C[5]C)(O[5]C[5]){1|N<2>,1|O<1>}	108.3563	1.124	3	108.3563	1.264	3	109.6005	0.587	22	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	N[5]-3:O[5]-2:S-1:	C[5]-3:O[5]-2:	O[5](C[5]N[5]S)(N[5]C[5])	C[5](N[5]C[5]C)(O[5]N[5])(S)	N[5](C[5]C[6a]N[5])(O[5]C[5])	O[5](C[5]N[5]S)(N[5]C[5]){1|C<3>,1|C<4>}	C[5](N[5]C[5]C)(O[5]N[5])(S){1|C<3>}	N[5](C[5]C[6a]N[5])(O[5]C[5]){1|C<3>,1|C<4>,1|N<2>,1|S<1>}	109.7130	0.000	1	109.7130	0.000	1	109.1660	0.598	2	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:1:	3:2:	C[5]-3:N[5]-2:	N[5]-3:O[5]-2:S-1:	C[5]-3:O[5]-2:	O[5](C[5]N[5]S)(N[5]C[5])	C[5](N[5]C[6a]C[5])(O[5]N[5])(S)	N[5](C[5]C[6a]N[5])(O[5]C[5])	O[5](C[5]N[5]S)(N[5]C[5]){2|C<3>}	C[5](N[5]C[6a]C[5])(O[5]N[5])(S){3|C<3>}	N[5](C[5]C[6a]N[5])(O[5]C[5]){1|S<1>,3|C<3>}	108.6190	0.000	1	108.6190	0.000	1	109.1660	0.598	2	109.5643	0.577	24	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:2:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:N-2:	N[5]-3:O[5]-2:	O[5](C[5]C[5]N)(N[5]N[5])	C[5](C[5]N[5]S)(O[5]N[5])(NC)	N[5](N[5]C[5]C)(O[5]C[5])	O[5](C[5]C[5]N)(N[5]N[5]){1|C<4>,1|S<2>}	C[5](C[5]N[5]S)(O[5]N[5])(NC){1|C<4>}	N[5](N[5]C[5]C)(O[5]C[5]){1|N<2>,1|S<2>}	110.1253	0.051	3	110.1253	0.003	3	110.1253	0.003	3	110.2330	0.060	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:2:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-2:	N[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]N[5])	C[5](C[5]C[6]N[5])(O[5]N[5])(OCo)	N[5](N[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]N[5]){2|C<3>}	C[5](C[5]C[6]N[5])(O[5]N[5])(OCo){1|N<3>,2|C<3>}	N[5](N[5]C[6a]C[5])(O[5]C[5]){1|O<2>,3|C<3>}	110.2385	0.404	2	110.2385	0.163	2	110.3407	0.113	3	110.2330	0.060	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:2:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:O-2:	N[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]N[5])	C[5](C[5]C[6]N[5])(O[5]N[5])(OZn)	N[5](N[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]N[5]){2|C<3>}	C[5](C[5]C[6]N[5])(O[5]N[5])(OZn){1|N<3>,2|C<3>}	N[5](N[5]C[6a]C[5])(O[5]C[5]){1|O<2>,3|C<3>}	110.5450	0.000	1	110.5450	0.000	1	110.3407	0.113	3	110.2330	0.060	6	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:3:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:N-3:	N[5]-3:O[5]-2:	O[5](C[5]C[5]N)(N[5]N[5])	C[5](C[5]C[6a]N[5])(O[5]N[5])(NHH)	N[5](N[5]C[5]O)(O[5]C[5])	O[5](C[5]C[5]N)(N[5]N[5]){1|C<3>,1|O<1>}	C[5](C[5]C[6a]N[5])(O[5]N[5])(NHH){1|O<1>,2|C<3>}	N[5](N[5]C[5]O)(O[5]C[5]){1|C<3>,1|N<3>}	109.2710	0.000	1	109.2710	0.000	1	109.5656	0.710	9	109.5656	0.710	9	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:3:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:N-3:	N[5]-3:O[5]-2:	O[5](C[5]C[5]N)(N[5]N[5])	C[5](C[5]N[5]B)(O[5]N[5])(NCH)	N[5](N[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]N)(N[5]N[5]){1|B<4>,1|C<3>}	C[5](C[5]N[5]B)(O[5]N[5])(NCH){1|C<3>}	N[5](N[5]C[6a]C[5])(O[5]C[5]){1|B<4>,1|N<3>,2|C<3>}	108.5875	0.237	2	108.5875	0.056	2	109.5656	0.710	9	109.5656	0.710	9	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:3:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:N-3:	N[5]-3:O[5]-2:	O[5](C[5]C[5]N)(N[5]N[5])	C[5](C[5]N[5]H)(O[5]N[5])(NHH)	N[5](N[5]C[5]C)(O[5]C[5])	O[5](C[5]C[5]N)(N[5]N[5]){1|C<4>,1|H<1>}	C[5](C[5]N[5]H)(O[5]N[5])(NHH){1|C<4>}	N[5](N[5]C[5]C)(O[5]C[5]){1|H<1>,1|N<3>}	109.4728	0.226	4	109.4728	0.051	4	109.5656	0.710	9	109.5656	0.710	9	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:3:	3:2:	C[5]-3:N[5]-2:	C[5]-3:O[5]-2:N-3:	N[5]-3:O[5]-2:	O[5](C[5]C[5]N)(N[5]N[5])	C[5](C[5]N[5]S)(O[5]N[5])(NHgC)	N[5](N[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]N)(N[5]N[5]){1|C<3>,1|S<2>}	C[5](C[5]N[5]S)(O[5]N[5])(NHgC){1|C<3>}	N[5](N[5]C[6a]C[5])(O[5]C[5]){1|N<3>,1|S<2>,2|C<3>}	110.8765	0.013	2	110.8765	0.000	2	109.5656	0.710	9	109.5656	0.710	9	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:4:	3:2:	C[5]-3:N[5]-2:	N[5]-3:O[5]-2:C-4:	C[5]-3:O[5]-2:	O[5](C[5]N[5]C)(N[5]C[5])	C[5](N[5]C[5]Pt)(O[5]N[5])(CCHH)	N[5](C[5]C[6a]N[5])(O[5]C[5])	O[5](C[5]N[5]C)(N[5]C[5]){1|Pt<4>,1|C<3>}	C[5](N[5]C[5]Pt)(O[5]N[5])(CCHH){1|C<3>}	N[5](C[5]C[6a]N[5])(O[5]C[5]){1|Pt<4>,1|C<4>,2|C<3>}	107.5425	0.114	2	107.8497	0.290	3	107.8497	0.290	3	107.8497	0.290	3	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	3:2:4:	3:2:	C[5]-3:N[5]-2:	N[5]-3:O[5]-2:C-4:	C[5]-3:O[5]-2:	O[5](C[5]N[5]C)(N[5]C[5])	C[5](N[5]C[5]Pt)(O[5]N[5])(CCHH)	N[5](C[5]C[6a]N[5])(O[5]C[5])	O[5](C[5]N[5]C)(N[5]C[5]){1|Pt<6>,1|C<3>}	C[5](N[5]C[5]Pt)(O[5]N[5])(CCHH){1|C<3>}	N[5](C[5]C[6a]N[5])(O[5]C[5]){1|Pt<6>,1|C<4>,2|C<3>}	108.4640	0.000	1	107.8497	0.290	3	107.8497	0.290	3	107.8497	0.290	3	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,5]O)(N[5]C[5])	C[5](C[5,5]C[5]2N[5])(O[5]N[5])(O)	N[5](C[5]C[5,5]C[6a])(O[5]C[5])	O[5](C[5]C[5,5]O)(N[5]C[5]){1|C<3>,1|C<4>,1|N<3>}	C[5](C[5,5]C[5]2N[5])(O[5]N[5])(O){1|H<1>,1|N<2>,4|C<3>}	N[5](C[5]C[5,5]C[6a])(O[5]C[5]){1|C<4>,1|N<3>,1|O<1>,2|C<3>}	109.4825	0.507	2	109.4825	0.257	2	109.4723	0.129	3	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,5]O)(N[5]C[5])	C[5](C[5,5]C[5]3)(O[5]N[5])(O)	N[5](C[5]C[5,5]C[6a])(O[5]C[5])	O[5](C[5]C[5,5]O)(N[5]C[5]){1|C<4>,2|C<3>}	C[5](C[5,5]C[5]3)(O[5]N[5])(O){1|H<1>,1|N<2>,4|C<3>}	N[5](C[5]C[5,5]C[6a])(O[5]C[5]){1|C<4>,1|O<1>,3|C<3>}	109.4520	0.000	1	109.4520	0.000	1	109.4723	0.129	3	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5,6]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,6]O)(N[5]C[5])	C[5](C[5,6]C[5]C[6]2)(O[5]N[5])(O)	N[5](C[5]C[5,6]C)(O[5]C[5])	O[5](C[5]C[5,6]O)(N[5]C[5]){3|C<4>}	C[5](C[5,6]C[5]C[6]2)(O[5]N[5])(O){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N[5](C[5]C[5,6]C)(O[5]C[5]){1|O<1>,2|C<4>}	110.0050	0.000	1	110.0050	0.000	1	110.0050	0.000	1	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]CC)(O[5]N[5])(O)	N[5](C[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,2|C<4>}	C[5](C[5]C[5]CC)(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]C[5])(O[5]C[5]){1|O<1>,2|C<3>,2|C<4>}	108.9980	0.000	1	108.9980	0.000	1	109.5015	0.134	4	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]CF)(O[5]N[5])(O)	N[5](C[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,1|C<4>,1|F<1>}	C[5](C[5]C[5]CF)(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]C[5])(O[5]C[5]){1|C<4>,1|F<1>,1|O<1>,2|C<3>}	109.5080	0.000	1	109.5080	0.000	1	109.5015	0.134	4	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]CH)(O[5]N[5])(O)	N[5](C[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,1|C<4>,1|H<1>}	C[5](C[5]C[5]CH)(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]C[5])(O[5]C[5]){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	109.8610	0.000	1	109.8610	0.000	1	109.5015	0.134	4	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:2:1:	3:2:	C[5]-3:N[5]-2:	C[5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5]O)(N[5]C[5])	C[5](C[5]C[5]HH)(O[5]N[5])(O)	N[5](C[5]C[6a]C[5])(O[5]C[5])	O[5](C[5]C[5]O)(N[5]C[5]){1|C<3>,2|H<1>}	C[5](C[5]C[5]HH)(O[5]N[5])(O){1|C<3>}	N[5](C[5]C[6a]C[5])(O[5]C[5]){1|O<1>,2|C<3>,2|H<1>}	109.6390	0.000	1	109.6390	0.000	1	109.5015	0.134	4	109.5535	0.128	8	109.2853	1.158	57	109.2853	1.158	57
976	818	960	5:SP2_SP2_SP2	O[5]	C[5]	N[5]	3:2:	4:3:2:	3:2:	C[5]-3:N[5]-2:	C[5]-4:C[5]-3:O[5]-2:	C[5]-3:O[5]-2:	O[5](C[5]C[5]2)(N[5]C[5])	C[5](C[5]C[5,5]C[5]H)(C[5]C[5]N)(O[5]N[5])	N[5](C[5]C[5]C)(O[5]C[5])	O[5](C[5]C[5]2)(N[5]C[5]){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[5](C[5]C[5,5]C[5]H)(C[5]C[5]N)(O[5]N[5]){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	N[5](C[5]C[5]C)(O[5]C[5]){1|C<4>,1|N<3>}	109.5870	0.000	1	109.5870	0.000	1	109.5870	0.000	1	109.5870	0.000	1	109.2853	1.158	57	109.2853	1.158	57
976	818	964	5:SP2_SP2_SPD6	O[5]	C[5]	Si[4,4,5]	6:3:	3:2:3:	3:3:3:3:2:2:	Si[4,4,5]-6:C[5]-3:	C[5]-3:O[5]-2:C[6a]-3:	N[4]-3:N[4]-3:N[4]-3:N[4]-3:O[5]-2:O[5]-2:	O[5](Si[4,4,5]N[4]4O[5])(C[5]C[6a]C[5])	C[5](C[5]C[6a]O[5])(O[5]Si[4,4,5])(C[6a]C[6a]2)	Si[4,4,5](N[4]C[4]C)4(O[5]C[5])2	O[5](Si[4,4,5]N[4]4O[5])(C[5]C[6a]C[5]){4|C<4>,5|C<3>}	C[5](C[5]C[6a]O[5])(O[5]Si[4,4,5])(C[6a]C[6a]2){2|H<1>,4|C<3>,4|N<3>}	Si[4,4,5](N[4]C[4]C)4(O[5]C[5])2{4|C<3>}	110.7550	0.214	2	110.7550	0.046	2	110.7550	0.046	2	110.7550	0.046	2	110.7550	0.046	2	110.7550	0.046	2
976	818	976	5:SP2_SP2_SP2	O[5]	C[5]	O[5]	3:2:	4:2:1:	3:2:	C[5]-3:O[5]-2:	C[3,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[3,5]O)(O[5]C[5])	C[5](C[3,5]C[3]2C[5])(O[5]O[5])(O)	O[5](C[5]C[3,5]O)(O[5]C[5])	O[5](C[5]C[3,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	C[5](C[3,5]C[3]2C[5])(O[5]O[5])(O){1|O<1>,4|H<1>}	O[5](C[5]C[3,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	108.1930	0.000	1	108.1930	0.000	1	108.1930	0.000	1	108.1458	0.037	9	108.1458	0.037	9	108.1458	0.037	9
976	818	976	5:SP2_SP2_SP2	O[5]	C[5]	O[5]	3:2:	4:2:1:	3:2:	C[5]-3:O[5]-2:	C[4,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[4,5]O)(O[5]C[5])	C[5](C[4,5]C[4]2C[5])(O[5]O[5])(O)	O[5](C[5]C[4,5]O)(O[5]C[5])	O[5](C[5]C[4,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	C[5](C[4,5]C[4]2C[5])(O[5]O[5])(O){1|C<4>,1|O<1>,4|H<1>}	O[5](C[5]C[4,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	108.1200	0.264	2	108.1200	0.070	2	108.1200	0.070	2	108.1458	0.037	9	108.1458	0.037	9	108.1458	0.037	9
976	818	976	5:SP2_SP2_SP2	O[5]	C[5]	O[5]	3:2:	4:2:1:	3:2:	C[5]-3:O[5]-2:	C[5,5,6]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,5,6]O)(O[5]C[5])	C[5](C[5,5,6]C[5,5,6]C[5,6]C[5])(O[5]O[5])(O)	O[5](C[5]C[5,5,6]O)(O[5]C[5])	O[5](C[5]C[5,5,6]O)(O[5]C[5]){1|O<1>,2|C<4>}	C[5](C[5,5,6]C[5,5,6]C[5,6]C[5])(O[5]O[5])(O){1|O<1>,3|C<4>,3|H<1>}	O[5](C[5]C[5,5,6]O)(O[5]C[5]){1|O<1>,2|C<4>}	108.2985	0.339	2	108.2985	0.115	2	108.2985	0.115	2	108.1458	0.037	9	108.1458	0.037	9	108.1458	0.037	9
976	818	976	5:SP2_SP2_SP2	O[5]	C[5]	O[5]	3:2:	4:2:1:	3:2:	C[5]-3:O[5]-2:	C[5,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,5]O)(O[5]C[5])	C[5](C[5,5]C[5]3)(O[5]O[5])(O)	O[5](C[5]C[5,5]O)(O[5]C[5])	O[5](C[5]C[5,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	C[5](C[5,5]C[5]3)(O[5]O[5])(O){1|O<1>,2|C<3>,4|H<1>}	O[5](C[5]C[5,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	108.1140	0.177	2	108.0705	0.013	4	108.0705	0.013	4	108.1458	0.037	9	108.1458	0.037	9	108.1458	0.037	9
976	818	976	5:SP2_SP2_SP2	O[5]	C[5]	O[5]	3:2:	4:2:1:	3:2:	C[5]-3:O[5]-2:	C[5,5]-4:O[5]-2:O-1:	C[5]-3:O[5]-2:	O[5](C[5]C[5,5]O)(O[5]C[5])	C[5](C[5,5]C[5]3)(O[5]O[5])(O)	O[5](C[5]C[5,5]O)(O[5]C[5])	O[5](C[5]C[5,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	C[5](C[5,5]C[5]3)(O[5]O[5])(O){1|O<1>,2|C<4>,4|H<1>}	O[5](C[5]C[5,5]O)(O[5]C[5]){1|O<1>,2|C<4>}	108.0270	0.020	2	108.0705	0.013	4	108.0705	0.013	4	108.1458	0.037	9	108.1458	0.037	9	108.1458	0.037	9
976	818	976	5:SP2_SP2_SP3	O[5]	C[5]	O[5]	3:2:	4:2:1:	4:2:	C[5]-3:O[5]-2:	C[5]-4:O[5]-2:O-1:	C[5]-4:O[5]-2:	O[5](C[5]C[5]O)(O[5]C[5])	C[5](C[5]C[5]CH)(O[5]O[5])(O)	O[5](C[5]C[5]CO)(O[5]C[5])	O[5](C[5]C[5]O)(O[5]C[5]){1|H<1>,1|O<2>,2|C<4>}	C[5](C[5]C[5]CH)(O[5]O[5])(O){1|C<4>,1|O<2>}	O[5](C[5]C[5]CO)(O[5]C[5]){1|C<4>,1|H<1>,1|O<1>}	107.6290	0.105	2	107.6290	0.011	2	107.6290	0.011	2	107.6290	0.011	2	107.6290	0.011	2	107.6290	0.011	2
976	818	987	5:SP2_SP-NON_SP2	O[5]	C[5]	P[5]	3:2:	3:2:2:	3:2:	C[5]-3:P[5]-2:	C[6a]-3:O[5]-2:P[5]-2:	C[5]-3:O[5]-2:	O[5](C[5]C[6a]P[5])(P[5]C[5])	C[5](C[6a]C[6a]2)(O[5]P[5])(P[5]C[5])	P[5](C[5]P[5]O)(O[5]C[5])	O[5](C[5]C[6a]P[5])(P[5]C[5]){1|O<2>,2|C<3>}	C[5](C[6a]C[6a]2)(O[5]P[5])(P[5]C[5]){1|O<2>,2|C<3>,2|C<4>}	P[5](C[5]P[5]O)(O[5]C[5]){1|C<3>}	118.6850	0.000	1	118.6850	0.000	1	118.6850	0.000	1	118.6850	0.000	1	118.6850	0.000	1	118.6850	0.000	1
976	818	999	5:SP2_SP2_SP3	O[5]	C[5]	N[5]	4:3:	2:2:3:	4:4:2:1:	N[5]-4:C[5]-3:	N[5]-2:O[5]-2:N-3:	C[5]-4:C-4:O[5]-2:H-1:	O[5](N[5]C[5]CH)(C[5]N[5]N)	C[5](N[5]C[5])(O[5]N[5])(NC[6a]C)	N[5](C[5]C[6a]2N[5])(CC[6a]HH)(O[5]C[5])(H)	O[5](N[5]C[5]CH)(C[5]N[5]N){2|C<3>}	C[5](N[5]C[5])(O[5]N[5])(NC[6a]C){1|C<4>,1|H<1>,2|C<3>}	N[5](C[5]C[6a]2N[5])(CC[6a]HH)(O[5]C[5])(H){1|N<3>,4|C<3>}	103.8350	0.000	1	103.8350	0.000	1	103.8350	0.000	1	103.8350	0.000	1	107.0055	20.104	2	107.0055	20.104	2
976	818	999	5:SP2_SP2_SP3	O[5]	C[5]	N[5]	4:3:	3:3:2:	3:2:1:1:	N[5]-4:C[5]-3:	C[5]-3:C[5]-3:O[5]-2:	C[5]-3:O[5]-2:H-1:H-1:	O[5](N[5]C[5]HH)(C[5]C[5]2)	C[5](C[5]C[5]2)(C[5]C[5]N)(O[5]N[5])	N[5](C[5]C[5]C)(O[5]C[5])(H)2	O[5](N[5]C[5]HH)(C[5]C[5]2){1|C<3>,1|N<3>,2|C<4>}	C[5](C[5]C[5]2)(C[5]C[5]N)(O[5]N[5]){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	N[5](C[5]C[5]C)(O[5]C[5])(H)2{1|C<3>,1|N<3>}	110.1760	0.000	1	110.1760	0.000	1	110.1760	0.000	1	110.1760	0.000	1	107.0055	20.104	2	107.0055	20.104	2
976	885	999	5:SP3_SP-NON_SP3	O[5]	Ga[5]	N[5,6]	4:4:	3:2:4:4:	5:4:2:4:	N[5,6]-4:Ga[5]-4:	O[5,6]-3:O[5]-2:C-4:C-4:	In[5,5,6,6]-5:C[6]-4:O[5]-2:C-4:	O[5](N[5,6]In[5,5,6,6]C[6]C)(Ga[5]O[5,6]CC)	Ga[5](O[5,6]In[5,5,6,6]N[6])(O[5]N[5,6])(CC3)2	N[5,6](In[5,5,6,6]N[5,6]O[5,6]2C)(C[6]C[6]HH)(O[5]Ga[5])(CH3)	O[5](N[5,6]In[5,5,6,6]C[6]C)(Ga[5]O[5,6]CC){1|N<3>,1|N<4>,1|O<3>,2|C<4>,2|H<1>}	Ga[5](O[5,6]In[5,5,6,6]N[6])(O[5]N[5,6])(CC3)2{1|N<4>,1|O<3>,5|C<4>}	N[5,6](In[5,5,6,6]N[5,6]O[5,6]2C)(C[6]C[6]HH)(O[5]Ga[5])(CH3){1|Ga<4>,1|O<2>,2|H<1>,2|N<3>,4|C<4>}	122.8385	2.068	2	122.8385	4.278	2	122.8385	4.278	2	122.8385	4.278	2	122.8385	4.278	2	122.6077	2.299	3
976	885	999	5:SP3_SP-NON_SP3	O[5]	Ga[5]	N[5]	4:4:	3:2:4:4:	4:2:4:4:	Ga[5]-4:N[5]-4:	O[5]-3:O[5]-2:C-4:C-4:	Ga[5]-4:O[5]-2:C-4:C-4:	O[5](Ga[5]O[5]CC)(N[5]Ga[5]CC)	Ga[5](O[5]Ga[5]N)(O[5]N[5])(CC3)2	N[5](Ga[5]O[5]CC)(O[5]Ga[5])(CH3)2	O[5](Ga[5]O[5]CC)(N[5]Ga[5]CC){1|N<3>,2|C<4>}	Ga[5](O[5]Ga[5]N)(O[5]N[5])(CC3)2{4|C<4>}	N[5](Ga[5]O[5]CC)(O[5]Ga[5])(CH3)2{1|N<3>,2|C<4>}	122.1460	0.000	1	122.1460	0.000	1	122.1460	0.000	1	122.1460	0.000	1	122.1460	0.000	1	122.6077	2.299	3
976	928	960	5:SP2_SP2_SPD6	O[5]	Si[3x5]	N[5]	6:2:	2:2:2:2:2:2:	2:3:	Si[3x5]-6:N[5]-2:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	O[5]-2:C[5]-3:	O[5](Si[3x5]O[5]5)(N[5]C[5])	Si[3x5](O[5]C[5])3(O[5]N[5])3	N[5](O[5]Si[3x5])(C[5]O[5]C)	O[5](Si[3x5]O[5]5)(N[5]C[5]){1|C<4>,2|C<3>,2|N<2>}	Si[3x5](O[5]C[5])3(O[5]N[5])3{3|C<4>}	N[5](O[5]Si[3x5])(C[5]O[5]C){4|O<2>}	114.3120	0.743	3	114.3120	0.552	3	114.3120	0.552	3	114.3120	0.552	3	113.8730	0.394	12	113.8730	0.394	12
976	928	960	5:SP2_SP2_SPD6	O[5]	Si[3x5]	N[5]	6:2:	2:2:2:2:2:2:	3:2:	Si[3x5]-6:N[5]-2:	O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:O[5]-2:	C[5]-3:O[5]-2:	O[5](Si[3x5]O[5]5)(N[5]C[5])	Si[3x5](O[5]C[5])3(O[5]N[5])3	N[5](C[5]C[6a]O[5])(O[5]Si[3x5])	O[5](Si[3x5]O[5]5)(N[5]C[5]){2|N<2>,3|C<3>}	Si[3x5](O[5]C[5])3(O[5]N[5])3{3|C<3>}	N[5](C[5]C[6a]O[5])(O[5]Si[3x5]){2|C<3>,4|O<2>}	113.7267	0.554	9	113.7267	0.307	9	113.7267	0.307	9	113.7267	0.307	9	113.8730	0.394	12	113.8730	0.394	12
976	931	960	5:SP2_SP2_SPD5	O[5]	Si[5]	N[5]	5:2:	2:2:4:4:1:	3:2:	Si[5]-5:N[5]-2:	O[5]-2:O[5]-2:C-4:C-4:F-1:	C[5]-3:O[5]-2:	O[5](Si[5]O[5]CCF)(N[5]C[5])	Si[5](O[5]C[5])(O[5]N[5])(CN[6]HH)(CH3)(F)	N[5](C[5]C[6a]O[5])(O[5]Si[5])	O[5](Si[5]O[5]CCF)(N[5]C[5]){1|C<3>}	Si[5](O[5]C[5])(O[5]N[5])(CN[6]HH)(CH3)(F){1|C<3>}	N[5](C[5]C[6a]O[5])(O[5]Si[5]){1|F<1>,2|C<3>,2|C<4>}	117.2870	0.000	1	117.2870	0.000	1	117.2870	0.000	1	117.2870	0.000	1	117.2870	0.000	1	117.2870	0.000	1
976	955	955	5:SP3_SP3_SP3	O[5,5]	P[5,5,3x6]	P[5,5,3x6]	4:4:	4:4:2:1:	4:4:2:1:	P[5,5,3x6]-4:P[5,5,3x6]-4:	C[5,4x6]-4:C[5,5x6]-4:O[5,5]-2:O-1:	C[5,4x6]-4:C[5,5x6]-4:O[5,5]-2:O-1:	O[5,5](P[5,5,3x6]C[5,4x6]C[5,5x6]O)2	P[5,5,3x6](C[5,4x6]C[5,5x6]C[6,6]C[6a])(C[5,5x6]C[5,4x6]C[5x6]C[6a])(O[5,5]P[5,5,3x6])(O)	P[5,5,3x6](C[5,4x6]C[5,5x6]C[6,6]C[6a])(C[5,5x6]C[5,4x6]C[5x6]C[6a])(O[5,5]P[5,5,3x6])(O)	O[5,5](P[5,5,3x6]C[5,4x6]C[5,5x6]O)2{2|C<4>,6|C<3>}	P[5,5,3x6](C[5,4x6]C[5,5x6]C[6,6]C[6a])(C[5,5x6]C[5,4x6]C[5x6]C[6a])(O[5,5]P[5,5,3x6])(O){1|C<4>,1|O<1>,2|H<1>,8|C<3>}	P[5,5,3x6](C[5,4x6]C[5,5x6]C[6,6]C[6a])(C[5,5x6]C[5,4x6]C[5x6]C[6a])(O[5,5]P[5,5,3x6])(O){1|C<4>,1|O<1>,2|H<1>,8|C<3>}	103.7165	0.043	2	103.7165	0.002	2	103.7165	0.002	2	103.7165	0.002	2	103.7165	0.002	2	109.4130	97.351	3
976	955	955	5:SP3_SP3_SP3	O[5]	P[5,5]	P[5,5]	4:4:	4:3:2:1:	4:3:2:1:	P[5,5]-4:P[5,5]-4:	C[5,5]-4:C[5,6a]-3:O[5]-2:O-1:	C[5,5]-4:C[5,6a]-3:O[5]-2:O-1:	O[5](P[5,5]C[5,6a]C[5,5]O)2	P[5,5](C[5,5]C[5,5]C[6a]N[5])(C[5,6a]C[5,6a]C[6a])(O[5]P[5,5])(O)	P[5,5](C[5,5]C[5,5]C[6a]N[5])(C[5,6a]C[5,6a]C[6a])(O[5]P[5,5])(O)	O[5](P[5,5]C[5,6a]C[5,5]O)2{2|N<3>,6|C<3>}	P[5,5](C[5,5]C[5,5]C[6a]N[5])(C[5,6a]C[5,6a]C[6a])(O[5]P[5,5])(O){1|N<3>,1|O<1>,2|H<1>,6|C<3>}	P[5,5](C[5,5]C[5,5]C[6a]N[5])(C[5,6a]C[5,6a]C[6a])(O[5]P[5,5])(O){1|N<3>,1|O<1>,2|H<1>,6|C<3>}	120.8060	0.000	1	120.8060	0.000	1	120.8060	0.000	1	120.8060	0.000	1	120.8060	0.000	1	109.4130	97.351	3
976	959	959	5:SP3_SP3_SP3	O[5]	S[5]	S[5]	4:4:	3:2:1:1:	3:2:1:1:	S[5]-4:S[5]-4:	C[5,6a]-3:O[5]-2:O-1:O-1:	C[5,6a]-3:O[5]-2:O-1:O-1:	O[5](S[5]C[5,6a]OO)2	S[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(O)2	S[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(O)2	O[5](S[5]C[5,6a]OO)2{2|C<3>}	S[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(O)2{1|S<4>,2|C<3>,2|O<1>}	S[5](C[5,6a]C[5,6a]C[6a])(O[5]S[5])(O)2{1|S<4>,2|C<3>,2|O<1>}	116.0635	0.841	2	116.0635	0.707	2	116.0635	0.707	2	116.0635	0.707	2	116.0635	0.707	2	116.0635	0.707	2
978	6	878	4:SP2_SP-NON_SP2	As[4]	As[4]	Ga[4,6]	4:3:	4:2:2:	3:3:2:2:	Ga[4,6]-4:As[4]-3:	Ga[6]-4:As[4]-2:As[4]-2:	N[6]-3:N[6]-3:As[4]-2:As[4]-2:	As[4](Ga[4,6]As[4]N[6]2)(As[4]As[4]Ga[6])	As[4](Ga[6]C[5]N[6]2)(As[4]Ga[4,6])2	Ga[4,6](N[6]C[6a]C[6])2(As[4]As[4])2	As[4](Ga[4,6]As[4]N[6]2)(As[4]As[4]Ga[6]){1|C<4>,2|N<3>,4|C<3>}	As[4](Ga[6]C[5]N[6]2)(As[4]Ga[4,6])2{1|C<4>,2|N<3>,6|C<3>}	Ga[4,6](N[6]C[6a]C[6])2(As[4]As[4])2{1|Ga<4>,2|C<4>,5|C<3>}	82.6294	0.364	2	82.6294	0.132	2	82.6294	0.132	2	82.6294	0.132	2	82.6294	0.132	2	82.6294	0.132	2
978	74	74	4:SP2_SP2_SP2	As[4]	N[4]	N[4]	3:3:	3:3:2:	3:3:2:	N[4]-3:N[4]-3:	As[4]-3:C[6a]-3:As[4]-2:	As[4]-3:C[6a]-3:As[4]-2:	As[4](N[4]As[4]C[6a])2	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4])	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4])	As[4](N[4]As[4]C[6a])2{1|Cl<1>,4|C<3>}	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4]){5|C<3>}	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4]){5|C<3>}	80.9872	0.000	1	80.9872	0.000	1	80.9872	0.000	1	80.9872	0.000	1	80.9872	0.000	1	80.9872	0.000	1
978	74	74	4:SP2_SP2_SP3	As[4]	N[4]	N[4]	3:3:	3:3:2:	3:3:2:	N[4]-3:N[4]-3:	As[4]-3:C[6a]-3:As[4]-2:	As[4]-3:C[6a]-3:As[4]-2:	As[4](N[4]As[4]C[6a])2	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4])	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4])	As[4](N[4]As[4]C[6a])2{1|Cl<1>,4|C<3>}	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4]){5|C<3>}	N[4](As[4]N[4]Cl)(C[6a]C[6a]2)(As[4]N[4]){5|C<3>}	81.8486	0.115	2	81.8486	0.013	2	81.8486	0.013	2	81.9250	0.024	3	81.9250	0.024	3	81.9250	0.024	3
978	74	74	4:SP2_SP2_SP3	As[4]	N[4]	N[4]	3:3:	3:3:2:	3:3:2:	N[4]-3:N[4]-3:	C[6a]-3:As[4]-3:As[4]-2:	C[6a]-3:As[4]-3:As[4]-2:	As[4](N[4]As[4]C[6a])2	N[4](C[6a]C[6a]2)(As[4]N[4]N)(As[4]N[4])	N[4](C[6a]C[6a]2)(As[4]N[4]N)(As[4]N[4])	As[4](N[4]As[4]C[6a])2{1|N<2>,4|C<3>}	N[4](C[6a]C[6a]2)(As[4]N[4]N)(As[4]N[4]){5|C<3>}	N[4](C[6a]C[6a]2)(As[4]N[4]N)(As[4]N[4]){5|C<3>}	82.0778	0.000	1	82.0778	0.000	1	82.0778	0.000	1	81.9250	0.024	3	81.9250	0.024	3	81.9250	0.024	3
978	74	846	4:SP2_SP2_SP2	As[4]	N[4]	C[4]	3:3:	4:2:4:	4:2:4:	N[4]-3:C[4]-3:	P[4]-4:As[4]-2:Si-4:	P[4]-4:As[4]-2:P-4:	As[4](N[4]P[4]Si)(C[4]P[4]P)	N[4](P[4]C[6a]2C[4])(As[4]C[4])(SiC3)	C[4](P[4]C[6a]2N[4])(As[4]N[4])(PC[6a]2N)	As[4](N[4]P[4]Si)(C[4]P[4]P){2|C<3>}	N[4](P[4]C[6a]2C[4])(As[4]C[4])(SiC3){1|P<4>,4|C<3>}	C[4](P[4]C[6a]2N[4])(As[4]N[4])(PC[6a]2N){1|Si<4>,4|C<3>}	79.4258	0.000	1	79.4258	0.000	1	79.4258	0.000	1	79.4258	0.000	1	79.4258	0.000	1	79.4258	0.000	1
978	907	907	4:SP2_SP3_SP3	As[4]	Ge[4,6]	Ge[4,6]	4:4:	3:3:2:2:	3:3:2:2:	Ge[4,6]-4:Ge[4,6]-4:	N[6]-3:N[6]-3:As[4]-2:As[4]-2:	N[6]-3:N[6]-3:As[4]-2:As[4]-2:	As[4](Ge[4,6]As[4]N[6]2)2	Ge[4,6](N[6]C[6a]C[6])2(As[4]Ge[4,6])2	Ge[4,6](N[6]C[6a]C[6])2(As[4]Ge[4,6])2	As[4](Ge[4,6]As[4]N[6]2)2{8|C<3>}	Ge[4,6](N[6]C[6a]C[6])2(As[4]Ge[4,6])2{2|H<1>,2|N<3>,5|C<3>}	Ge[4,6](N[6]C[6a]C[6])2(As[4]Ge[4,6])2{2|H<1>,2|N<3>,5|C<3>}	73.4849	0.121	2	73.4849	0.015	2	73.4849	0.015	2	73.4849	0.015	2	73.4849	0.015	2	73.4849	0.015	2
978	996	996	4:SP2_SP3_SP3	As[4]	Si[4,4]	Si[4,4]	4:4:	2:2:3:3:	2:2:3:3:	Si[4,4]-4:Si[4,4]-4:	As[4]-2:As[4]-2:N[4]-3:N[4]-3:	As[4]-2:As[4]-2:N[4]-3:N[4]-3:	As[4](Si[4,4]As[4]N[4]2)2	Si[4,4](As[4]Si[4,4])2(N[4]C[4]C)2	Si[4,4](As[4]Si[4,4])2(N[4]C[4]C)2	As[4](Si[4,4]As[4]N[4]2)2{2|C<3>,4|C<4>}	Si[4,4](As[4]Si[4,4])2(N[4]C[4]C)2{1|C<3>,2|N<3>}	Si[4,4](As[4]Si[4,4])2(N[4]C[4]C)2{1|C<3>,2|N<3>}	71.3935	0.000	1	71.3935	0.000	1	71.3935	0.000	1	71.3935	0.000	1	71.3935	0.000	1	71.3935	0.000	1
979	3	880	0:SP2_SP2_SP3	Si	B[5a]	Si	3:3:4:	2:2:3:	3:4:4:4:	B[5a]-3:Si-3:Si-4:	O[5a]-2:O[5a]-2:Si-3:	Si-3:C-4:C-4:C-4:	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	B[5a](O[5a]C[5a,6a])2(SiSi2)	Si(SiB[5a]Si)(CSi2H)2(CCCH)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	B[5a](O[5a]C[5a,6a])2(SiSi2){2|C<3>}	Si(SiB[5a]Si)(CSi2H)2(CCCH)	121.3560	0.000	1	121.3560	0.000	1	121.3560	0.000	1	121.3560	0.000	1	121.3560	0.000	1	121.3560	0.000	1
979	3	979	0:SP2_SP2_SP2	Si	B[5a]	Si	3:3:4:	2:2:3:	3:4:1:	B[5a]-3:Si-3:Si-4:	O[5a]-2:O[5a]-2:Si-3:	Si-3:Si-4:H-1:	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	B[5a](O[5a]C[5a,6a])2(SiSi2)	Si(SiB[5a]Si)(SiC3)(H)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	B[5a](O[5a]C[5a,6a])2(SiSi2){2|C<3>}	Si(SiB[5a]Si)(SiC3)(H)	112.2950	0.000	1	112.2950	0.000	1	112.2950	0.000	1	112.2950	0.000	1	112.2950	0.000	1	112.2950	0.000	1
979	466	490	0:SP2_SP3_SP3	Si	C[6]	C	4:4:4:	3:4:3:1:	3:4:1:1:	C[6]-4:C-4:C-4:	C[6]-3:C[6]-4:Si-3:H-1:	Si-3:C-4:H-1:H-1:	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(SiCC)(H)	C(SiC[6]C)(CH3)(H)2	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(SiCC)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C(SiC[6]C)(CH3)(H)2	110.4475	0.069	2	110.4475	0.005	2	110.4475	0.005	2	110.4475	0.005	2	110.6130	4.529	8	110.6130	4.529	8
979	466	490	0:SP2_SP3_SP3	Si	C[6]	C	4:4:4:	4:4:3:1:	3:4:1:1:	C[6]-4:C-4:C-4:	C[6]-4:C[6]-4:Si-3:H-1:	Si-3:C-4:H-1:H-1:	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6,6a]HH)(C[6]N[6]CH)(SiCC)(H)	C(SiC[6]C)(CH3)(H)2	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6,6a]HH)(C[6]N[6]CH)(SiCC)(H){1|S<4>,2|C<3>}	C(SiC[6]C)(CH3)(H)2	112.6160	4.254	2	112.6160	18.096	2	110.6682	6.325	6	110.6682	6.325	6	110.6130	4.529	8	110.6130	4.529	8
979	466	490	0:SP2_SP3_SP3	Si	C[6]	C	4:4:4:	4:4:3:1:	3:4:1:1:	C[6]-4:C-4:C-4:	C[6]-4:C[6]-4:Si-3:H-1:	Si-3:C-4:H-1:H-1:	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6]HH)(C[6]N[6]HH)(SiCC)(H)	C(SiC[6]C)(CH3)(H)2	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6]HH)(C[6]N[6]HH)(SiCC)(H){1|C<4>,1|S<4>,2|H<1>}	C(SiC[6]C)(CH3)(H)2	109.0800	0.757	2	109.6942	0.715	4	110.6682	6.325	6	110.6682	6.325	6	110.6130	4.529	8	110.6130	4.529	8
979	466	490	0:SP2_SP3_SP3	Si	C[6]	C	4:4:4:	4:4:3:1:	3:4:1:1:	C[6]-4:C-4:C-4:	C[6]-4:C[6]-4:Si-3:H-1:	Si-3:C-4:H-1:H-1:	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6]HH)(C[6]N[6]HH)(SiCC)(H)	C(SiC[6]C)(CH3)(H)2	Si(C[6]C[6]2H)(CCHH)2	C[6](C[6]C[6]HH)(C[6]N[6]HH)(SiCC)(H){1|C<4>,2|C<3>}	C(SiC[6]C)(CH3)(H)2	110.3085	0.252	2	109.6942	0.715	4	110.6682	6.325	6	110.6682	6.325	6	110.6130	4.529	8	110.6130	4.529	8
979	474	490	0:SP2_SP3_SP3	Si	C[5,5]	C	4:4:4:	3:3:4:3:	3:1:1:1:	C[5,5]-4:C-4:C-4:	C[5,6a]-3:C[5,6a]-3:C[3x5]-4:Si-3:	Si-3:H-1:H-1:H-1:	Si(C[5,5]C[5,6a]2C[3x5])(CH3)2	C[5,5](C[5,6a]C[5,6a]C[6a])2(C[3x5]C[5,5]2H)(SiCC)	C(SiC[5,5]C)(H)3	Si(C[5,5]C[5,6a]2C[3x5])(CH3)2	C[5,5](C[5,6a]C[5,6a]C[6a])2(C[3x5]C[5,5]2H)(SiCC){2|Si<3>,2|H<1>,6|C<3>}	C(SiC[5,5]C)(H)3	111.8313	1.601	6	111.8313	2.563	6	111.8313	2.563	6	111.8313	2.563	6	111.8313	2.563	6	111.8313	2.563	6
979	474	643	0:SP2_SP2_SP3	Si	C[5]	C[6a]	4:3:3:	3:3:3:1:	3:3:3:	C[5]-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:Si-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]S)(SiC[6a]2)(H)	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5])	Si(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]S)(SiC[6a]2)(H){1|H<1>,1|P<4>,2|C<3>}	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5]){1|C<3>,2|H<1>}	110.2465	0.500	2	110.2465	0.250	2	110.2465	0.250	2	110.2465	0.250	2	110.2465	0.250	2	110.2465	0.250	2
979	474	818	0:SP2_SP2_SP3	Si	C[5]	C[5]	4:3:4:	3:3:3:4:	3:3:3:	C[5]-4:C[5]-3:Si-4:	C[5]-3:C[5]-3:Si-3:C-4:	N[5]-3:N[5]-3:Si-3:	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](C[5]C[5]C)2(SiC[5]Si)(CH3)	C[5](N[5]C[5]C)2(SiC[5]Si)	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](C[5]C[5]C)2(SiC[5]Si)(CH3){2|C<4>}	C[5](N[5]C[5]C)2(SiC[5]Si){2|C<4>}	96.3210	0.000	1	96.3210	0.000	1	96.3210	0.000	1	96.3210	0.000	1	96.3210	0.000	1	96.3210	0.000	1
979	474	880	0:SP2_SP3_SP3	Si	C[5]	Si	4:3:4:	3:3:3:4:	3:4:4:4:	C[5]-4:C[5]-3:Si-4:	C[5]-3:C[5]-3:Si-3:C-4:	Si-3:Si-4:Si-4:Si-4:	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](C[5]C[5]C)2(SiC[5]Si)(CH3)	Si(SiC[5]2)(SiC3)3	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](C[5]C[5]C)2(SiC[5]Si)(CH3){2|C<4>}	Si(SiC[5]2)(SiC3)3	116.5430	0.000	1	116.5430	0.000	1	116.5430	0.000	1	116.5430	0.000	1	116.5430	0.000	1	116.5430	0.000	1
979	474	944	0:SP2_SP-NON_SP3	Si	C[5]	I	4:3:1:	3:4:3:1:	3:	C[5]-4:Si-3:I-1:	N[5]-3:C[5]-4:Si-3:H-1:	Si-3:	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiI)(H)	I(SiC[5]Si)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiI)(H){2|C<3>,2|C<4>,2|H<1>}	I(SiC[5]Si)	114.1280	0.672	2	114.1280	0.451	2	114.1280	0.451	2	114.1280	0.451	2	114.1280	0.451	2	114.1280	0.451	2
979	474	956	0:SP2_SP2_SP3	Si	C[5]	N	4:3:3:	3:3:3:4:	3:4:4:	C[5]-4:Si-3:N-3:	C[5]-3:C[5]-3:Si-3:C-4:	Si-3:Si-4:Si-4:	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	C[5](C[5]C[5]C)2(SiSiN)(CH3)	N(SiC[5]Si)(SiC3)2	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	C[5](C[5]C[5]C)2(SiSiN)(CH3){2|C<4>}	N(SiC[5]Si)(SiC3)2	116.6265	0.334	2	116.6265	0.112	2	116.6265	0.112	2	116.6265	0.112	2	116.6265	0.112	2	116.6265	0.112	2
979	474	979	0:SP2_SP2_SP3	Si	C[5]	Si	4:3:1:	3:4:3:1:	4:3:1:	C[5]-4:Si-3:I-1:	N[5]-3:C[5]-4:Si-3:H-1:	C[5]-4:Si-3:I-1:	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiI)(H)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiI)(H){2|C<3>,2|C<4>,2|H<1>}	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	107.9165	0.412	2	107.9165	0.170	2	107.9165	0.170	2	107.9165	0.170	2	114.5605	58.914	4	114.5605	58.914	4
979	474	979	0:SP2_SP2_SP3	Si	C[5]	Si	4:3:3:	3:3:3:4:	4:3:3:	C[5]-4:Si-3:N-3:	C[5]-3:C[5]-3:Si-3:C-4:	C[5]-4:Si-3:N-3:	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	C[5](C[5]C[5]C)2(SiSiN)(CH3)	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	C[5](C[5]C[5]C)2(SiSiN)(CH3){2|C<4>}	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	121.2045	0.047	2	121.2045	0.002	2	121.2045	0.002	2	121.2045	0.002	2	114.5605	58.914	4	114.5605	58.914	4
979	486	643	0:SP2_SP2_SP3	Si	C[3]	C[6a]	3:3:4:	4:4:3:1:	3:3:3:	C[6a]-3:C[6a]-3:C[3]-4:	C[3]-4:C[3]-4:Si-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(C[3]C[3]2H)	C[3](C[3]C[6a]C[3]C)(C[3]C[3]HH)(SiC[6a]2)(H)	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3])	Si(C[6a]C[6a]2)2(C[3]C[3]2H)	C[3](C[3]C[6a]C[3]C)(C[3]C[3]HH)(SiC[6a]2)(H){2|C<3>}	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	110.1555	3.359	2	110.1555	11.286	2	110.1555	11.286	2	110.1555	11.286	2	114.2853	82.049	4	114.2853	82.049	4
979	486	643	0:SP2_SP2_SP3	Si	C[3]	C[6a]	4:3:3:	3:3:3:4:	3:3:3:	C[3]-4:C[6a]-3:C[6a]-3:	Si[3]-3:P[3]-3:Si-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	Si(C[3]Si[3]P[3]C)(C[6a]C[6a]2)2	C[3](Si[3]C[5]P[3])(P[3]Si[3]Si)(SiC[6a]2)(CC3)	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3])	Si(C[3]Si[3]P[3]C)(C[6a]C[6a]2)2	C[3](Si[3]C[5]P[3])(P[3]Si[3]Si)(SiC[6a]2)(CC3){2|N<3>}	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	118.4150	12.909	2	118.4150	166.641	2	118.4150	166.641	2	118.4150	166.641	2	114.2853	82.049	4	114.2853	82.049	4
979	490	490	0:SP2_SP3_SP3	Si	C	C	3:4:4:	3:1:1:1:	3:1:1:1:	C[5]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(C[5]C[5]N[5])(CH3)2	C(SiC[5]C)(H)3	C(SiC[5]C)(H)3	Si(C[5]C[5]N[5])(CH3)2	C(SiC[5]C)(H)3	C(SiC[5]C)(H)3	103.6370	0.000	1	103.6370	0.000	1	103.6370	0.000	1	111.7916	35.866	5	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	3:4:4:	3:1:1:1:	3:1:1:1:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C(SiC[6a]C)(H)3	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C(SiC[6a]C)(H)3	115.5900	0.000	1	115.5900	0.000	1	113.8303	20.114	4	111.7916	35.866	5	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	3:4:4:	3:1:1:1:	3:1:1:1:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C(SiC[6a]C)(H)3	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C(SiC[6a]C)(H)3	113.2437	5.302	3	113.2437	28.107	3	113.8303	20.114	4	111.7916	35.866	5	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	3:4:4:	3:4:4:4:	3:4:4:4:	C[6a]-3:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(C[6a]C[6a]2)(CC3)2	C(SiC[6a]C)(CH3)3	C(SiC[6a]C)(CH3)3	Si(C[6a]C[6a]2)(CC3)2	C(SiC[6a]C)(CH3)3	C(SiC[6a]C)(CH3)3	110.9695	0.194	4	110.9695	0.038	4	110.9695	0.038	4	110.9695	0.038	4	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:2:	3:1:1:1:	3:1:1:1:	C-4:C-4:O-2:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(CH3)2(OSi)	C(SiCO)(H)3	C(SiCO)(H)3	Si(CH3)2(OSi)	C(SiCO)(H)3	C(SiCO)(H)3	111.8980	0.000	1	111.8980	0.000	1	111.8980	0.000	1	111.8980	0.000	1	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:1:1:1:	3:1:1:1:	C-4:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(CH3)3	C(SiCC)(H)3	C(SiCC)(H)3	Si(CH3)3	C(SiCC)(H)3	C(SiCC)(H)3	113.7339	1.213	27	113.7339	1.472	27	113.7339	1.472	27	113.2135	3.053	32	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:1:1:1:	3:1:1:1:	C[5,5]-4:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(C[5,5]C[5,6a]2C[3x5])(CH3)2	C(SiC[5,5]C)(H)3	C(SiC[5,5]C)(H)3	Si(C[5,5]C[5,6a]2C[3x5])(CH3)2	C(SiC[5,5]C)(H)3	C(SiC[5,5]C)(H)3	109.7700	1.465	3	109.7700	2.147	3	109.7700	2.147	3	113.2135	3.053	32	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:1:1:1:	3:1:1:1:	C[5]-4:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si-3:H-1:H-1:H-1:	Si(C[5]C[5]2Zr)(CH3)2	C(SiC[5]C)(H)3	C(SiC[5]C)(H)3	Si(C[5]C[5]2Zr)(CH3)2	C(SiC[5]C)(H)3	C(SiC[5]C)(H)3	111.3535	1.515	2	111.3535	2.296	2	111.3535	2.296	2	113.2135	3.053	32	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:4:1:1:	3:4:1:1:	C[6]-4:C-4:C-4:	Si-3:C-4:H-1:H-1:	Si-3:C-4:H-1:H-1:	Si(C[6]C[6]2H)(CCHH)2	C(SiC[6]C)(CH3)(H)2	C(SiC[6]C)(CH3)(H)2	Si(C[6]C[6]2H)(CCHH)2	C(SiC[6]C)(CH3)(H)2	C(SiC[6]C)(CH3)(H)2	110.4775	1.644	4	110.4775	2.702	4	110.4775	2.702	4	110.4775	2.702	4	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:4:4:1:	3:4:4:1:	C-4:C-4:C-4:	Si-3:C-4:C-4:H-1:	Si-3:C-4:C-4:H-1:	Si(CCCH)3	C(SiCC)(CH3)2(H)	C(SiCC)(CH3)2(H)	Si(CCCH)3	C(SiCC)(CH3)2(H)	C(SiCC)(CH3)2(H)	113.8805	3.508	6	113.8805	12.307	6	113.8805	12.307	6	113.8805	12.307	6	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:4:4:4:	3:1:1:1:	C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si-3:H-1:H-1:H-1:	Si(CC3)2(CH3)	C(SiCC)(CH3)3	C(SiCC)(H)3	Si(CC3)2(CH3)	C(SiCC)(CH3)3	C(SiCC)(H)3	104.2657	2.532	12	104.2657	6.413	12	104.2657	6.413	12	104.2657	6.413	12	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:4:4:4:	3:4:4:4:	C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(CC3)2(CH3)	C(SiCC)(CH3)3	C(SiCC)(CH3)3	Si(CC3)2(CH3)	C(SiCC)(CH3)3	C(SiCC)(CH3)3	112.2193	0.532	6	112.2193	0.283	6	109.5360	3.956	24	109.5360	3.956	24	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	3:4:4:4:	3:4:4:4:	C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(CC3)3	C(SiCC)(CH3)3	C(SiCC)(CH3)3	Si(CC3)3	C(SiCC)(CH3)3	C(SiCC)(CH3)3	108.6416	1.371	18	108.6416	1.880	18	109.5360	3.956	24	109.5360	3.956	24	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	4:4:3:1:	3:4:4:1:	C-4:C-4:C-4:	Si-4:Si-4:Si-3:H-1:	Si-3:C-4:C-4:H-1:	Si(CSi2H)2(CCCH)	C(SiC3)2(SiCC)(H)	C(SiCC)(CH3)2(H)	Si(CSi2H)2(CCCH)	C(SiC3)2(SiCC)(H)	C(SiCC)(CH3)2(H)	111.5230	1.109	4	111.5230	1.230	4	111.5230	1.230	4	111.5230	1.230	4	110.7650	13.735	94	110.7650	13.735	94
979	490	490	0:SP2_SP3_SP3	Si	C	C	4:4:4:	4:4:3:1:	4:4:3:1:	C-4:C-4:C-4:	Si-4:Si-4:Si-3:H-1:	Si-4:Si-4:Si-3:H-1:	Si(CSi2H)2(CCCH)	C(SiC3)2(SiCC)(H)	C(SiC3)2(SiCC)(H)	Si(CSi2H)2(CCCH)	C(SiC3)2(SiCC)(H)	C(SiC3)2(SiCC)(H)	111.5050	0.751	2	111.5050	0.564	2	111.5050	0.564	2	111.5050	0.564	2	110.7650	13.735	94	110.7650	13.735	94
979	490	643	0:SP2_SP2_SP2	Si	C	C[6a]	3:4:4:	3:1:1:1:	3:3:3:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	C[6a,6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC)	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC){1|Si<4>,1|H<1>,3|C<3>}	113.6840	0.000	1	113.6840	0.000	1	113.6840	0.000	1	113.6840	0.000	1	113.6840	0.000	1	113.6840	0.000	1
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:1:1:1:	3:3:3:	C[6a]-3:C[6a]-3:C-4:	Si-3:H-1:H-1:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CH3)	C(SiC[6a]2)(H)3	C[6a](C[6a]C[6a]C)2(SiC[6a]C)	Si(C[6a]C[6a]2)2(CH3)	C(SiC[6a]2)(H)3	C[6a](C[6a]C[6a]C)2(SiC[6a]C){1|C<3>,2|H<1>}	111.2190	0.000	1	111.2190	0.000	1	110.5000	1.034	2	110.5000	1.034	2	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:1:1:1:	3:3:3:	C[6a]-3:C[6a]-3:C-4:	Si-3:H-1:H-1:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CH3)	C(SiC[6a]2)(H)3	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(SiC[6a]C)	Si(C[6a]C[6a]2)2(CH3)	C(SiC[6a]2)(H)3	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(SiC[6a]C){1|C<3>,2|H<1>}	109.7810	0.000	1	109.7810	0.000	1	110.5000	1.034	2	110.5000	1.034	2	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:4:1:1:	3:3:3:	C[6a]-3:Si-3:C-4:	Si-3:C-4:H-1:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C(SiC[6a]Si)(CCHH)(H)2	C[6a](C[6a]C[6a]C)2(SiSiC)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C(SiC[6a]Si)(CCHH)(H)2	C[6a](C[6a]C[6a]C)2(SiSiC){1|C<3>,2|H<1>}	110.1920	0.000	1	110.1920	0.000	1	110.1920	0.000	1	110.1920	0.000	1	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:4:4:1:	3:3:3:	C[6a]-3:Si[5]-3:C-4:	Si-3:C-4:C-4:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C(SiC[6a]Si[5])(CH3)2(H)	C[6a](C[6a]C[6a]C)2(SiSi[5]C)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C(SiC[6a]Si[5])(CH3)2(H)	C[6a](C[6a]C[6a]C)2(SiSi[5]C){1|C<3>,2|H<1>}	118.1570	1.919	2	118.1570	3.683	2	118.1570	3.683	2	118.1570	3.683	2	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:4:4:4:	3:3:3:	C[6a]-3:C[6a]-3:C-4:	Si-3:C-4:C-4:C-4:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CC3)	C(SiC[6a]2)(CH3)3	C[6a](C[6a]C[6a]H)2(SiC[6a]C)	Si(C[6a]C[6a]2)2(CC3)	C(SiC[6a]2)(CH3)3	C[6a](C[6a]C[6a]H)2(SiC[6a]C){1|C<3>,2|H<1>}	104.4240	3.347	2	104.4240	11.205	2	104.4240	11.205	2	106.4033	17.356	3	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:3:4:	3:4:4:4:	3:3:3:	C[6a]-3:Si[5]-3:C-4:	Si-3:C-4:C-4:C-4:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C(SiC[6a]Si[5])(CH3)3	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiSi[5]C)	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C(SiC[6a]Si[5])(CH3)3	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiSi[5]C){2|H<1>,5|C<3>}	110.3620	0.000	1	110.3620	0.000	1	110.3620	0.000	1	106.4033	17.356	3	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:4:2:	3:4:4:4:	3:3:3:	C[6a]-3:C-4:C-2:	Si-3:C-4:C-4:C-4:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(CC3)(CC)	C(SiC[6a]C)(CH3)3	C[6a](C[6a]C[6a]2)2(SiCC)	Si(C[6a]C[6a]2)(CC3)(CC)	C(SiC[6a]C)(CH3)3	C[6a](C[6a]C[6a]2)2(SiCC){2|H<1>,5|C<3>}	121.1290	0.000	1	121.1290	0.000	1	121.1290	0.000	1	121.1290	0.000	1	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:4:4:	3:1:1:1:	3:3:3:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	C[6a,6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC)	Si(C[6a]C[6a,6a]C[6a])(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC){1|Si<4>,1|H<1>,3|C<3>}	116.1520	0.000	1	116.1520	0.000	1	116.1520	0.000	1	117.1703	10.077	7	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:4:4:	3:1:1:1:	3:3:3:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC)	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(SiCC){1|H<1>,4|C<3>}	114.3635	2.020	2	114.3635	4.081	2	117.3400	11.851	6	117.1703	10.077	7	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:4:4:	3:1:1:1:	3:3:3:	C[6a]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a]C[6a]2)2(SiCC)	Si(C[6a]C[6a]2)(CH3)2	C(SiC[6a]C)(H)3	C[6a](C[6a]C[6a]2)2(SiCC){2|H<1>,5|C<3>}	118.8282	3.087	4	118.8282	9.532	4	117.3400	11.851	6	117.1703	10.077	7	111.5827	36.562	24	111.5827	36.562	24
979	490	643	0:SP2_SP2_SP3	Si	C	C[6a]	3:4:4:	3:4:4:4:	3:3:3:	C[6a]-3:C-4:C-4:	Si-3:C-4:C-4:C-4:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(CC3)2	C(SiC[6a]C)(CH3)3	C[6a](C[6a]C[6a]H)2(SiCC)	Si(C[6a]C[6a]2)(CC3)2	C(SiC[6a]C)(CH3)3	C[6a](C[6a]C[6a]H)2(SiCC){1|C<3>,2|H<1>}	106.2434	2.141	8	106.2434	4.585	8	106.2434	4.585	8	106.2434	4.585	8	111.5827	36.562	24	111.5827	36.562	24
979	490	818	0:SP2_SP2_SP3	Si	C	C[5]	3:3:4:	3:1:1:1:	3:4:3:	C[5]-3:Si-3:C-4:	Si-3:H-1:H-1:H-1:	N[5]-3:C[5]-4:Si-3:	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C(SiC[5]Si)(H)3	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiC)	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C(SiC[5]Si)(H)3	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiC){2|C<3>,2|C<4>,2|H<1>}	118.3560	0.232	2	118.3560	0.054	2	118.3560	0.054	2	118.3560	0.054	2	113.8445	27.237	4	113.8445	27.237	4
979	490	818	0:SP2_SP2_SP3	Si	C	C[5]	3:4:4:	3:1:1:1:	3:4:3:	C[5]-3:C-4:C-4:	Si-3:H-1:H-1:H-1:	N[5]-3:C[5]-4:Si-3:	Si(C[5]C[5]N[5])(CH3)2	C(SiC[5]C)(H)3	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiCC)	Si(C[5]C[5]N[5])(CH3)2	C(SiC[5]C)(H)3	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiCC){2|C<3>,2|C<4>,2|H<1>}	109.3330	0.492	2	109.3330	0.242	2	109.3330	0.242	2	109.3330	0.242	2	113.8445	27.237	4	113.8445	27.237	4
979	490	893	0:SP2_SP2_SP3	Si	C	O	2:4:3:	3:1:1:1:	4:3:	O-2:C-4:C-3:	Si-3:H-1:H-1:H-1:	C[6]-4:Si-3:	Si(OC[6])(CH3)(CCC)	C(SiCO)(H)3	O(C[6]C[6]2H)(SiCC)	Si(OC[6])(CH3)(CCC)	C(SiCO)(H)3	O(C[6]C[6]2H)(SiCC)	111.9760	0.000	1	111.9760	0.000	1	111.9760	0.000	1	111.9760	0.000	1	110.6980	11.255	4	110.6980	11.255	4
979	490	893	0:SP2_SP2_SP3	Si	C	O	4:3:2:	3:1:1:1:	4:3:	C-4:C-3:O-2:	Si-3:H-1:H-1:H-1:	C-4:Si-3:	Si(CH3)(CCC)(OC)	C(SiCO)(H)3	O(CC[6a]CH)(SiCC)	Si(CH3)(CCC)(OC)	C(SiCO)(H)3	O(CC[6a]CH)(SiCC)	114.5790	0.000	1	114.5790	0.000	1	114.5790	0.000	1	114.5790	0.000	1	110.6980	11.255	4	110.6980	11.255	4
979	490	893	0:SP2_SP2_SP3	Si	C	O	4:4:2:	3:1:1:1:	4:3:	C-4:C-4:O-2:	Si-3:H-1:H-1:H-1:	Si-4:Si-3:	Si(CH3)2(OSi)	C(SiCO)(H)3	O(SiC3)(SiCC)	Si(CH3)2(OSi)	C(SiCO)(H)3	O(SiC3)(SiCC)	108.1185	1.940	2	108.1185	3.762	2	108.1185	3.762	2	108.1185	3.762	2	110.6980	11.255	4	110.6980	11.255	4
979	490	930	0:SP2_SP2_SP3	Si	C	C	2:4:3:	3:1:1:1:	3:4:4:	O-2:C-4:C-3:	Si-3:H-1:H-1:H-1:	Si-3:C-4:C-4:	Si(OC[6])(CH3)(CCC)	C(SiCO)(H)3	C(SiCO)(CH3)2	Si(OC[6])(CH3)(CCC)	C(SiCO)(H)3	C(SiCO)(CH3)2	123.8690	0.000	1	123.8690	0.000	1	123.8690	0.000	1	123.8690	0.000	1	122.0197	2.576	3	122.0197	2.576	3
979	490	930	0:SP2_SP2_SP3	Si	C	C	4:3:2:	3:1:1:1:	3:4:4:	C-4:C-3:O-2:	Si-3:H-1:H-1:H-1:	Si-3:C-4:C-4:	Si(CH3)(CCC)(OC)	C(SiCO)(H)3	C(SiCO)(CH3)2	Si(CH3)(CCC)(OC)	C(SiCO)(H)3	C(SiCO)(CH3)2	121.1980	0.000	1	121.1980	0.000	1	121.1980	0.000	1	121.1980	0.000	1	122.0197	2.576	3	122.0197	2.576	3
979	490	930	0:SP2_SP2_SP3	Si	C	C	5:4:3:	3:1:1:1:	3:4:4:	Si-5:C-4:C-3:	Si-3:H-1:H-1:H-1:	Si-3:C-4:C-4:	Si(SiLi2SiC)(CH3)(CCC)	C(SiSiC)(H)3	C(SiSiC)(CH3)2	Si(SiLi2SiC)(CH3)(CCC)	C(SiSiC)(H)3	C(SiSiC)(CH3)2	120.9920	0.000	1	120.9920	0.000	1	120.9920	0.000	1	120.9920	0.000	1	122.0197	2.576	3	122.0197	2.576	3
979	490	979	0:SP2_SP2_SP3	Si	C	Si	3:3:4:	3:1:1:1:	3:3:4:	C[5]-3:Si-3:C-4:	Si-3:H-1:H-1:H-1:	C[5]-3:Si-3:C-4:	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C(SiC[5]Si)(H)3	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C(SiC[5]Si)(H)3	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	110.5065	0.206	2	110.5065	0.042	2	110.5065	0.042	2	110.5065	0.042	2	110.5637	0.031	3	110.5637	0.031	3
979	490	979	0:SP2_SP2_SP3	Si	C	Si	3:3:4:	3:4:1:1:	3:3:1:	C[6a]-3:Si-3:C-4:	Si-3:C-4:H-1:H-1:	C[6a]-3:Si-3:Br-1:	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C(SiC[6a]Si)(CCHH)(H)2	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C(SiC[6a]Si)(CCHH)(H)2	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	110.6780	0.000	1	110.6780	0.000	1	110.6780	0.000	1	110.6780	0.000	1	110.5637	0.031	3	110.5637	0.031	3
979	490	983	0:SP2_SP1_SP3	Si	C	C	3:4:2:	3:4:4:4:	3:3:	C[6a]-3:C-4:C-2:	Si-3:C-4:C-4:C-4:	Si-3:C-3:	Si(C[6a]C[6a]2)(CC3)(CC)	C(SiC[6a]C)(CH3)3	C(SiC[6a]C)(CSiC)	Si(C[6a]C[6a]2)(CC3)(CC)	C(SiC[6a]C)(CH3)3	C(SiC[6a]C)(CSiC)	116.7660	0.000	1	116.7660	0.000	1	116.7660	0.000	1	116.7660	0.000	1	116.7660	0.000	1	116.7660	0.000	1
979	490	989	0:SP2_SP2_SP3	Si	C	Si[5]	3:3:4:	3:4:4:1:	4:4:3:	C[6a]-3:Si[5]-3:C-4:	Si-3:C-4:C-4:H-1:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C(SiC[6a]Si[5])(CH3)2(H)	Si[5](C[5]C[5]Si2)2(SiC[6a]C)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C(SiC[6a]Si[5])(CH3)2(H)	Si[5](C[5]C[5]Si2)2(SiC[6a]C){4|H<1>}	118.8910	0.195	2	118.8910	0.038	2	118.8910	0.038	2	118.8910	0.038	2	122.1160	31.221	3	122.1160	31.221	3
979	490	989	0:SP2_SP2_SP3	Si	C	Si[5]	3:3:4:	3:4:4:4:	4:4:3:	C[6a]-3:Si[5]-3:C-4:	Si-3:C-4:C-4:C-4:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C(SiC[6a]Si[5])(CH3)3	Si[5](C[5]C[5]Si2)2(SiC[6a]C)	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C(SiC[6a]Si[5])(CH3)3	Si[5](C[5]C[5]Si2)2(SiC[6a]C){4|H<1>}	128.5660	0.000	1	128.5660	0.000	1	128.5660	0.000	1	128.5660	0.000	1	122.1160	31.221	3	122.1160	31.221	3
979	490	996	0:SP2_SP3_SP3	Si	C	Si[4]	4:4:4:	3:4:1:1:	3:3:3:3:	Si[4]-4:Si[4]-4:C-4:	Si-3:C-4:H-1:H-1:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(CCHH)	C(SiSi[4]2)(CBHH)(H)2	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C)	Si(Si[4]C[6a]N[4]2)2(CCHH)	C(SiSi[4]2)(CBHH)(H)2	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C){1|H<1>,1|O<2>,3|C<3>}	106.6195	5.182	2	106.6195	26.857	2	106.6195	26.857	2	106.6195	26.857	2	106.6195	26.857	2	106.6195	26.857	2
979	618	880	0:SP2_SP2_SP3	Si	B[6,6]	Si	3:3:4:	4:4:3:	3:4:4:4:	B[6,6]-3:Si-3:Si-4:	C[6,6]-4:C[6,6]-4:Si-3:	Si-3:C-4:C-4:C-4:	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	B[6,6](C[6,6]C[6]2H)2(SiSi2)	Si(SiB[6,6]Si)(CSi2H)2(CCCH)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	B[6,6](C[6,6]C[6]2H)2(SiSi2){2|C<4>,8|H<1>}	Si(SiB[6,6]Si)(CSi2H)2(CCCH)	131.9240	0.000	1	131.9240	0.000	1	131.9240	0.000	1	131.9240	0.000	1	131.9240	0.000	1	131.9240	0.000	1
979	618	979	0:SP2_SP2_SP2	Si	B[6,6]	Si	3:3:4:	4:4:3:	3:4:1:	B[6,6]-3:Si-3:Si-4:	C[6,6]-4:C[6,6]-4:Si-3:	Si-3:Si-4:H-1:	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	B[6,6](C[6,6]C[6]2H)2(SiSi2)	Si(SiB[6,6]Si)(SiC3)(H)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	B[6,6](C[6,6]C[6]2H)2(SiSi2){2|C<4>,8|H<1>}	Si(SiB[6,6]Si)(SiC3)(H)	116.9030	0.000	1	116.9030	0.000	1	116.9030	0.000	1	116.9030	0.000	1	116.9030	0.000	1	116.9030	0.000	1
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:2:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:P-2:	C[5,6a]-3:C[5,6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]P)	C[6a](C[6a]C[6a]H)2(SiC[6a]P)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]P){1|C<3>,8|C<4>}	C[6a](C[6a]C[6a]H)2(SiC[6a]P){1|C<3>,2|H<1>}	113.5480	0.000	1	113.5480	0.000	1	113.5480	0.000	1	110.6075	17.293	2	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:2:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:P-2:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(PSi)	C[6a](C[6a]C[6a]C)2(SiC[6a]P)	C[6a](C[6a]C[6a]C)2(SiC[6a]P)	Si(C[6a]C[6a]2)2(PSi)	C[6a](C[6a]C[6a]C)2(SiC[6a]P){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]P){1|C<3>,2|H<1>}	107.6670	0.000	1	107.6670	0.000	1	107.6670	0.000	1	110.6075	17.293	2	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CSiC)	C[6a](C[6a]C[6a]C)2(SiC[6a]C)	C[6a](C[6a]C[6a]C)2(SiC[6a]C)	Si(C[6a]C[6a]2)2(CSiC)	C[6a](C[6a]C[6a]C)2(SiC[6a]C){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]C){1|C<3>,2|H<1>}	113.1425	0.392	2	113.1425	0.154	2	113.1425	0.154	2	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)3	C[6a](C[6a]C[6a]H)2(SiC[6a]2)	C[6a](C[6a]C[6a]H)2(SiC[6a]2)	Si(C[6a]C[6a]2)3	C[6a](C[6a]C[6a]H)2(SiC[6a]2){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(SiC[6a]2){1|C<3>,2|H<1>}	100.3572	1.702	8	100.3572	2.898	8	100.3572	2.898	8	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:P-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(PSiW)	C[6a](C[6a]C[6a]C)2(SiC[6a]P)	C[6a](C[6a]C[6a]C)2(SiC[6a]P)	Si(C[6a]C[6a]2)2(PSiW)	C[6a](C[6a]C[6a]C)2(SiC[6a]P){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]P){1|C<3>,2|H<1>}	104.4570	0.000	1	104.4570	0.000	1	104.4570	0.000	1	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[5,6a]-3:C[5,6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]Si)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]Si){1|C<3>,8|C<4>}	C[6a](C[6a]C[6a]H)2(SiC[6a]Si){1|C<3>,2|H<1>}	118.1420	0.000	1	118.1420	0.000	1	118.1420	0.000	1	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	116.1270	0.000	1	116.1270	0.000	1	115.9670	1.323	3	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si)	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(SiC[6a]Si){1|C<3>,2|H<1>}	117.0290	0.000	1	117.0290	0.000	1	115.9670	1.323	3	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(SiC[6a]Mg)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	Si(C[6a]C[6a]2)2(SiC[6a]Mg)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	114.7450	0.000	1	114.7450	0.000	1	115.9670	1.323	3	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si[5]-3:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	Si-3:C[6a]-3:C[6a]-3:	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5])	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5]){1|N<2>,2|H<1>,4|C<3>}	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	112.6060	0.000	1	111.2365	3.751	2	111.2365	3.751	2	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si[5]-3:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	Si-3:C[6a]-3:C[6a]-3:	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5])	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5]){2|H<1>,5|C<3>}	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	109.8670	0.000	1	111.2365	3.751	2	111.2365	3.751	2	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	Si-3:C[6a]-3:C[6a]-3:	Si(C[6a]C[6a]2)2(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	Si(C[6a]C[6a]2)2(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	113.2650	0.000	1	113.2650	0.000	1	113.2650	0.000	1	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:3:	3:3:3:	3:3:3:	P[3]-3:C[6a]-3:C[6a]-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(P[3]Si[3]C[3])(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3])	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3])	Si(P[3]Si[3]C[3])(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3]){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3]){1|C<3>,2|H<1>}	103.9550	0.000	1	103.9550	0.000	1	103.9550	0.000	1	107.3335	50.525	19	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:4:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CC3)	C[6a](C[6a]C[6a]H)2(SiC[6a]C)	C[6a](C[6a]C[6a]H)2(SiC[6a]C)	Si(C[6a]C[6a]2)2(CC3)	C[6a](C[6a]C[6a]H)2(SiC[6a]C){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(SiC[6a]C){1|C<3>,2|H<1>}	99.3345	0.000	1	99.3345	0.000	1	105.8013	83.638	2	107.9732	55.971	3	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:4:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(CH3)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(SiC[6a]C)	C[6a](C[6a]C[6a]C)2(SiC[6a]C)	Si(C[6a]C[6a]2)2(CH3)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(SiC[6a]C){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]C){1|C<3>,2|H<1>}	112.2680	0.000	1	112.2680	0.000	1	105.8013	83.638	2	107.9732	55.971	3	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	3:3:4:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:C[3]-4:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(C[3]C[3]2H)	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3])	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3])	Si(C[6a]C[6a]2)2(C[3]C[3]2H)	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	112.3170	0.000	1	112.3170	0.000	1	112.3170	0.000	1	107.9732	55.971	3	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	4:3:3:	3:3:3:	3:3:3:	C[3]-4:C[6a]-3:C[6a]-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[3]Si[3]P[3]C)(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3])	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3])	Si(C[3]Si[3]P[3]C)(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]C)2(SiC[6a]C[3]){1|C<3>,2|H<1>}	100.0950	0.000	1	100.0950	0.000	1	100.0950	0.000	1	106.2880	76.706	2	107.5787	45.547	26	107.5787	45.547	26
979	643	643	0:SP2_SP2_SP2	Si	C[6a]	C[6a]	4:3:3:	3:3:3:	3:3:3:	C[5]-4:C[6a]-3:C[6a]-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5])	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5])	Si(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5]){1|C<3>,2|H<1>}	C[6a](C[6a]C[6a]H)2(SiC[6a]C[5]){1|C<3>,2|H<1>}	112.4810	0.000	1	112.4810	0.000	1	112.4810	0.000	1	106.2880	76.706	2	107.5787	45.547	26	107.5787	45.547	26
979	643	727	0:SP2_SP2_SP2	Si	C[6a]	C[5a]	3:3:3:	3:3:3:	3:3:2:	C[5a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	Si-3:C[5a]-3:S[5a]-2:	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a])	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a]){1|Si<3>,1|H<1>}	110.7265	0.592	2	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3
979	643	727	0:SP2_SP2_SP2	Si	C[6a]	C[5a]	3:3:3:	3:3:3:	3:3:2:	C[5a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	Si-3:C[5a]-3:S[5a]-2:	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a])	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a]){2|H<1>}	111.7210	0.000	1	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3	111.0580	0.505	3
979	643	818	0:SP2_SP2_SP2	Si	C[6a]	C[5]	3:3:1:	3:3:3:	3:3:3:	C[6a]-3:C[5]-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	N[5]-3:N[5]-3:Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[6a](C[6a]C[6a]2)2(SiC[5]H)	C[5](N[5]C[5]C)2(SiC[6a]H)	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[6a](C[6a]C[6a]2)2(SiC[5]H){2|H<1>,5|C<3>}	C[5](N[5]C[5]C)2(SiC[6a]H){2|C<4>}	98.8480	0.000	1	98.8480	0.000	1	98.8480	0.000	1	98.8480	0.000	1	105.5385	26.898	4	105.5385	26.898	4
979	643	818	0:SP2_SP2_SP2	Si	C[6a]	C[5]	3:3:2:	3:3:3:	3:3:3:	C[6a]-3:C[5]-3:P-2:	C[6a]-3:C[6a]-3:Si-3:	N[5]-3:N[5]-3:Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[6a](C[6a]C[6a]2)2(SiC[5]P)	C[5](N[5]C[5]C)2(SiC[6a]P)	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[6a](C[6a]C[6a]2)2(SiC[5]P){2|H<1>,5|C<3>}	C[5](N[5]C[5]C)2(SiC[6a]P){2|C<4>}	106.8820	0.000	1	106.8820	0.000	1	106.8820	0.000	1	106.8820	0.000	1	105.5385	26.898	4	105.5385	26.898	4
979	643	818	0:SP2_SP2_SP2	Si	C[6a]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[5]-3:C[5]-3:	C[6a]-3:C[6a]-3:Si-3:	Si-3:N[5]-3:N[5]-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)2	C[6a](C[6a]C[6a]2)2(SiC[5]2)	C[5](SiC[6a]C[5])(N[5]C[5]C)2	Si(C[6a]C[6a]2)(C[5]N[5]2)2	C[6a](C[6a]C[6a]2)2(SiC[5]2){2|H<1>,5|C<3>}	C[5](SiC[6a]C[5])(N[5]C[5]C)2{2|C<4>}	108.2120	4.453	2	108.2120	19.832	2	108.2120	19.832	2	108.2120	19.832	2	105.5385	26.898	4	105.5385	26.898	4
979	643	852	0:SP2_SP2_SP3	Si	C[6a]	P[3]	3:3:3:	3:3:3:	3:4:3:	P[3]-3:C[6a]-3:C[6a]-3:	C[6a]-3:C[6a]-3:Si-3:	Si[3]-3:C[3]-4:Si-3:	Si(P[3]Si[3]C[3])(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3])	P[3](Si[3]C[3]C[5])(C[3]Si[3]SiC)(SiC[6a]2)	Si(P[3]Si[3]C[3])(C[6a]C[6a]2)2	C[6a](C[6a]C[6a]C)2(SiC[6a]P[3]){1|C<3>,2|H<1>}	P[3](Si[3]C[3]C[5])(C[3]Si[3]SiC)(SiC[6a]2){2|N<3>}	113.3615	10.275	2	113.3615	105.575	2	113.3615	105.575	2	113.3615	105.575	2	113.3615	105.575	2	113.3615	105.575	2
979	643	880	0:SP2_SP2_SP3	Si	C[6a]	Si	3:3:4:	3:3:3:	3:4:4:4:	C[6a]-3:Si[5]-3:Si-4:	C[6a]-3:C[6a]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si)	Si(SiC[6a]Si[5])(CH3)3	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si){1|C<3>,2|H<1>}	Si(SiC[6a]Si[5])(CH3)3	105.4390	0.000	1	105.4390	0.000	1	105.4390	0.000	1	108.8765	23.633	2	113.5505	37.770	4	113.5505	37.770	4
979	643	880	0:SP2_SP2_SP3	Si	C[6a]	Si	3:3:4:	3:3:3:	3:4:4:4:	C[6a]-3:Si[5]-3:Si-4:	C[6a]-3:C[6a]-3:Si-3:	Si-3:Si-4:C-4:C-4:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si)	Si(SiC[6a]Si[5])(SiSiCC)(CH3)2	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si){1|C<3>,2|H<1>}	Si(SiC[6a]Si[5])(SiSiCC)(CH3)2	112.3140	0.000	1	112.3140	0.000	1	112.3140	0.000	1	108.8765	23.633	2	113.5505	37.770	4	113.5505	37.770	4
979	643	880	0:SP2_SP2_SP3	Si	C[6a]	Si	3:4:4:	3:3:3:	3:4:4:4:	C[6a]-3:Si-4:Si-4:	C[6a]-3:C[6a]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[6a]C[6a]2)(SiC3)2	C[6a](C[6a]C[6a]H)2(SiSi2)	Si(SiC[6a]Si)(CC3)2(CH3)	Si(C[6a]C[6a]2)(SiC3)2	C[6a](C[6a]C[6a]H)2(SiSi2){1|Si<3>,1|C<3>,1|H<1>}	Si(SiC[6a]Si)(CC3)2(CH3)	118.2245	1.514	2	118.2245	2.292	2	118.2245	2.292	2	118.2245	2.292	2	113.5505	37.770	4	113.5505	37.770	4
979	643	924	0:SP2_SP-NON_SP2	Si	C[6a]	Br	3:3:1:	3:3:3:	3:	C[6a]-3:Si-3:Br-1:	C[6a]-3:C[6a]-3:Si-3:	Si-3:	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi){1|C<3>,2|H<1>}	Br(SiC[6a]Si)	109.9440	4.486	2	109.9440	20.123	2	109.7337	10.194	3	109.7337	10.194	3	109.7337	10.194	3	109.7337	10.194	3
979	643	924	0:SP2_SP-NON_SP2	Si	C[6a]	Br	3:3:1:	3:3:3:	3:	C[6a]-3:Si-3:Br-1:	C[6a]-3:C[6a]-3:Si-3:	Si-3:	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi){1|C<3>,2|H<1>}	Br(SiC[6a]Si)	109.3130	0.000	1	109.3130	0.000	1	109.7337	10.194	3	109.7337	10.194	3	109.7337	10.194	3	109.7337	10.194	3
979	643	930	0:SP2_SP2_SP2	Si	C[6a]	C	3:3:3:	3:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:Si-3:	Si-3:Si-3:C-4:	Si(C[6a]C[6a]2)2(CSiC)	C[6a](C[6a]C[6a]C)2(SiC[6a]C)	C(SiC[6a]2)(SiC[5]P)(CC3)	Si(C[6a]C[6a]2)2(CSiC)	C[6a](C[6a]C[6a]C)2(SiC[6a]C){1|C<3>,2|H<1>}	C(SiC[6a]2)(SiC[5]P)(CC3)	110.5400	6.109	4	110.5400	37.318	4	110.5400	37.318	4	110.5400	37.318	4	110.5400	37.318	4	110.5400	37.318	4
979	643	940	0:SP2_SP-NON_SP2	Si	C[6a]	P	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[5]-3:P-2:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[6a](C[6a]C[6a]2)2(SiC[5]P)	P(C[6a]C[6a]2)(SiC[6a]C[5])	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[6a](C[6a]C[6a]2)2(SiC[5]P){2|H<1>,5|C<3>}	P(C[6a]C[6a]2)(SiC[6a]C[5])	119.3800	0.000	1	119.3800	0.000	1	119.3800	0.000	1	115.9254	95.553	5	115.9254	95.553	5	115.9254	95.553	5
979	643	940	0:SP2_SP-NON_SP2	Si	C[6a]	P	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6a]-3:P-2:	C[5,6a]-3:C[5,6a]-3:Si-3:	C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]P)	P(C[6a]C[5,6a]2)(SiC[6a]2)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]P){1|C<3>,8|C<4>}	P(C[6a]C[5,6a]2)(SiC[6a]2)	120.3780	0.000	1	120.3780	0.000	1	120.3780	0.000	1	115.9254	95.553	5	115.9254	95.553	5	115.9254	95.553	5
979	643	940	0:SP2_SP-NON_SP2	Si	C[6a]	P	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6a]-3:P-2:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[6a]C[6a]H)2(SiC[6a]P)	P(C[6a]C[5,6a]2)(SiC[6a]2)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(PC[6a])	C[6a](C[6a]C[6a]H)2(SiC[6a]P){1|C<3>,2|H<1>}	P(C[6a]C[5,6a]2)(SiC[6a]2)	126.0500	0.000	1	126.0500	0.000	1	126.0500	0.000	1	115.9254	95.553	5	115.9254	95.553	5	115.9254	95.553	5
979	643	940	0:SP2_SP-NON_SP2	Si	C[6a]	P	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[6a]-3:P-2:	C[6a]-3:C[6a]-3:Si-3:	Si-3:Si-3:	Si(C[6a]C[6a]2)2(PSi)	C[6a](C[6a]C[6a]C)2(SiC[6a]P)	P(SiC[6a]2)(SiC[5]C)	Si(C[6a]C[6a]2)2(PSi)	C[6a](C[6a]C[6a]C)2(SiC[6a]P){1|C<3>,2|H<1>}	P(SiC[6a]2)(SiC[5]C)	106.9095	9.240	2	106.9095	85.373	2	106.9095	85.373	2	115.9254	95.553	5	115.9254	95.553	5	115.9254	95.553	5
979	643	951	0:SP2_SP-NON_SP2	Si	C[6a]	H	3:3:1:	3:3:3:	3:	C[6a]-3:C[5]-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[6a](C[6a]C[6a]2)2(SiC[5]H)	H(SiC[6a]C[5])	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[6a](C[6a]C[6a]2)2(SiC[5]H){2|H<1>,5|C<3>}	H(SiC[6a]C[5])	98.2055	0.000	1	98.2055	0.000	1	98.2055	0.000	1	106.3692	133.294	2	106.3692	133.294	2	106.3692	133.294	2
979	643	951	0:SP2_SP-NON_SP2	Si	C[6a]	H	3:3:1:	3:3:3:	3:	C[6a]-3:Si-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	Si-3:	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	C[6a](C[6a]C[6a]C)2(SiSiH)	H(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	C[6a](C[6a]C[6a]C)2(SiSiH){1|C<3>,2|H<1>}	H(SiC[6a]Si)	114.5330	0.000	1	114.5330	0.000	1	114.5330	0.000	1	106.3692	133.294	2	106.3692	133.294	2	106.3692	133.294	2
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:1:	3:3:3:	3:3:1:	C[6a]-3:Si-3:Br-1:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:Br-1:	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	128.4965	6.213	2	128.4965	38.606	2	128.4965	38.606	2	127.9557	20.180	3	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:1:	3:3:3:	3:3:1:	C[6a]-3:Si-3:H-1:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:H-1:	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	C[6a](C[6a]C[6a]C)2(SiSiH)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	C[6a](C[6a]C[6a]C)2(SiSiH){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	126.8740	0.000	1	126.8740	0.000	1	126.8740	0.000	1	127.9557	20.180	3	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:1:	3:3:3:	3:3:4:	C[6a]-3:Si-3:Br-1:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:C-4:	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	C[6a](C[6a]C[6a]C)2(SiBrSi){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	127.0320	0.000	1	127.0320	0.000	1	127.0320	0.000	1	127.0320	0.000	1	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:2:	3:3:3:	3:3:2:	C[6a]-3:Si-3:C-2:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:C-2:	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C[6a](C[6a]C[6a]C)2(SiSiC)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C[6a](C[6a]C[6a]C)2(SiSiC){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	131.8110	0.000	1	131.8110	0.000	1	131.8110	0.000	1	131.8110	0.000	1	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[5,6a]-3:C[5,6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]Si)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[5,6a]C[5,6a]C[5])2(SiC[6a]Si){1|C<3>,8|C<4>}	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	122.7070	0.000	1	122.7070	0.000	1	122.7070	0.000	1	121.3250	17.873	6	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si){1|C<3>,2|H<1>}	Si(C[6a]C[5,6a]2)(C[6a]C[6a]2)(SiC[6a]2)	119.0730	0.000	1	119.0730	0.000	1	121.0486	21.768	5	121.3250	17.873	6	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si)	Si(C[6a]C[6a]2)2(SiC[6a]2)	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]C)2(SiC[6a]Si){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)2(SiC[6a]2)	123.2170	4.927	3	123.2170	24.273	3	121.0486	21.768	5	121.3250	17.873	6	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si)	Si(C[6a]C[6a]2)2(SiC[6a]2)	Si(C[6a]C[6a]2)2(SiC[6a]2)	C[6a](C[6a]C[6a]H)2(SiC[6a]Si){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)2(SiC[6a]2)	116.5190	0.000	1	116.5190	0.000	1	121.0486	21.768	5	121.3250	17.873	6	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	3:3:4:	3:3:3:	3:3:1:	C[6a]-3:Si-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:Br-1:	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C[6a](C[6a]C[6a]C)2(SiSiC)	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	C[6a](C[6a]C[6a]C)2(SiSiC){1|C<3>,2|H<1>}	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	131.3630	0.000	1	131.3630	0.000	1	131.3630	0.000	1	131.3630	0.000	1	124.3922	35.140	13	124.3922	35.140	13
979	643	979	0:SP2_SP2_SP2	Si	C[6a]	Si	4:3:3:	3:3:3:	4:3:3:	C[5]-4:C[6a]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	C[5]-4:C[6a]-3:Si-3:	Si(C[5]C[5]2Fe)(C[6a]C[6a]2)(SiC[6a]C[5])	C[6a](C[6a]C[6a]C)2(SiC[5]Si)	Si(C[5]C[5]2Fe)(C[6a]C[6a]2)(SiC[6a]C[5])	Si(C[5]C[5]2Fe)(C[6a]C[6a]2)(SiC[6a]C[5])	C[6a](C[6a]C[6a]C)2(SiC[5]Si){1|C<3>,2|H<1>}	Si(C[5]C[5]2Fe)(C[6a]C[6a]2)(SiC[6a]C[5])	115.0750	0.000	1	115.0750	0.000	1	115.0750	0.000	1	115.0750	0.000	1	124.3922	35.140	13	124.3922	35.140	13
979	643	983	0:SP2_SP1_SP2	Si	C[6a]	C	3:3:2:	3:3:3:	3:2:	C[6a]-3:Si-3:C-2:	C[6a]-3:C[6a]-3:Si-3:	Si-3:C-2:	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C[6a](C[6a]C[6a]C)2(SiSiC)	C(SiC[6a]Si)(CSi)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C[6a](C[6a]C[6a]C)2(SiSiC){1|C<3>,2|H<1>}	C(SiC[6a]Si)(CSi)	111.1540	0.000	1	111.1540	0.000	1	111.1540	0.000	1	111.1540	0.000	1	116.6290	59.951	2	116.6290	59.951	2
979	643	983	0:SP2_SP1_SP2	Si	C[6a]	C	3:4:2:	3:3:3:	3:3:	C[6a]-3:C-4:C-2:	C[6a]-3:C[6a]-3:Si-3:	Si-3:C-3:	Si(C[6a]C[6a]2)(CC3)(CC)	C[6a](C[6a]C[6a]2)2(SiCC)	C(SiC[6a]C)(CSiC)	Si(C[6a]C[6a]2)(CC3)(CC)	C[6a](C[6a]C[6a]2)2(SiCC){2|H<1>,5|C<3>}	C(SiC[6a]C)(CSiC)	122.1040	0.000	1	122.1040	0.000	1	122.1040	0.000	1	122.1040	0.000	1	116.6290	59.951	2	116.6290	59.951	2
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:3:	3:3:3:	3:4:4:	C[5a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	Si-3:C[5]-4:C[5]-4:	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[5a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2{4|H<1>}	122.7583	1.751	3	122.7583	3.066	3	122.7583	3.066	3	122.7583	3.066	3	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:3:	3:3:3:	4:4:3:	C[6a]-3:C[6a]-3:Si[5]-3:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5])	Si[5](C[5]C[5]Si2)2(SiC[6a]2)	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5]){1|N<2>,2|H<1>,4|C<3>}	Si[5](C[5]C[5]Si2)2(SiC[6a]2){4|H<1>}	121.1290	0.000	1	122.3380	2.923	2	122.3380	2.923	2	123.8818	3.875	6	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:3:	3:3:3:	4:4:3:	C[6a]-3:C[6a]-3:Si[5]-3:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5])	Si[5](C[5]C[5]Si2)2(SiC[6a]2)	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiC[6a]Si[5]){2|H<1>,5|C<3>}	Si[5](C[5]C[5]Si2)2(SiC[6a]2){4|H<1>}	123.5470	0.000	1	122.3380	2.923	2	122.3380	2.923	2	123.8818	3.875	6	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:3:	3:3:3:	4:4:3:	C[6a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	Si[5](C[5]C[5]Si2)2(SiC[6a]2)	Si(C[6a]C[6a,6a]2)(C[6a]C[6a]2)(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	Si[5](C[5]C[5]Si2)2(SiC[6a]2){4|H<1>}	125.9405	0.506	2	125.9405	0.256	2	124.6538	3.101	4	123.8818	3.875	6	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:3:	3:3:3:	4:4:3:	C[6a]-3:C[6a]-3:Si[5]-3:	Si-3:C[6a]-3:C[6a]-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)2(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2	Si[5](C[5]C[5]Si2)2(SiC[6a]2)	Si(C[6a]C[6a]2)2(Si[5]C[5]2)	C[6a](SiC[6a]Si[5])(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	Si[5](C[5]C[5]Si2)2(SiC[6a]2){4|H<1>}	123.3670	1.557	2	123.3670	2.424	2	124.6538	3.101	4	123.8818	3.875	6	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:4:	3:3:3:	4:4:3:	C[6a]-3:Si[5]-3:C-4:	C[6a,6a]-3:C[6a,6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiSi[5]C)	Si[5](C[5]C[5]Si2)2(SiC[6a]C)	Si(C[6a]C[6a,6a]2)(Si[5]C[5]2)(CC3)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(SiSi[5]C){2|H<1>,5|C<3>}	Si[5](C[5]C[5]Si2)2(SiC[6a]C){4|H<1>}	120.4630	0.000	1	120.4630	0.000	1	120.4630	0.000	1	119.6496	5.575	5	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:4:	3:3:3:	4:4:3:	C[6a]-3:Si[5]-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C[6a](C[6a]C[6a]C)2(SiSi[5]C)	Si[5](C[5]C[5]Si2)2(SiC[6a]C)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(CCCH)	C[6a](C[6a]C[6a]C)2(SiSi[5]C){1|C<3>,2|H<1>}	Si[5](C[5]C[5]Si2)2(SiC[6a]C){4|H<1>}	120.6060	0.338	2	120.6060	0.114	2	120.6060	0.114	2	119.6496	5.575	5	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:4:	3:3:3:	4:4:3:	C[6a]-3:Si[5]-3:Si-4:	C[6a]-3:C[6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si)	Si[5](C[5]C[5]Si2)2(SiC[6a]Si)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si){1|C<3>,2|H<1>}	Si[5](C[5]C[5]Si2)2(SiC[6a]Si){4|H<1>}	121.1130	0.000	1	121.1130	0.000	1	118.2865	15.978	2	119.6496	5.575	5	122.1296	7.551	14	122.1296	7.551	14
979	643	989	0:SP2_SP2_SP2	Si	C[6a]	Si[5]	3:3:4:	3:3:3:	4:4:3:	C[6a]-3:Si[5]-3:Si-4:	C[6a]-3:C[6a]-3:Si-3:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si)	Si[5](C[5]C[5]Si2)2(SiC[6a]Si)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	C[6a](C[6a]C[6a]C)2(SiSi[5]Si){1|C<3>,2|H<1>}	Si[5](C[5]C[5]Si2)2(SiC[6a]Si){4|H<1>}	115.4600	0.000	1	115.4600	0.000	1	118.2865	15.978	2	119.6496	5.575	5	122.1296	7.551	14	122.1296	7.551	14
979	690	880	0:SP2_SP-NON_SP3	Si	Ga	Si	4:4:2:	3:3:	3:4:4:4:	Si-4:Si-4:Ga-2:	Si-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(SiC3)2(GaSi)	Ga(SiSi2)2	Si(SiGaSi)(CC3)2(CH3)	Si(SiC3)2(GaSi)	Ga(SiSi2)2	Si(SiGaSi)(CC3)2(CH3)	112.2675	1.407	4	112.2675	1.980	4	112.2675	1.980	4	112.2675	1.980	4	112.2675	1.980	4	112.2675	1.980	4
979	727	989	0:SP2_SP2_SP2	Si	C[5a]	Si[5]	3:3:3:	3:3:2:	3:4:4:	C[5a]-3:C[6a]-3:Si[5]-3:	Si-3:C[5a]-3:S[5a]-2:	Si-3:C[5]-4:C[5]-4:	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a])	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a]){1|Si<3>,1|H<1>}	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2{4|H<1>}	117.6825	0.298	2	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3
979	727	989	0:SP2_SP2_SP2	Si	C[5a]	Si[5]	3:3:3:	3:3:2:	3:4:4:	C[5a]-3:C[6a]-3:Si[5]-3:	Si-3:C[5a]-3:S[5a]-2:	Si-3:C[5]-4:C[5]-4:	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a])	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2	Si(C[5a]C[5a]S[5a])(C[6a]C[6a]2)(Si[5]C[5]2)	C[5a](SiC[6a]Si[5])(C[5a]C[5a]H)(S[5a]C[5a]){2|H<1>}	Si[5](SiC[5a]C[6a])(C[5]C[5]Si2)2{4|H<1>}	119.6580	0.000	1	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3	118.3410	1.345	3
979	790	790	0:SP2_SP-NON_SP-NON	Si	Cl	Cl	1:1:1:	3:	3:	Cl-1:Cl-1:Cl-1:	Si-3:	Si-3:	Si(Cl)3	Cl(SiCl2)	Cl(SiCl2)	Si(Cl)3	Cl(SiCl2)	Cl(SiCl2)	119.9619	51.081	3	119.9619	2609.241	3	119.9619	2609.241	3	119.9619	2609.241	3	119.9619	2609.241	3	119.9619	2609.241	3
979	790	818	0:SP2_SP-NON_SP2	Si	Cl	C[5]	3:3:1:	3:	3:3:3:	C[5]-3:N-3:Cl-1:	Si-3:	N[5]-3:N[5]-3:Si-3:	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	Cl(SiC[5]N)	C[5](N[5]C[5]C)2(SiClN)	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	Cl(SiC[5]N)	C[5](N[5]C[5]C)2(SiClN){2|C<4>}	96.1227	0.000	1	96.1227	0.000	1	96.1227	0.000	1	96.1227	0.000	1	96.1227	0.000	1	96.1227	0.000	1
979	790	951	0:SP2_SP-NON_SP-NON	Si	Cl	H	1:1:1:	3:	3:	Cl-1:H-1:H-1:	Si-3:	Si-3:	Si(Cl)(H)2	Cl(SiHH)	H(SiClH)	Si(Cl)(H)2	Cl(SiHH)	H(SiClH)	94.2206	0.193	2	94.2206	0.037	2	94.2206	0.037	2	94.2206	0.037	2	94.2206	0.037	2	94.2206	0.037	2
979	790	956	0:SP2_SP-NON_SP2	Si	Cl	N	3:3:1:	3:	3:3:4:	C[5]-3:N-3:Cl-1:	Si-3:	C[6a]-3:Si-3:Si-4:	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	Cl(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]Cl)(SiC3)	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	Cl(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]Cl)(SiC3)	105.9220	0.000	1	105.9220	0.000	1	105.9220	0.000	1	105.9220	0.000	1	105.9220	0.000	1	105.9220	0.000	1
979	790	996	0:SP2_SP-NON_SP3	Si	Cl	Si[4]	4:4:1:	3:	3:3:3:3:	Si[4]-4:Si[4]-4:Cl-1:	Si-3:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(Cl)	Cl(SiSi[4]2)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl)	Si(Si[4]C[6a]N[4]2)2(Cl)	Cl(SiSi[4]2)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl){1|H<1>,1|O<2>,3|C<3>}	99.7495	1.442	2	99.7495	2.079	2	99.7495	2.079	2	99.7495	2.079	2	99.7495	2.079	2	99.7495	2.079	2
979	818	818	0:SP2_SP2_SP2	Si	C[5]	C[5]	3:3:3:	3:3:3:	3:3:3:	C[6a]-3:C[5]-3:C[5]-3:	Si-3:N[5]-3:N[5]-3:	Si-3:N[5]-3:N[5]-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)2	C[5](SiC[6a]C[5])(N[5]C[5]C)2	C[5](SiC[6a]C[5])(N[5]C[5]C)2	Si(C[6a]C[6a]2)(C[5]N[5]2)2	C[5](SiC[6a]C[5])(N[5]C[5]C)2{2|C<4>}	C[5](SiC[6a]C[5])(N[5]C[5]C)2{2|C<4>}	93.7791	0.000	1	93.7791	0.000	1	93.7791	0.000	1	93.7791	0.000	1	93.4335	0.239	2	93.4335	0.239	2
979	818	818	0:SP2_SP2_SP2	Si	C[5]	C[5]	3:3:4:	3:3:3:	3:3:3:	C[5]-3:C[5]-3:Si-4:	N[5]-3:N[5]-3:Si-3:	N[5]-3:N[5]-3:Si-3:	Si(C[5]N[5]2)2(SiC3)	C[5](N[5]C[5]C)2(SiC[5]Si)	C[5](N[5]C[5]C)2(SiC[5]Si)	Si(C[5]N[5]2)2(SiC3)	C[5](N[5]C[5]C)2(SiC[5]Si){2|C<4>}	C[5](N[5]C[5]C)2(SiC[5]Si){2|C<4>}	93.0879	0.000	1	93.0879	0.000	1	93.0879	0.000	1	93.0879	0.000	1	93.4335	0.239	2	93.4335	0.239	2
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:3:4:	3:3:3:	3:4:4:4:	C[5]-3:C[5]-3:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)2(SiC3)	C[5](N[5]C[5]C)2(SiC[5]Si)	Si(SiC[5]2)(CC3)3	Si(C[5]N[5]2)2(SiC3)	C[5](N[5]C[5]C)2(SiC[5]Si){2|C<4>}	Si(SiC[5]2)(CC3)3	117.8050	6.108	2	117.8050	37.308	2	117.8050	37.308	2	116.0893	27.484	3	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:3:4:	3:3:3:	3:4:4:4:	C[5]-3:Si-3:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiSiZn)(SiC3)	C[5](N[5]C[5]C)2(SiSi2)	Si(SiC[5]Si)(CSi2H)2(CCCH)	Si(C[5]N[5]2)(SiSiZn)(SiC3)	C[5](N[5]C[5]C)2(SiSi2){2|C<4>}	Si(SiC[5]Si)(CSi2H)2(CCCH)	112.6580	0.000	1	112.6580	0.000	1	112.6580	0.000	1	116.0893	27.484	3	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:4:1:	3:3:3:	3:4:4:4:	C[5]-3:Si-4:H-1:	N[5]-3:N[5]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiC3)(H)	C[5](N[5]C[5]C)2(SiSiH)	Si(SiC[5]H)(CC3)3	Si(C[5]N[5]2)(SiC3)(H)	C[5](N[5]C[5]C)2(SiSiH){2|C<4>}	Si(SiC[5]H)(CC3)3	104.8400	0.000	1	104.8400	0.000	1	104.8400	0.000	1	104.8400	0.000	1	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:4:4:	3:3:3:	3:4:4:4:	C[5]-3:Si-4:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiC3)2	C[5](N[5]C[5]C)2(SiSi2)	Si(SiC[5]Si)(CC3)3	Si(C[5]N[5]2)(SiC3)2	C[5](N[5]C[5]C)2(SiSi2){2|C<4>}	Si(SiC[5]Si)(CC3)3	105.2142	1.176	4	105.2142	1.382	4	104.0305	8.042	5	105.9606	28.785	6	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:4:4:	3:3:3:	3:4:4:4:	C[5]-3:Si-4:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiSi3)(SiC3)	C[5](N[5]C[5]C)2(SiSi2)	Si(SiC[5]Si)(CH3)3	Si(C[5]N[5]2)(SiSi3)(SiC3)	C[5](N[5]C[5]C)2(SiSi2){2|C<4>}	Si(SiC[5]Si)(CH3)3	99.2957	0.000	1	99.2957	0.000	1	104.0305	8.042	5	105.9606	28.785	6	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	3:4:4:	3:3:3:	3:4:4:4:	C[5]-3:Si-4:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:Si-4:Si-4:Si-4:	Si(C[5]N[5]2)(SiSi3)(SiC3)	C[5](N[5]C[5]C)2(SiSi2)	Si(SiC[5]Si)(SiC3)3	Si(C[5]N[5]2)(SiSi3)(SiC3)	C[5](N[5]C[5]C)2(SiSi2){2|C<4>}	Si(SiC[5]Si)(SiC3)3	115.6110	0.000	1	115.6110	0.000	1	115.6110	0.000	1	105.9606	28.785	6	108.5592	43.410	11	108.5592	43.410	11
979	818	880	0:SP2_SP2_SP3	Si	C[5]	Si	4:3:4:	3:3:3:	3:4:4:4:	C[5]-4:C[5]-3:Si-4:	N[5]-3:N[5]-3:Si-3:	Si-3:Si-4:Si-4:Si-4:	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](N[5]C[5]C)2(SiC[5]Si)	Si(SiC[5]2)(SiC3)3	Si(C[5]C[5]2C)(C[5]N[5]2)(SiSi3)	C[5](N[5]C[5]C)2(SiC[5]Si){2|C<4>}	Si(SiC[5]2)(SiC3)3	105.2800	0.000	1	105.2800	0.000	1	105.2800	0.000	1	105.2800	0.000	1	108.5592	43.410	11	108.5592	43.410	11
979	818	930	0:SP2_SP2_SP2	Si	C[5]	C	3:3:2:	3:3:3:	3:3:4:	C[5]-3:C-3:P-2:	N[5]-3:N[5]-3:Si-3:	Si-3:Si-3:C-4:	Si(C[5]N[5]2)(CSiC)(PSi)	C[5](N[5]C[5]C)2(SiCP)	C(SiC[6a]2)(SiC[5]P)(CC3)	Si(C[5]N[5]2)(CSiC)(PSi)	C[5](N[5]C[5]C)2(SiCP){2|C<4>}	C(SiC[6a]2)(SiC[5]P)(CC3)	120.4280	0.000	1	120.4280	0.000	1	120.4280	0.000	1	120.4280	0.000	1	121.2370	1.309	2	121.2370	1.309	2
979	818	930	0:SP2_SP2_SP2	Si	C[5]	C	3:3:3:	3:3:3:	3:3:4:	C[5]-3:C-3:P-3:	N[5]-3:N[5]-3:Si-3:	Si-3:Si-3:C-4:	Si(C[5]N[5]2)(CSiC)(PSiW)	C[5](N[5]C[5]C)2(SiCP)	C(SiC[6a]2)(SiC[5]P)(CC3)	Si(C[5]N[5]2)(CSiC)(PSiW)	C[5](N[5]C[5]C)2(SiCP){2|C<4>}	C(SiC[6a]2)(SiC[5]P)(CC3)	122.0460	0.000	1	122.0460	0.000	1	122.0460	0.000	1	122.0460	0.000	1	121.2370	1.309	2	121.2370	1.309	2
979	818	940	0:SP2_SP-NON_SP2	Si	C[5]	P	3:3:2:	3:3:3:	3:3:	C[5]-3:C-3:P-2:	N[5]-3:N[5]-3:Si-3:	Si-3:Si-3:	Si(C[5]N[5]2)(CSiC)(PSi)	C[5](N[5]C[5]C)2(SiCP)	P(SiC[6a]2)(SiC[5]C)	Si(C[5]N[5]2)(CSiC)(PSi)	C[5](N[5]C[5]C)2(SiCP){2|C<4>}	P(SiC[6a]2)(SiC[5]C)	106.2090	0.000	1	106.2090	0.000	1	106.2090	0.000	1	106.2340	0.001	2	106.2340	0.001	2	106.2340	0.001	2
979	818	940	0:SP2_SP-NON_SP2	Si	C[5]	P	3:3:2:	3:3:3:	3:3:	C[6a]-3:C[5]-3:P-2:	N[5]-3:N[5]-3:Si-3:	C[6a]-3:Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[5](N[5]C[5]C)2(SiC[6a]P)	P(C[6a]C[6a]2)(SiC[6a]C[5])	Si(C[6a]C[6a]2)(C[5]N[5]2)(PC[6a])	C[5](N[5]C[5]C)2(SiC[6a]P){2|C<4>}	P(C[6a]C[6a]2)(SiC[6a]C[5])	106.2590	0.000	1	106.2590	0.000	1	106.2590	0.000	1	106.2340	0.001	2	106.2340	0.001	2	106.2340	0.001	2
979	818	941	0:SP2_SP2_SP2	Si	C[5]	N	3:2:2:	3:3:3:	3:3:	C[5]-3:N-2:N-2:	N[5]-3:N[5]-3:Si-3:	C[6a]-3:Si-3:	Si(C[5]N[5]2)(NC[6a])2	C[5](N[5]C[6a]C[5])2(SiNN)	N(C[6a]C[6a]2)(SiC[5]N)	Si(C[5]N[5]2)(NC[6a])2	C[5](N[5]C[6a]C[5])2(SiNN){2|H<1>,4|C<3>}	N(C[6a]C[6a]2)(SiC[5]N)	106.1585	4.809	2	106.1585	23.127	2	106.1585	23.127	2	106.1585	23.127	2	106.1585	23.127	2	106.1585	23.127	2
979	818	944	0:SP2_SP-NON_SP2	Si	C[5]	I	3:1:1:	3:4:3:	3:	C[5]-3:I-1:I-1:	N[5]-3:C[5]-4:Si-3:	Si-3:	Si(C[5]C[5]N[5])(I)2	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiII)	I(SiC[5]I)	Si(C[5]C[5]N[5])(I)2	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiII){2|C<3>,2|C<4>,2|H<1>}	I(SiC[5]I)	97.3755	2.234	4	97.3755	4.992	4	97.3755	4.992	4	97.3755	4.992	4	97.3755	4.992	4	97.3755	4.992	4
979	818	945	0:SP2_SP2_SP3	Si	C[5]	P	3:3:3:	3:3:3:	3:3:3:	C[5]-3:N-3:P-3:	N[5]-3:N[5]-3:Si-3:	C[6a]-3:C[6a]-3:Si-3:	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	C[5](N[5]C[5]C)2(SiNP)	P(C[6a]C[6a]2)2(SiC[5]N)	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	C[5](N[5]C[5]C)2(SiNP){2|C<4>}	P(C[6a]C[6a]2)2(SiC[5]N)	99.4692	0.000	1	99.4692	0.000	1	99.4692	0.000	1	99.4692	0.000	1	99.4692	0.000	1	99.4692	0.000	1
979	818	951	0:SP2_SP-NON_SP2	Si	C[5]	H	3:3:1:	3:3:3:	3:	C[6a]-3:C[5]-3:H-1:	N[5]-3:N[5]-3:Si-3:	Si-3:	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[5](N[5]C[5]C)2(SiC[6a]H)	H(SiC[6a]C[5])	Si(C[6a]C[6a]2)(C[5]N[5]2)(H)	C[5](N[5]C[5]C)2(SiC[6a]H){2|C<4>}	H(SiC[6a]C[5])	92.7340	0.000	1	92.7340	0.000	1	92.7340	0.000	1	92.7340	0.000	1	96.6023	61.257	3	96.6023	61.257	3
979	818	951	0:SP2_SP-NON_SP2	Si	C[5]	H	3:3:1:	3:4:3:	3:	C[5]-3:Si-3:H-1:	N[5]-3:C[5]-4:Si-3:	Si-3:	Si(C[5]C[5]N[5])(SiC[5]H)(H)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiH)	H(SiC[5]Si)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiH){2|C<3>,2|C<4>,2|H<1>}	H(SiC[5]Si)	105.6100	0.000	1	105.6100	0.000	1	105.6100	0.000	1	105.6100	0.000	1	96.6023	61.257	3	96.6023	61.257	3
979	818	951	0:SP2_SP-NON_SP2	Si	C[5]	H	3:4:1:	3:3:3:	3:	C[5]-3:Si-4:H-1:	N[5]-3:N[5]-3:Si-3:	Si-3:	Si(C[5]N[5]2)(SiC3)(H)	C[5](N[5]C[5]C)2(SiSiH)	H(SiC[5]Si)	Si(C[5]N[5]2)(SiC3)(H)	C[5](N[5]C[5]C)2(SiSiH){2|C<4>}	H(SiC[5]Si)	91.4630	0.000	1	91.4630	0.000	1	91.4630	0.000	1	91.4630	0.000	1	96.6023	61.257	3	96.6023	61.257	3
979	818	956	0:SP2_SP2_SP2	Si	C[5]	N	3:3:1:	3:3:3:	3:3:4:	C[5]-3:N-3:Cl-1:	N[5]-3:N[5]-3:Si-3:	C[6a]-3:Si-3:Si-4:	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	C[5](N[5]C[5]C)2(SiClN)	N(C[6a]C[6a]2)(SiC[5]Cl)(SiC3)	Si(C[5]N[5]2)(NC[6a]Si)(Cl)	C[5](N[5]C[5]C)2(SiClN){2|C<4>}	N(C[6a]C[6a]2)(SiC[5]Cl)(SiC3)	103.1800	0.000	1	103.1800	0.000	1	103.1800	0.000	1	103.1800	0.000	1	102.3795	1.282	2	102.3795	1.282	2
979	818	956	0:SP2_SP2_SP2	Si	C[5]	N	3:3:3:	3:3:3:	3:3:4:	C[5]-3:N-3:P-3:	N[5]-3:N[5]-3:Si-3:	C[6a]-3:Si-3:Si-4:	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	C[5](N[5]C[5]C)2(SiNP)	N(C[6a]C[6a]2)(SiC[5]P)(SiC3)	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	C[5](N[5]C[5]C)2(SiNP){2|C<4>}	N(C[6a]C[6a]2)(SiC[5]P)(SiC3)	101.5790	0.000	1	101.5790	0.000	1	101.5790	0.000	1	101.5790	0.000	1	102.3795	1.282	2	102.3795	1.282	2
979	818	979	0:SP2_SP2_SP2	Si	C[5]	Si	3:3:1:	3:4:3:	3:3:1:	C[5]-3:Si-3:H-1:	N[5]-3:C[5]-4:Si-3:	C[5]-3:Si-3:H-1:	Si(C[5]C[5]N[5])(SiC[5]H)(H)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiH)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiH){2|C<3>,2|C<4>,2|H<1>}	Si(C[5]C[5]N[5])(SiC[5]H)(H)	111.8140	0.000	1	111.8140	0.000	1	111.8140	0.000	1	111.8140	0.000	1	114.4087	5.374	3	114.4087	5.374	3
979	818	979	0:SP2_SP2_SP2	Si	C[5]	Si	3:3:4:	3:4:3:	3:3:4:	C[5]-3:Si-3:C-4:	N[5]-3:C[5]-4:Si-3:	C[5]-3:Si-3:C-4:	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiC)	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(SiSiC){2|C<3>,2|C<4>,2|H<1>}	Si(C[5]C[5]N[5])(SiC[5]C)(CH3)	115.7060	0.806	2	115.7060	0.650	2	115.7060	0.650	2	115.7060	0.650	2	114.4087	5.374	3	114.4087	5.374	3
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	2:4:4:	3:4:4:4:	3:4:4:4:	As-2:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(AsC[6a])(SiC3)2	Si(SiAsSi)(CC3)2(CH3)	Si(SiAsSi)(CC3)2(CH3)	Si(AsC[6a])(SiC3)2	Si(SiAsSi)(CC3)2(CH3)	Si(SiAsSi)(CC3)2(CH3)	127.3150	0.000	1	127.3150	0.000	1	127.3150	0.000	1	127.3150	0.000	1	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:4:	C[5]-3:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiC3)2	Si(SiC[5]Si)(CC3)3	Si(SiC[5]Si)(CC3)3	Si(C[5]N[5]2)(SiC3)2	Si(SiC[5]Si)(CC3)3	Si(SiC[5]Si)(CC3)3	134.9960	0.262	2	134.9960	0.068	2	134.9960	0.068	2	126.5710	75.876	5	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:4:	C[5]-3:Si-4:Si-4:	Si-3:Si-4:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si(C[5]N[5]2)(SiSi3)(SiC3)	Si(SiC[5]Si)(SiC3)3	Si(SiC[5]Si)(CH3)3	Si(C[5]N[5]2)(SiSi3)(SiC3)	Si(SiC[5]Si)(SiC3)3	Si(SiC[5]Si)(CH3)3	126.0060	0.000	1	126.0060	0.000	1	126.0060	0.000	1	126.5710	75.876	5	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:4:	C[6a]-3:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(C[6a]C[6a]2)(SiC3)2	Si(SiC[6a]Si)(CC3)2(CH3)	Si(SiC[6a]Si)(CC3)2(CH3)	Si(C[6a]C[6a]2)(SiC3)2	Si(SiC[6a]Si)(CC3)2(CH3)	Si(SiC[6a]Si)(CC3)2(CH3)	122.2070	0.000	1	122.2070	0.000	1	122.2070	0.000	1	126.5710	75.876	5	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:4:	Si-3:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiSi2)(SiC3)2	Si(SiSi2)(CCCH)3	Si(SiSi2)(CH3)3	Si(SiSi2)(SiC3)2	Si(SiSi2)(CCCH)3	Si(SiSi2)(CH3)3	114.6500	0.000	1	114.6500	0.000	1	114.6500	0.000	1	126.5710	75.876	5	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:2:	3:4:4:4:	3:4:4:4:	Si-4:Si-4:F-2:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiC3)2(FLi)	Si(SiSiF)(CC3)2(CH3)	Si(SiSiF)(CC3)2(CH3)	Si(SiC3)2(FLi)	Si(SiSiF)(CC3)2(CH3)	Si(SiSiF)(CC3)2(CH3)	104.4670	0.000	1	104.4670	0.000	1	104.4670	0.000	1	113.2057	57.576	3	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:2:	3:4:4:4:	3:4:4:4:	Si-4:Si-4:Ga-2:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiC3)2(GaSi)	Si(SiGaSi)(CC3)2(CH3)	Si(SiGaSi)(CC3)2(CH3)	Si(SiC3)2(GaSi)	Si(SiGaSi)(CC3)2(CH3)	Si(SiGaSi)(CC3)2(CH3)	117.5750	0.778	2	117.5750	0.605	2	117.5750	0.605	2	113.2057	57.576	3	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:4:	3:3:3:3:	3:4:4:4:	Si-4:Si-4:Si-4:	C[6a]-3:C[6a]-3:C[6a]-3:Si-3:	Si-3:C-4:C-4:C-4:	Si(SiC[6a]3)(SiC3)2	Si(C[6a]C[6a]2)3(SiSi2)	Si(SiSi2)(CH3)3	Si(SiC[6a]3)(SiC3)2	Si(C[6a]C[6a]2)3(SiSi2)	Si(SiSi2)(CH3)3	105.2357	0.405	4	105.2357	0.164	4	105.2357	0.164	4	105.2357	0.164	4	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:4:	3:4:4:4:	3:4:4:4:	Si-4:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiC3)3	Si(SiSi2)(CC3)2(CH3)	Si(SiSi2)(CC3)2(CH3)	Si(SiC3)3	Si(SiSi2)(CC3)2(CH3)	Si(SiSi2)(CC3)2(CH3)	119.9987	0.473	3	119.9987	0.224	3	110.2466	68.222	8	110.2466	68.222	8	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:4:	3:4:4:4:	3:4:4:4:	Si-4:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiC3)3	Si(SiSi2)(CH3)3	Si(SiSi2)(CH3)3	Si(SiC3)3	Si(SiSi2)(CH3)3	Si(SiSi2)(CH3)3	105.3453	2.625	3	105.3453	6.892	3	110.2466	68.222	8	110.2466	68.222	8	114.4144	114.119	21	114.4144	114.119	21
979	880	880	0:SP2_SP3_SP3	Si	Si	Si	4:4:4:	3:4:4:4:	3:4:4:4:	Si-4:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:C-4:C-4:C-4:	Si(SiC[6a]3)(SiC3)2	Si(SiSi2)(CH3)3	Si(SiSi2)(CH3)3	Si(SiC[6a]3)(SiC3)2	Si(SiSi2)(CH3)3	Si(SiSi2)(CH3)3	102.9705	0.254	2	102.9705	0.064	2	110.2466	68.222	8	110.2466	68.222	8	114.4144	114.119	21	114.4144	114.119	21
979	880	941	0:SP2_SP2_SP3	Si	Si	N	3:2:4:	3:4:4:4:	3:3:	Si-3:N-2:Si-4:	Si-3:C-4:C-4:C-4:	C[5]-3:Si-3:	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)2(CH3)	N(C[5]N[5]2)(SiSi2)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)2(CH3)	N(C[5]N[5]2)(SiSi2)	104.0945	0.360	2	104.0945	0.130	2	106.2510	14.016	3	106.2510	14.016	3	106.1388	7.359	5	106.1388	7.359	5
979	880	941	0:SP2_SP2_SP3	Si	Si	N	3:2:4:	3:4:4:4:	3:3:	Si-3:N-2:Si-4:	Si-3:C-4:C-4:C-4:	C[5]-3:Si-3:	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)3	N(C[5]N[5]2)(SiSi2)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)3	N(C[5]N[5]2)(SiSi2)	110.5640	0.000	1	110.5640	0.000	1	106.2510	14.016	3	106.2510	14.016	3	106.1388	7.359	5	106.1388	7.359	5
979	880	941	0:SP2_SP2_SP3	Si	Si	N	4:3:2:	3:4:4:4:	3:3:	Si-4:Si-3:N-2:	Si-3:Si-4:Si-4:Si-4:	C[5]-3:Si-3:	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSiN)(SiC3)3	N(C[5]N[5]2)(SiSi2)	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSiN)(SiC3)3	N(C[5]N[5]2)(SiSi2)	105.9705	1.143	2	105.9705	1.307	2	105.9705	1.307	2	105.9705	1.307	2	106.1388	7.359	5	106.1388	7.359	5
979	880	951	0:SP2_SP-NON_SP3	Si	Si	H	3:4:1:	3:4:4:4:	3:	C[5]-3:Si-4:H-1:	Si-3:C-4:C-4:C-4:	Si-3:	Si(C[5]N[5]2)(SiC3)(H)	Si(SiC[5]H)(CC3)3	H(SiC[5]Si)	Si(C[5]N[5]2)(SiC3)(H)	Si(SiC[5]H)(CC3)3	H(SiC[5]Si)	95.1273	0.000	1	95.1273	0.000	1	95.1273	0.000	1	95.1273	0.000	1	107.6663	84.501	5	107.6663	84.501	5
979	880	951	0:SP2_SP-NON_SP3	Si	Si	H	3:4:1:	4:4:3:4:	3:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	Si-3:	Si(SiB[5a]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	Si(SiB[5a]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	112.3890	0.000	1	112.3890	0.000	1	107.9783	22.931	3	107.9783	22.931	3	107.6663	84.501	5	107.6663	84.501	5
979	880	951	0:SP2_SP-NON_SP3	Si	Si	H	3:4:1:	4:4:3:4:	3:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	Si-3:	Si(SiB[6,6]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	Si(SiB[6,6]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	102.8850	0.000	1	102.8850	0.000	1	107.9783	22.931	3	107.9783	22.931	3	107.6663	84.501	5	107.6663	84.501	5
979	880	951	0:SP2_SP-NON_SP3	Si	Si	H	3:4:1:	4:4:3:4:	3:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	Si-3:	Si(SiSiN)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	Si(SiSiN)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	108.6610	0.000	1	108.6610	0.000	1	107.9783	22.931	3	107.9783	22.931	3	107.6663	84.501	5	107.6663	84.501	5
979	880	951	0:SP2_SP-NON_SP3	Si	Si	H	4:2:1:	4:4:3:4:	3:	Si-4:Si-2:H-1:	C-4:C-4:Si-3:C-4:	Si-3:	Si(SiC3)(SiSi)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	Si(SiC3)(SiSi)(H)	Si(CSi2H)2(SiSiH)(CCCH)	H(SiSi2)	119.2690	0.000	1	119.2690	0.000	1	119.2690	0.000	1	119.2690	0.000	1	107.6663	84.501	5	107.6663	84.501	5
979	880	956	0:SP2_SP2_SP3	Si	Si	N	3:4:2:	4:4:3:4:	3:3:3:	N-3:Si-4:Si-2:	C-4:C-4:Si-3:C-4:	C[6a]-3:C[6a]-3:Si-3:	Si(NC[6a]2)(SiC3)(SiSi)	Si(CSi2H)2(SiSiN)(CCCH)	N(C[6a]C[6a]2)2(SiSi2)	Si(NC[6a]2)(SiC3)(SiSi)	Si(CSi2H)2(SiSiN)(CCCH)	N(C[6a]C[6a]2)2(SiSi2)	118.3100	0.000	1	118.3100	0.000	1	118.3100	0.000	1	118.3100	0.000	1	119.2075	1.611	2	119.2075	1.611	2
979	880	956	0:SP2_SP2_SP3	Si	Si	N	3:4:3:	4:4:3:4:	3:4:4:	Si-3:Si-4:N-3:	C-4:C-4:Si-3:C-4:	Si-3:C-4:C-4:	Si(SiSiH)(SiC3)(NCC)	Si(CSi2H)2(SiSiN)(CCCH)	N(SiSi2)(CCHH)2	Si(SiSiH)(SiC3)(NCC)	Si(CSi2H)2(SiSiN)(CCCH)	N(SiSi2)(CCHH)2	120.1050	0.000	1	120.1050	0.000	1	120.1050	0.000	1	120.1050	0.000	1	119.2075	1.611	2	119.2075	1.611	2
979	880	957	0:SP2_SP1_SP3	Si	Si	Si	3:4:2:	4:4:3:4:	3:4:	N-3:Si-4:Si-2:	C-4:C-4:Si-3:C-4:	Si-3:Si-4:	Si(NC[6a]2)(SiC3)(SiSi)	Si(CSi2H)2(SiSiN)(CCCH)	Si(SiSiN)(SiC3)	Si(NC[6a]2)(SiC3)(SiSi)	Si(CSi2H)2(SiSiN)(CCCH)	Si(SiSiN)(SiC3)	122.5950	0.000	1	122.5950	0.000	1	122.5950	0.000	1	122.5950	0.000	1	122.0210	0.659	2	122.0210	0.659	2
979	880	957	0:SP2_SP1_SP3	Si	Si	Si	4:2:1:	4:4:3:4:	3:4:	Si-4:Si-2:H-1:	C-4:C-4:Si-3:C-4:	Si-3:Si-4:	Si(SiC3)(SiSi)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(SiSiH)(SiC3)	Si(SiC3)(SiSi)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(SiSiH)(SiC3)	121.4470	0.000	1	121.4470	0.000	1	121.4470	0.000	1	121.4470	0.000	1	122.0210	0.659	2	122.0210	0.659	2
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:2:4:	3:4:4:4:	3:2:4:	Si-3:N-2:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:N-2:Si-4:	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)2(CH3)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)2(CH3)	Si(SiSiN)(NC[5])(SiC3)	121.5005	0.306	2	121.5005	0.094	2	122.5053	3.076	3	122.5053	3.076	3	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:2:4:	3:4:4:4:	3:2:4:	Si-3:N-2:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:N-2:Si-4:	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)3	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(CC3)3	Si(SiSiN)(NC[5])(SiC3)	124.5150	0.000	1	124.5150	0.000	1	122.5053	3.076	3	122.5053	3.076	3	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:3:4:	3:4:4:4:	3:4:1:	B[5a]-3:Si-3:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:Si-4:H-1:	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	Si(SiB[5a]Si)(CSi2H)2(CCCH)	Si(SiB[5a]Si)(SiC3)(H)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	Si(SiB[5a]Si)(CSi2H)2(CCCH)	Si(SiB[5a]Si)(SiC3)(H)	124.3930	0.000	1	124.3930	0.000	1	124.3930	0.000	1	117.7390	88.551	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:3:4:	3:4:4:4:	3:4:1:	B[6,6]-3:Si-3:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:Si-4:H-1:	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	Si(SiB[6,6]Si)(CSi2H)2(CCCH)	Si(SiB[6,6]Si)(SiC3)(H)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	Si(SiB[6,6]Si)(CSi2H)2(CCCH)	Si(SiB[6,6]Si)(SiC3)(H)	111.0850	0.000	1	111.0850	0.000	1	111.0850	0.000	1	117.7390	88.551	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:1:	4:4:3:4:	3:3:4:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	B[5a]-3:Si-3:Si-4:	Si(SiB[5a]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	Si(SiB[5a]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	131.7070	0.000	1	131.7070	0.000	1	131.7070	0.000	1	138.7850	100.196	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:1:	4:4:3:4:	3:3:4:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	B[6,6]-3:Si-3:Si-4:	Si(SiB[6,6]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	Si(SiB[6,6]Si)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	145.8630	0.000	1	145.8630	0.000	1	145.8630	0.000	1	138.7850	100.196	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:1:	4:4:3:4:	3:4:3:	Si-3:Si-4:H-1:	C-4:C-4:Si-3:C-4:	Si-3:Si-4:N-3:	Si(SiSiN)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(SiSiH)(SiC3)(NCC)	Si(SiSiN)(SiC3)(H)	Si(CSi2H)2(SiSiH)(CCCH)	Si(SiSiH)(SiC3)(NCC)	141.7270	0.000	1	141.7270	0.000	1	141.7270	0.000	1	141.7270	0.000	1	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:2:	4:4:3:4:	3:4:2:	Si-3:Si-4:C-2:	C-4:C-4:Si-3:C-4:	Si-3:Si-4:C-2:	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	Si(SiSiC)(SiC3)(CN)	119.7430	9.738	5	119.7430	94.832	5	119.7430	94.832	5	119.7430	94.832	5	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:3:	4:4:3:4:	3:4:1:	Si-3:Si-4:N-3:	C-4:C-4:Si-3:C-4:	Si-3:Si-4:H-1:	Si(SiSiH)(SiC3)(NCC)	Si(CSi2H)2(SiSiN)(CCCH)	Si(SiSiN)(SiC3)(H)	Si(SiSiH)(SiC3)(NCC)	Si(CSi2H)2(SiSiN)(CCCH)	Si(SiSiN)(SiC3)(H)	116.1430	0.000	1	116.1430	0.000	1	116.1430	0.000	1	116.1430	0.000	1	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:	Si-3:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:Si-4:Si-4:	Si(SiSi2)(SiC3)2	Si(SiSi2)(CCCH)3	Si(SiSi2)(SiC3)2	Si(SiSi2)(SiC3)2	Si(SiSi2)(CCCH)3	Si(SiSi2)(SiC3)2	122.9850	0.000	1	122.9850	0.000	1	121.8860	2.416	2	121.8860	2.416	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	3:4:4:	3:4:4:4:	3:4:4:	Si-3:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	Si-3:Si-4:Si-4:	Si(SiSi2)(SiC3)2	Si(SiSi2)(CH3)3	Si(SiSi2)(SiC3)2	Si(SiSi2)(SiC3)2	Si(SiSi2)(CH3)3	Si(SiSi2)(SiC3)2	120.7870	0.000	1	120.7870	0.000	1	121.8860	2.416	2	121.8860	2.416	2	123.0927	97.081	18	123.0927	97.081	18
979	880	979	0:SP2_SP2_SP3	Si	Si	Si	4:3:2:	3:4:4:4:	4:3:2:	Si-4:Si-3:N-2:	Si-3:Si-4:Si-4:Si-4:	Si-4:Si-3:N-2:	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSiN)(SiC3)3	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSiN)(SiC3)3	Si(SiSi3)(SiSiN)(NC[5])	117.3735	1.705	2	117.3735	2.906	2	117.3735	2.906	2	117.3735	2.906	2	123.0927	97.081	18	123.0927	97.081	18
979	880	983	0:SP2_SP1_SP3	Si	Si	C	3:4:2:	4:4:3:4:	3:1:	Si-3:Si-4:C-2:	C-4:C-4:Si-3:C-4:	Si-3:N-1:	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(N)	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(N)	111.9040	0.000	1	111.9040	0.000	1	111.9040	0.000	1	111.9040	0.000	1	104.8420	17.769	5	104.8420	17.769	5
979	880	983	0:SP2_SP1_SP3	Si	Si	C	3:4:2:	4:4:3:4:	3:2:	Si-3:Si-4:C-2:	C-4:C-4:Si-3:C-4:	Si-3:N-2:	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(NC)	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(NC)	104.4835	0.853	2	104.4835	0.728	2	103.0765	2.912	4	103.0765	2.912	4	104.8420	17.769	5	104.8420	17.769	5
979	880	983	0:SP2_SP1_SP3	Si	Si	C	3:4:2:	4:4:3:4:	3:2:	Si-3:Si-4:C-2:	C-4:C-4:Si-3:C-4:	Si-3:N-2:	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(NSi)	Si(SiSiC)(SiC3)(CN)	Si(CSi2H)2(SiSiC)(CCCH)	C(SiSi2)(NSi)	101.6695	0.298	2	101.6695	0.089	2	103.0765	2.912	4	103.0765	2.912	4	104.8420	17.769	5	104.8420	17.769	5
979	880	989	0:SP2_SP2_SP3	Si	Si	Si[5]	3:3:4:	3:4:4:4:	4:4:3:	C[6a]-3:Si[5]-3:Si-4:	Si-3:C-4:C-4:C-4:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	Si(SiC[6a]Si[5])(CH3)3	Si[5](C[5]C[5]Si2)2(SiC[6a]Si)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiC3)	Si(SiC[6a]Si[5])(CH3)3	Si[5](C[5]C[5]Si2)2(SiC[6a]Si){4|H<1>}	131.4710	0.000	1	131.4710	0.000	1	131.4710	0.000	1	130.0150	4.240	2	130.0150	4.240	2	130.0150	4.240	2
979	880	989	0:SP2_SP2_SP3	Si	Si	Si[5]	3:3:4:	3:4:4:4:	4:4:3:	C[6a]-3:Si[5]-3:Si-4:	Si-3:Si-4:C-4:C-4:	C[5]-4:C[5]-4:Si-3:	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	Si(SiC[6a]Si[5])(SiSiCC)(CH3)2	Si[5](C[5]C[5]Si2)2(SiC[6a]Si)	Si(C[6a]C[6a]2)(Si[5]C[5]2)(SiSiCC)	Si(SiC[6a]Si[5])(SiSiCC)(CH3)2	Si[5](C[5]C[5]Si2)2(SiC[6a]Si){4|H<1>}	128.5590	0.000	1	128.5590	0.000	1	128.5590	0.000	1	130.0150	4.240	2	130.0150	4.240	2	130.0150	4.240	2
979	880	990	0:SP2_SP2_SP3	Si	Si	As	2:4:4:	3:4:4:4:	3:3:	As-2:Si-4:Si-4:	Si-3:C-4:C-4:C-4:	C[6a]-3:Si-3:	Si(AsC[6a])(SiC3)2	Si(SiAsSi)(CC3)2(CH3)	As(C[6a]C[6a]2)(SiSi2)	Si(AsC[6a])(SiC3)2	Si(SiAsSi)(CC3)2(CH3)	As(C[6a]C[6a]2)(SiSi2)	116.3425	16.411	2	116.3425	269.329	2	116.3425	269.329	2	116.3425	269.329	2	116.3425	269.329	2	116.3425	269.329	2
979	893	930	0:SP2_SP2_SP2	Si	O	C	2:4:3:	4:3:	3:4:4:	O-2:C-4:C-3:	C[6]-4:Si-3:	Si-3:C-4:C-4:	Si(OC[6])(CH3)(CCC)	O(C[6]C[6]2H)(SiCC)	C(SiCO)(CH3)2	Si(OC[6])(CH3)(CCC)	O(C[6]C[6]2H)(SiCC)	C(SiCO)(CH3)2	112.7760	0.000	1	112.7760	0.000	1	112.7760	0.000	1	112.7760	0.000	1	115.7995	18.283	2	115.7995	18.283	2
979	893	930	0:SP2_SP2_SP2	Si	O	C	4:3:2:	4:3:	3:4:4:	C-4:C-3:O-2:	C-4:Si-3:	Si-3:C-4:C-4:	Si(CH3)(CCC)(OC)	O(CC[6a]CH)(SiCC)	C(SiCO)(CH3)2	Si(CH3)(CCC)(OC)	O(CC[6a]CH)(SiCC)	C(SiCO)(CH3)2	118.8230	0.000	1	118.8230	0.000	1	118.8230	0.000	1	118.8230	0.000	1	115.7995	18.283	2	115.7995	18.283	2
979	924	979	0:SP2_SP-NON_SP2	Si	Br	Si	3:3:1:	3:	3:3:1:	C[6a]-3:Si-3:Br-1:	Si-3:	C[6a]-3:Si-3:Br-1:	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]Br)(Br)	105.8375	0.783	2	105.8375	0.613	2	105.8375	0.613	2	105.8375	0.613	2	109.0147	30.590	3	109.0147	30.590	3
979	924	979	0:SP2_SP-NON_SP2	Si	Br	Si	3:3:1:	3:	3:3:4:	C[6a]-3:Si-3:Br-1:	Si-3:	C[6a]-3:Si-3:C-4:	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	Si(C[6a]C[6a]2)(SiC[6a]C)(Br)	Br(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]Br)(CCHH)	115.3690	0.000	1	115.3690	0.000	1	115.3690	0.000	1	115.3690	0.000	1	109.0147	30.590	3	109.0147	30.590	3
979	930	940	0:SP2_SP-NON_SP2	Si	C	P	3:3:2:	3:3:4:	3:3:	C[5]-3:C-3:P-2:	Si-3:Si-3:C-4:	Si-3:Si-3:	Si(C[5]N[5]2)(CSiC)(PSi)	C(SiC[6a]2)(SiC[5]P)(CC3)	P(SiC[6a]2)(SiC[5]C)	Si(C[5]N[5]2)(CSiC)(PSi)	C(SiC[6a]2)(SiC[5]P)(CC3)	P(SiC[6a]2)(SiC[5]C)	133.3600	0.000	1	133.3600	0.000	1	133.3600	0.000	1	133.3600	0.000	1	133.3600	0.000	1	133.3600	0.000	1
979	940	951	0:SP2_SP-NON_SP-NON	Si	P	H	3:2:1:	3:3:	3:	N-3:P-2:H-1:	C[6a]-3:Si-3:	Si-3:	Si(NC[6a]Si)(PC[6a])(H)	P(C[6a]C[6a]2)(SiHN)	H(SiNP)	Si(NC[6a]Si)(PC[6a])(H)	P(C[6a]C[6a]2)(SiHN)	H(SiNP)	126.6820	0.000	1	126.6820	0.000	1	126.6820	0.000	1	126.6820	0.000	1	126.6820	0.000	1	126.6820	0.000	1
979	940	956	0:SP2_SP-NON_SP2	Si	P	N	3:2:1:	3:3:	3:4:3:	N-3:P-2:H-1:	C[6a]-3:Si-3:	C[6a]-3:Si-4:Si-3:	Si(NC[6a]Si)(PC[6a])(H)	P(C[6a]C[6a]2)(SiHN)	N(C[6a]C[6a]2)(SiC3)(SiHP)	Si(NC[6a]Si)(PC[6a])(H)	P(C[6a]C[6a]2)(SiHN)	N(C[6a]C[6a]2)(SiC3)(SiHP)	124.0310	0.000	1	124.0310	0.000	1	124.0310	0.000	1	124.0310	0.000	1	124.0310	0.000	1	124.0310	0.000	1
979	941	941	0:SP2_SP2_SP2	Si	N	N	3:2:2:	3:3:	3:3:	C[5]-3:N-2:N-2:	C[6a]-3:Si-3:	C[6a]-3:Si-3:	Si(C[5]N[5]2)(NC[6a])2	N(C[6a]C[6a]2)(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]N)	Si(C[5]N[5]2)(NC[6a])2	N(C[6a]C[6a]2)(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]N)	147.6270	0.000	1	147.6270	0.000	1	147.6270	0.000	1	147.6270	0.000	1	147.6270	0.000	1	147.6270	0.000	1
979	941	979	0:SP2_SP2_SP2	Si	N	Si	3:2:4:	3:3:	3:2:4:	Si-3:N-2:Si-4:	C[5]-3:Si-3:	Si-3:N-2:Si-4:	Si(SiSiN)(NC[5])(SiC3)	N(C[5]N[5]2)(SiSi2)	Si(SiSiN)(NC[5])(SiC3)	Si(SiSiN)(NC[5])(SiC3)	N(C[5]N[5]2)(SiSi2)	Si(SiSiN)(NC[5])(SiC3)	120.0333	2.636	3	120.0333	6.949	3	120.0333	6.949	3	120.0333	6.949	3	119.5770	3.872	5	119.5770	3.872	5
979	941	979	0:SP2_SP2_SP2	Si	N	Si	4:3:2:	3:3:	4:3:2:	Si-4:Si-3:N-2:	C[5]-3:Si-3:	Si-4:Si-3:N-2:	Si(SiSi3)(SiSiN)(NC[5])	N(C[5]N[5]2)(SiSi2)	Si(SiSi3)(SiSiN)(NC[5])	Si(SiSi3)(SiSiN)(NC[5])	N(C[5]N[5]2)(SiSi2)	Si(SiSi3)(SiSiN)(NC[5])	118.8925	0.165	2	118.8925	0.027	2	118.8925	0.027	2	118.8925	0.027	2	119.5770	3.872	5	119.5770	3.872	5
979	944	944	0:SP2_SP-NON_SP-NON	Si	I	I	3:1:1:	3:	3:	C[5]-3:I-1:I-1:	Si-3:	Si-3:	Si(C[5]C[5]N[5])(I)2	I(SiC[5]I)	I(SiC[5]I)	Si(C[5]C[5]N[5])(I)2	I(SiC[5]I)	I(SiC[5]I)	99.9731	1.102	2	99.9731	1.213	2	99.9731	1.213	2	99.9731	1.213	2	99.9731	1.213	2	99.9731	1.213	2
979	944	979	0:SP2_SP-NON_SP2	Si	I	Si	4:3:1:	3:	4:3:1:	C[5]-4:Si-3:I-1:	Si-3:	C[5]-4:Si-3:I-1:	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	I(SiC[5]Si)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	I(SiC[5]Si)	Si(C[5]C[5]N[5]H)(SiC[5]I)(I)	107.4780	0.512	2	107.4780	0.262	2	107.4780	0.262	2	107.4780	0.262	2	107.4780	0.262	2	107.4780	0.262	2
979	945	956	0:SP2_SP2_SP3	Si	P	N	3:3:3:	3:3:3:	3:3:4:	C[5]-3:N-3:P-3:	C[6a]-3:C[6a]-3:Si-3:	C[6a]-3:Si-3:Si-4:	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	P(C[6a]C[6a]2)2(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]P)(SiC3)	Si(C[5]N[5]2)(NC[6a]Si)(PC[6a]2)	P(C[6a]C[6a]2)2(SiC[5]N)	N(C[6a]C[6a]2)(SiC[5]P)(SiC3)	108.4670	0.000	1	108.4670	0.000	1	108.4670	0.000	1	108.4670	0.000	1	108.4670	0.000	1	108.4670	0.000	1
979	951	951	0:SP2_SP-NON_SP-NON	Si	H	H	1:1:1:	3:	3:	Cl-1:H-1:H-1:	Si-3:	Si-3:	Si(Cl)(H)2	H(SiClH)	H(SiClH)	Si(Cl)(H)2	H(SiClH)	H(SiClH)	170.1380	0.000	1	170.1380	0.000	1	170.1380	0.000	1	115.4075	957.120	5	115.4075	957.120	5	115.4075	957.120	5
979	951	951	0:SP2_SP-NON_SP-NON	Si	H	H	1:1:1:	3:	3:	H-1:H-1:H-1:	Si-3:	Si-3:	Si(H)3	H(SiHH)	H(SiHH)	Si(H)3	H(SiHH)	H(SiHH)	101.7249	5.298	4	101.7249	28.064	4	101.7249	28.064	4	115.4075	957.120	5	115.4075	957.120	5	115.4075	957.120	5
979	951	956	0:SP2_SP-NON_SP2	Si	H	N	3:2:1:	3:	3:4:3:	N-3:P-2:H-1:	Si-3:	C[6a]-3:Si-4:Si-3:	Si(NC[6a]Si)(PC[6a])(H)	H(SiNP)	N(C[6a]C[6a]2)(SiC3)(SiHP)	Si(NC[6a]Si)(PC[6a])(H)	H(SiNP)	N(C[6a]C[6a]2)(SiC3)(SiHP)	108.7970	0.000	1	108.7970	0.000	1	108.7970	0.000	1	108.7970	0.000	1	108.7970	0.000	1	108.7970	0.000	1
979	951	957	0:SP2_SP-NON_SP1	Si	H	Si	4:2:1:	3:	3:4:	Si-4:Si-2:H-1:	Si-3:	Si-3:Si-4:	Si(SiC3)(SiSi)(H)	H(SiSi2)	Si(SiSiH)(SiC3)	Si(SiC3)(SiSi)(H)	H(SiSi2)	Si(SiSiH)(SiC3)	119.2840	0.000	1	119.2840	0.000	1	119.2840	0.000	1	119.2840	0.000	1	119.2840	0.000	1	119.2840	0.000	1
979	951	979	0:SP2_SP-NON_SP2	Si	H	Si	3:3:1:	3:	3:3:1:	C[5]-3:Si-3:H-1:	Si-3:	C[5]-3:Si-3:H-1:	Si(C[5]C[5]N[5])(SiC[5]H)(H)	H(SiC[5]Si)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	H(SiC[5]Si)	Si(C[5]C[5]N[5])(SiC[5]H)(H)	110.0170	0.000	1	110.0170	0.000	1	110.0170	0.000	1	114.0815	33.040	2	111.6240	26.137	5	111.6240	26.137	5
979	951	979	0:SP2_SP-NON_SP2	Si	H	Si	3:3:1:	3:	3:3:1:	C[6a]-3:Si-3:H-1:	Si-3:	C[6a]-3:Si-3:H-1:	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	H(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	H(SiC[6a]Si)	Si(C[6a]C[6a]2)(SiC[6a]H)(H)	118.1460	0.000	1	118.1460	0.000	1	118.1460	0.000	1	114.0815	33.040	2	111.6240	26.137	5	111.6240	26.137	5
979	951	979	0:SP2_SP-NON_SP2	Si	H	Si	3:4:1:	3:	3:3:4:	Si-3:Si-4:H-1:	Si-3:	B[5a]-3:Si-3:Si-4:	Si(SiB[5a]Si)(SiC3)(H)	H(SiSi2)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	Si(SiB[5a]Si)(SiC3)(H)	H(SiSi2)	Si(B[5a]O[5a]2)(SiSiH)(SiC3)	114.5360	0.000	1	114.5360	0.000	1	114.5360	0.000	1	112.7170	6.618	2	111.6240	26.137	5	111.6240	26.137	5
979	951	979	0:SP2_SP-NON_SP2	Si	H	Si	3:4:1:	3:	3:3:4:	Si-3:Si-4:H-1:	Si-3:	B[6,6]-3:Si-3:Si-4:	Si(SiB[6,6]Si)(SiC3)(H)	H(SiSi2)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	Si(SiB[6,6]Si)(SiC3)(H)	H(SiSi2)	Si(B[6,6]C[6,6]2)(SiSiH)(SiC3)	110.8980	0.000	1	110.8980	0.000	1	110.8980	0.000	1	112.7170	6.618	2	111.6240	26.137	5	111.6240	26.137	5
979	951	979	0:SP2_SP-NON_SP2	Si	H	Si	3:4:1:	3:	3:4:3:	Si-3:Si-4:H-1:	Si-3:	Si-3:Si-4:N-3:	Si(SiSiN)(SiC3)(H)	H(SiSi2)	Si(SiSiH)(SiC3)(NCC)	Si(SiSiN)(SiC3)(H)	H(SiSi2)	Si(SiSiH)(SiC3)(NCC)	104.5230	0.000	1	104.5230	0.000	1	104.5230	0.000	1	104.5230	0.000	1	111.6240	26.137	5	111.6240	26.137	5
979	951	996	0:SP2_SP-NON_SP3	Si	H	Si[4]	4:4:1:	3:	3:3:3:3:	Si[4]-4:Si[4]-4:H-1:	Si-3:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(H)	H(SiSi[4]2)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H)	Si(Si[4]C[6a]N[4]2)2(H)	H(SiSi[4]2)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H){1|H<1>,1|O<2>,3|C<3>}	96.8692	7.233	2	96.8692	52.322	2	96.8692	52.322	2	96.8692	52.322	2	96.8692	52.322	2	96.8692	52.322	2
979	956	957	0:SP2_SP1_SP2	Si	N	Si	3:4:2:	3:3:3:	3:4:	N-3:Si-4:Si-2:	C[6a]-3:C[6a]-3:Si-3:	Si-3:Si-4:	Si(NC[6a]2)(SiC3)(SiSi)	N(C[6a]C[6a]2)2(SiSi2)	Si(SiSiN)(SiC3)	Si(NC[6a]2)(SiC3)(SiSi)	N(C[6a]C[6a]2)2(SiSi2)	Si(SiSiN)(SiC3)	116.9220	0.000	1	116.9220	0.000	1	116.9220	0.000	1	116.9220	0.000	1	116.9220	0.000	1	116.9220	0.000	1
979	956	979	0:SP2_SP2_SP2	Si	N	Si	3:4:3:	3:4:4:	3:4:1:	Si-3:Si-4:N-3:	Si-3:C-4:C-4:	Si-3:Si-4:H-1:	Si(SiSiH)(SiC3)(NCC)	N(SiSi2)(CCHH)2	Si(SiSiN)(SiC3)(H)	Si(SiSiH)(SiC3)(NCC)	N(SiSi2)(CCHH)2	Si(SiSiN)(SiC3)(H)	122.4110	0.000	1	122.4110	0.000	1	122.4110	0.000	1	122.4110	0.000	1	121.7517	0.336	3	121.7517	0.336	3
979	956	979	0:SP2_SP2_SP2	Si	N	Si	4:3:3:	3:4:4:	4:3:3:	C[5]-4:Si-3:N-3:	Si-3:Si-4:Si-4:	C[5]-4:Si-3:N-3:	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	N(SiC[5]Si)(SiC3)2	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	N(SiC[5]Si)(SiC3)2	Si(C[5]C[5]2C)(SiC[5]N)(NSi2)	121.4220	0.144	2	121.4220	0.021	2	121.4220	0.021	2	121.4220	0.021	2	121.7517	0.336	3	121.7517	0.336	3
979	979	983	0:SP2_SP1_SP2	Si	Si	C	3:3:2:	3:3:2:	3:2:	C[6a]-3:Si-3:C-2:	C[6a]-3:Si-3:C-2:	Si-3:C-2:	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C(SiC[6a]Si)(CSi)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	Si(C[6a]C[6a]2)(SiC[6a]C)(CC)	C(SiC[6a]Si)(CSi)	116.0610	0.000	1	116.0610	0.000	1	116.0610	0.000	1	116.0610	0.000	1	106.5537	24.858	6	106.5537	24.858	6
979	979	983	0:SP2_SP1_SP2	Si	Si	C	3:4:2:	3:4:2:	3:1:	Si-3:Si-4:C-2:	Si-3:Si-4:C-2:	Si-3:N-1:	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(N)	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(N)	107.9830	0.000	1	107.9830	0.000	1	107.9830	0.000	1	107.9830	0.000	1	106.5537	24.858	6	106.5537	24.858	6
979	979	983	0:SP2_SP1_SP2	Si	Si	C	3:4:2:	3:4:2:	3:2:	Si-3:Si-4:C-2:	Si-3:Si-4:C-2:	Si-3:N-2:	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(NC)	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(NC)	103.5405	1.159	2	103.5405	1.343	2	103.8195	0.652	4	103.8195	0.652	4	106.5537	24.858	6	106.5537	24.858	6
979	979	983	0:SP2_SP1_SP2	Si	Si	C	3:4:2:	3:4:2:	3:2:	Si-3:Si-4:C-2:	Si-3:Si-4:C-2:	Si-3:N-2:	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(NSi)	Si(SiSiC)(SiC3)(CN)	Si(SiSiC)(SiC3)(CN)	C(SiSi2)(NSi)	104.0985	0.548	2	104.0985	0.300	2	103.8195	0.652	4	103.8195	0.652	4	106.5537	24.858	6	106.5537	24.858	6
979	996	996	0:SP2_SP3_SP3	Si	Si[4]	Si[4]	4:4:1:	3:3:3:3:	3:3:3:3:	Si[4]-4:Si[4]-4:Cl-1:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(Cl)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl)	Si(Si[4]C[6a]N[4]2)2(Cl)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl){1|H<1>,1|O<2>,3|C<3>}	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]Cl){1|H<1>,1|O<2>,3|C<3>}	114.2190	0.000	1	114.2190	0.000	1	114.2190	0.000	1	113.0445	2.759	2	112.9443	1.410	3	112.9443	1.410	3
979	996	996	0:SP2_SP3_SP3	Si	Si[4]	Si[4]	4:4:1:	3:3:3:3:	3:3:3:3:	Si[4]-4:Si[4]-4:H-1:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(H)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H)	Si(Si[4]C[6a]N[4]2)2(H)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H){1|H<1>,1|O<2>,3|C<3>}	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]H){1|H<1>,1|O<2>,3|C<3>}	111.8700	0.000	1	111.8700	0.000	1	111.8700	0.000	1	113.0445	2.759	2	112.9443	1.410	3	112.9443	1.410	3
979	996	996	0:SP2_SP3_SP3	Si	Si[4]	Si[4]	4:4:4:	3:3:3:3:	3:3:3:3:	Si[4]-4:Si[4]-4:C-4:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	C[6a]-3:N[4]-3:N[4]-3:Si-3:	Si(Si[4]C[6a]N[4]2)2(CCHH)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C)	Si(Si[4]C[6a]N[4]2)2(CCHH)	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C){1|H<1>,1|O<2>,3|C<3>}	Si[4](C[6a]C[6,6a]C[6a])(N[4]C[4]C)2(SiSi[4]C){1|H<1>,1|O<2>,3|C<3>}	112.7440	0.000	1	112.7440	0.000	1	112.7440	0.000	1	112.7440	0.000	1	112.9443	1.410	3	112.9443	1.410	3
980	113	113	4:SP3_SP3_SP3	N[4,5]	B[4,5a]	B[4,5a]	4:4:4:4:	4:4:2:2:	4:4:2:2:	B[4,5a]-4:B[4,5a]-4:C[5]-4:C[5]-4:	N[4,5]-4:N[4,5]-4:O[5a]-2:O[5a]-2:	N[4,5]-4:N[4,5]-4:O[5a]-2:O[5a]-2:	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2{2|C<4>,4|C<3>,4|H<1>}	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2{2|C<3>,2|O<2>,4|C<4>,8|H<1>}	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2{2|C<3>,2|O<2>,4|C<4>,8|H<1>}	88.8068	0.082	2	88.8068	0.007	2	88.8068	0.007	2	88.8068	0.007	2	88.8068	0.007	2	88.8068	0.007	2
980	113	474	0:SP3_SP3_SP3	N[4,5]	B[4,5a]	C[5]	4:4:4:4:	4:4:2:2:	4:4:1:1:	B[4,5a]-4:B[4,5a]-4:C[5]-4:C[5]-4:	N[4,5]-4:N[4,5]-4:O[5a]-2:O[5a]-2:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2{2|C<4>,4|C<3>,4|H<1>}	B[4,5a](N[4,5]B[4,5a]C[5]2)2(O[5a]C[5a,6a])2{2|C<3>,2|O<2>,4|C<4>,8|H<1>}	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2{1|N<4>,4|H<1>,4|O<2>}	116.2435	1.340	8	116.2435	1.796	8	116.2435	1.796	8	116.2435	1.796	8	116.2435	1.796	8	116.2435	1.796	8
980	113	718	4:SP3_SP3_SPD5	N[4,5,5]	B[4,5a]	P[4,5,5]	5:4:3:3:	4:3:2:2:	4:3:2:2:2:	P[4,5,5]-5:B[4,5a]-4:C[5]-3:C[5]-3:	N[4,5,5]-4:N[4]-3:O[5a]-2:O[5a]-2:	N[4,5,5]-4:N[4]-3:O[5]-2:O[5]-2:O-2:	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2	B[4,5a](N[4,5,5]P[4,5,5]C[5]2)(N[4]P[4,5,5]C[6a])(O[5a]C[5a,6a])2	P[4,5,5](N[4,5,5]B[4,5a]C[5]2)(N[4]B[4,5a]C[6a])(O[5]C[5])2(OC)	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2{2|C<4>,3|C<3>}	B[4,5a](N[4,5,5]P[4,5,5]C[5]2)(N[4]P[4,5,5]C[6a])(O[5a]C[5a,6a])2{2|H<1>,3|O<2>,6|C<3>}	P[4,5,5](N[4,5,5]B[4,5a]C[5]2)(N[4]B[4,5a]C[6a])(O[5]C[5])2(OC){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	87.3012	0.000	1	87.3012	0.000	1	87.3012	0.000	1	87.3012	0.000	1	87.3012	0.000	1	87.3012	0.000	1
980	113	818	0:SP3_SP2_SP3	N[4,5,5]	B[4,5a]	C[5]	5:4:3:3:	4:3:2:2:	4:3:1:	P[4,5,5]-5:B[4,5a]-4:C[5]-3:C[5]-3:	N[4,5,5]-4:N[4]-3:O[5a]-2:O[5a]-2:	N[4,5,5]-4:C[5]-3:H-1:	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2	B[4,5a](N[4,5,5]P[4,5,5]C[5]2)(N[4]P[4,5,5]C[6a])(O[5a]C[5a,6a])2	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H)	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2{2|C<4>,3|C<3>}	B[4,5a](N[4,5,5]P[4,5,5]C[5]2)(N[4]P[4,5,5]C[6a])(O[5a]C[5a,6a])2{2|H<1>,3|O<2>,6|C<3>}	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H){1|C<3>,1|H<1>,1|N<3>,4|O<2>}	118.0340	0.984	2	118.0340	0.969	2	118.0340	0.969	2	118.0340	0.969	2	118.0340	0.969	2	118.0340	0.969	2
980	198	490	0:SP3_SP3_SPD5	N[4]	Ga[3,3,4]	C	5:4:4:1:	4:4:4:3:1:	4:4:4:4:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	B[3,3]-4:N[3,4]-4:N[4]-4:N[3]-3:Cl-1:	N[4]-4:C-4:C-4:C-4:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl)	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl){2|Cl<1>,2|C<3>}	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	123.9350	0.000	1	123.9350	0.000	1	123.9350	0.000	1	123.9350	0.000	1	123.9350	0.000	1	123.9350	0.000	1
980	198	878	4:SP3_SP-NON_SPD5	N[4]	Ga[3,3,4]	Ga[4]	5:4:4:1:	4:4:4:3:1:	4:4:1:1:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	B[3,3]-4:N[3,4]-4:N[4]-4:N[3]-3:Cl-1:	N[3,4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl)	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl){2|Cl<1>,2|C<3>}	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2{1|Cl<1>,1|C<3>,1|N<3>}	90.0329	0.000	1	90.0329	0.000	1	90.0329	0.000	1	90.0329	0.000	1	90.0329	0.000	1	90.0329	0.000	1
980	198	951	0:SP3_SP-NON_SPD5	N[4]	Ga[3,3,4]	H	5:4:4:1:	4:4:4:3:1:	4:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	B[3,3]-4:N[3,4]-4:N[4]-4:N[3]-3:Cl-1:	N[4]-4:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl)	H(N[4]Ga[3,3,4]Ga[4]C)	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	Ga[3,3,4](B[3,3]N[3,4]C[6a]N[3])(N[3,4]B[3,3]Ga[4]C)(N[4]Ga[4]CH)(N[3]B[3,3]C)(Cl){2|Cl<1>,2|C<3>}	H(N[4]Ga[3,3,4]Ga[4]C)	105.3460	0.000	1	105.3460	0.000	1	105.3460	0.000	1	105.3460	0.000	1	105.3460	0.000	1	105.3460	0.000	1
980	466	466	6:SP3_SP3_SP3	N[4,4,6]	C[6]	C[6]	4:3:4:4:	4:4:1:1:	4:4:1:1:	C[3x4]-4:C[3x4]-3:C[6]-4:C[6]-4:	N[4,4,6]-4:C[6]-4:H-1:H-1:	N[4,4,6]-4:C[6]-4:H-1:H-1:	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2{1|C<4>,1|H<2>,1|O<2>,2|O<3>,4|H<1>}	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2{1|C<4>,1|C<6>,1|H<2>,3|H<1>}	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2{1|C<4>,1|C<6>,1|H<2>,3|H<1>}	109.2670	0.000	1	109.2670	0.000	1	109.2670	0.000	1	109.2670	0.000	1	109.2670	0.000	1	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	3:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,5]-3:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2{1|B<4>,1|C<3>,1|C<4>,2|N<3>,4|H<1>}	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2{1|C<3>,2|C<4>,2|F<1>,4|H<1>}	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2{1|C<3>,2|C<4>,2|F<1>,4|H<1>}	110.3520	0.000	1	110.3520	0.000	1	110.3520	0.000	1	110.3520	0.000	1	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:3:	4:4:1:1:	4:4:1:1:	B[4]-4:C[6]-4:C[6]-4:C[4]-3:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B)	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{1|Cl<1>,1|B<3>,1|C<4>,2|C<3>,4|H<1>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{1|Cl<1>,1|B<3>,1|C<4>,2|C<3>,4|H<1>}	110.8985	0.013	2	110.8985	0.000	2	110.8985	0.000	2	110.8985	0.000	2	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:C[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2{3|C<4>,4|H<1>,6|C<3>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{2|C<4>,3|C<3>,5|H<1>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{2|C<4>,3|C<3>,5|H<1>}	106.6860	0.000	1	106.6860	0.000	1	106.6860	0.000	1	106.6820	3.869	5	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{4|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,4|C<4>,4|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,4|C<4>,4|H<1>}	105.7710	0.000	1	105.7710	0.000	1	105.1000	0.900	2	106.6820	3.869	5	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{1|O<2>,3|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2{2|C<3>,2|H<1>,4|C<4>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2{2|C<3>,2|H<1>,4|C<4>}	104.4290	0.000	1	104.4290	0.000	1	105.1000	0.900	2	106.6820	3.869	5	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{3|C<4>,4|C<3>,7|H<1>}	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,3|C<4>,5|H<1>}	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,3|C<4>,5|H<1>}	106.7490	0.000	1	106.7490	0.000	1	106.7490	0.000	1	106.6820	3.869	5	108.1949	6.599	8	108.3140	5.902	9
980	466	466	6:SP3_SP3_SP3	N[4,6]	C[6]	C[6]	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2{3|C<4>,4|H<1>}	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2{1|C<4>,1|N<4>,8|H<1>}	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2{1|C<4>,1|N<4>,8|H<1>}	109.7750	0.000	1	109.7750	0.000	1	109.7750	0.000	1	106.6820	3.869	5	108.1949	6.599	8	108.3140	5.902	9
980	466	478	0:SP3_SP3_SP3	N[4,4,6]	C[6]	C[3x4]	4:3:4:4:	4:4:1:1:	6:4:2:1:	C[3x4]-4:C[3x4]-3:C[6]-4:C[6]-4:	N[4,4,6]-4:C[6]-4:H-1:H-1:	C[3,3,4,4]-6:N[4,4,6]-4:H[4,4]-2:H-1:	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])(H)	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2{1|C<4>,1|H<2>,1|O<2>,2|O<3>,4|H<1>}	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2{1|C<4>,1|C<6>,1|H<2>,3|H<1>}	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])(H){2|C<4>,5|H<1>}	111.4335	5.673	2	111.4335	32.184	2	111.4335	32.184	2	111.4335	32.184	2	111.4335	32.184	2	112.0111	11.525	10
980	466	478	0:SP3_SP3_SP3	N[4,6]	C[6]	C[4,6,6]	4:4:4:4:	4:4:1:1:	4:4:4:4:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6,6]-4:C[6]-4:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{4|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,4|C<4>,4|H<1>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	112.3780	3.977	2	112.3780	15.815	2	112.6283	9.631	4	112.6283	9.631	4	112.6283	9.631	4	112.0111	11.525	10
980	466	478	0:SP3_SP3_SP3	N[4,6]	C[6]	C[4,6,6]	4:4:4:4:	4:4:1:1:	4:4:4:4:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6,6]-4:C[6]-4:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{1|O<2>,3|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2{2|C<3>,2|H<1>,4|C<4>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	112.8785	3.581	2	112.8785	12.827	2	112.6283	9.631	4	112.6283	9.631	4	112.6283	9.631	4	112.0111	11.525	10
980	466	478	0:SP3_SP3_SP3	N[4,6]	C[6]	C[4,6]	4:4:4:4:	4:4:1:1:	4:4:4:1:	C[4,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6]-4:H-1:	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2	C[4,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6]C[6]HH)(H)	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{3|C<4>,4|C<3>,7|H<1>}	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,3|C<4>,5|H<1>}	C[4,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6]C[6]HH)(H){2|C<3>,3|C<4>,8|H<1>}	110.8965	0.578	2	110.8965	0.334	2	110.8965	0.334	2	110.8965	0.334	2	110.8965	0.334	2	112.0111	11.525	10
980	466	478	0:SP3_SP3_SP3	N[4,6]	C[6]	C[4]	4:4:4:4:	4:4:1:1:	4:3:4:1:	B[4]-4:C[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6a]-3:C[4]-4:H-1:	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	C[4](N[4,6]B[4]C[6]2)(C[6a]C[6a]2)(C[4]B[4]CC)(H)	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2{3|C<4>,4|H<1>,6|C<3>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{2|C<4>,3|C<3>,5|H<1>}	C[4](N[4,6]B[4]C[6]2)(C[6a]C[6a]2)(C[4]B[4]CC)(H){2|C<4>,4|C<3>,6|H<1>}	112.4690	6.101	2	112.4690	37.221	2	112.4690	37.221	2	112.4690	37.221	2	112.4690	37.221	2	112.0111	11.525	10
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	3:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,5]-3:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,5]-4:N[4,6]-4:F-1:F-1:	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2	B[4](C[4,5]C[4,5]C[5]N[6])(N[4,6]C[4,5]C[6]2)(F)2	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2{1|B<4>,1|C<3>,1|C<4>,2|N<3>,4|H<1>}	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2{1|C<3>,2|C<4>,2|F<1>,4|H<1>}	B[4](C[4,5]C[4,5]C[5]N[6])(N[4,6]C[4,5]C[6]2)(F)2{1|B<4>,1|C<3>,1|N<3>,4|C<4>,4|H<1>}	114.4840	0.334	2	114.4840	0.111	2	114.4840	0.111	2	114.4840	0.111	2	118.0127	69.527	14	118.0127	69.527	14
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	4:4:4:3:	4:4:1:1:	4:3:3:1:	B[4]-4:C[6]-4:C[6]-4:C[4]-3:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[4]-3:C[6a]-3:Cl-1:	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B)	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	B[4](N[4,6]C[4]C[6]2)(C[4]C[4]N[6])(C[6a]C[6a]2)(Cl)	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{1|Cl<1>,1|B<3>,1|C<4>,2|C<3>,4|H<1>}	B[4](N[4,6]C[4]C[6]2)(C[4]C[4]N[6])(C[6a]C[6a]2)(Cl){1|B<3>,2|C<3>,4|H<1>,6|C<4>}	116.8495	2.785	4	116.8495	7.754	4	116.8495	7.754	4	116.8495	7.754	4	118.0127	69.527	14	118.0127	69.527	14
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	4:4:4:4:	4:4:1:1:	4:3:3:4:	B[4]-4:C[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[6a]-3:C[6a]-3:C[4]-4:	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	B[4](N[4,6]C[4]C[6]2)(C[6a]C[6a]2)2(C[4]C[4]CC)	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2{3|C<4>,4|H<1>,6|C<3>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{2|C<4>,3|C<3>,5|H<1>}	B[4](N[4,6]C[4]C[6]2)(C[6a]C[6a]2)2(C[4]C[4]CC){2|C<4>,4|F<1>,5|C<3>,5|H<1>}	117.6210	13.728	2	117.6210	188.452	2	117.6210	188.452	2	117.6210	188.452	2	118.0127	69.527	14	118.0127	69.527	14
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	4:4:4:4:	4:4:1:1:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{4|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,4|C<4>,4|H<1>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	119.1800	13.079	2	119.1800	171.051	2	119.4210	118.611	4	120.0950	127.079	6	118.0127	69.527	14	118.0127	69.527	14
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	4:4:4:4:	4:4:1:1:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{1|O<2>,3|C<4>,5|C<3>,8|H<1>}	C[6](N[4,6]C[4,6,6]B[4]C[6])(C[6]O[6]HH)(H)2{2|C<3>,2|H<1>,4|C<4>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	119.6620	13.585	2	119.6620	184.550	2	119.4210	118.611	4	120.0950	127.079	6	118.0127	69.527	14	118.0127	69.527	14
980	466	742	0:SP3_SP3_SP3	N[4,6]	C[6]	B[4]	4:4:4:4:	4:4:1:1:	4:4:3:3:	C[4,6]-4:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2	B[4](C[4,6]C[4,6]C[6]H)(N[4,6]C[4,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{3|C<4>,4|C<3>,7|H<1>}	C[6](N[4,6]C[4,6]B[4]C[6])(C[6]C[6]HH)(H)2{2|C<3>,3|C<4>,5|H<1>}	B[4](C[4,6]C[4,6]C[6]H)(N[4,6]C[4,6]C[6]2)(C[6a]C[6a]2)2{4|C<3>,4|C<4>,4|F<1>,7|H<1>}	121.4430	16.556	2	121.4430	274.108	2	121.4430	274.108	2	120.0950	127.079	6	118.0127	69.527	14	118.0127	69.527	14
980	466	742	6:SP3_SP3_SP3	N[4,6,6]	C[6,6]	B[4,6,6]	4:4:4:1:	4:4:1:1:	4:4:4:1:	B[4,6,6]-4:B[4,6,6]-4:C[6,6]-4:H-1:	B[4,6,6]-4:N[4,6,6]-4:H-1:H-1:	N[4,6,6]-4:N[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H)	C[6,6](B[4,6,6]N[4,6,6]2H)(N[4,6,6]B[4,6,6]2H)(H)2	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H)	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H){1|C<4>,2|N<4>,6|H<1>}	C[6,6](B[4,6,6]N[4,6,6]2H)(N[4,6,6]B[4,6,6]2H)(H)2{1|B<4>,1|N<4>,2|C<4>,4|H<1>}	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H){1|C<4>,2|B<4>,6|H<1>}	115.6949	0.266	14	115.6949	0.071	14	115.6949	0.071	14	115.6949	0.071	14	115.6949	0.071	14	115.6949	0.071	14
980	466	818	0:SP3_SP2_SP3	N[4,5]	C[6]	C[5]	4:4:4:3:	4:4:4:1:	4:3:1:	Ga[4,5]-4:Ga[4,5]-4:C[6]-4:C[5]-3:	N[4,5]-4:C[6]-4:C[6]-4:H-1:	N[4,5]-4:C[5]-3:H-1:	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H)	C[6](N[4,5]Ga[4,5]2C[5])(C[6]C[6]HH)2(H)	C[5](N[4,5]Ga[4,5]2C[6])(C[5]N[5]H)(H)	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H){2|C<3>,5|C<4>,5|H<1>}	C[6](N[4,5]Ga[4,5]2C[5])(C[6]C[6]HH)2(H){2|Cl<1>,1|C<3>,1|C<4>,1|N<4>,2|N<3>,5|H<1>}	C[5](N[4,5]Ga[4,5]2C[6])(C[5]N[5]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|N<4>,3|C<4>}	110.1540	0.000	1	110.1540	0.000	1	110.1540	0.000	1	110.1540	0.000	1	110.1540	0.000	1	110.1540	0.000	1
980	466	846	0:SP3_SP2_SP3	N[4,4,6]	C[6]	C[3x4]	4:3:4:4:	4:4:1:1:	6:4:2:	C[3x4]-4:C[3x4]-3:C[6]-4:C[6]-4:	N[4,4,6]-4:C[6]-4:H-1:H-1:	C[3,3,4,4]-6:N[4,4,6]-4:H[4,4]-2:	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2{1|C<4>,1|H<2>,1|O<2>,2|O<3>,4|H<1>}	C[6](N[4,4,6]C[3x4]2C[6])(C[6]O[6]HH)(H)2{1|C<4>,1|C<6>,1|H<2>,3|H<1>}	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4]){2|C<4>,6|H<1>}	106.1835	30.068	2	106.1835	904.103	2	106.1835	904.103	2	106.1835	904.103	2	106.1835	904.103	2	111.1686	144.504	8
980	466	846	0:SP3_SP2_SP3	N[4,6]	C[6]	C[4,5]	3:4:4:4:	4:4:1:1:	4:4:3:	C[4,5]-3:B[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	C[4,5]-4:N[4,6]-4:C[5]-3:	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2	C[4,5](C[4,5]B[4]C[5]N[6])(N[4,6]B[4]C[6]2)(C[5]B[5]N[6])	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2{1|B<4>,1|C<3>,1|C<4>,2|N<3>,4|H<1>}	C[6](N[4,6]C[4,5]B[4]C[6])(C[6]C[6]HH)(H)2{1|C<3>,2|C<4>,2|F<1>,4|H<1>}	C[4,5](C[4,5]B[4]C[5]N[6])(N[4,6]B[4]C[6]2)(C[5]B[5]N[6]){1|N<3>,2|C<3>,2|F<1>,4|H<1>,6|C<4>}	115.7125	1.999	2	115.7125	3.996	2	115.7125	3.996	2	115.7125	3.996	2	115.7125	3.996	2	111.1686	144.504	8
980	466	846	0:SP3_SP2_SP3	N[4,6]	C[6]	C[4]	4:4:4:3:	4:4:1:1:	4:3:3:	B[4]-4:C[6]-4:C[6]-4:C[4]-3:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:C[4]-3:B-3:	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B)	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2	C[4](N[4,6]B[4]C[6]2)(C[4]B[4]N[6])(BC[6a]Cl)	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](N[4,6]B[4]C[4]C[6])(C[6]C[6]HH)(H)2{1|Cl<1>,1|B<3>,1|C<4>,2|C<3>,4|H<1>}	C[4](N[4,6]B[4]C[6]2)(C[4]B[4]N[6])(BC[6a]Cl){1|Cl<1>,1|C<3>,4|C<4>,4|H<1>}	111.3893	2.020	4	111.3893	4.079	4	111.3893	4.079	4	111.3893	4.079	4	111.3893	4.079	4	111.1686	144.504	8
980	466	856	0:SP3_SP3_SP3	N[4]	C[6,6]	N[6]	4:4:4:3:	4:4:4:1:	4:4:4:	C[6,6]-4:Ga[4]-4:Ga[4]-4:N[6]-3:	C[3x6]-4:C[3x6]-4:N[4]-4:H-1:	N[4]-4:C[6]-4:C[6]-4:	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2)	C[6,6](C[3x6]C[6,6]2H)2(N[4]Ga[4]2N[6])(H)	N[6](N[4]C[6,6]Ga[4]2)(C[6]C[6]HH)2	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2){1|N<3>,6|H<1>,7|C<4>}	C[6,6](C[3x6]C[6,6]2H)2(N[4]Ga[4]2N[6])(H){1|N<4>,8|C<4>,8|H<1>}	N[6](N[4]C[6,6]Ga[4]2)(C[6]C[6]HH)2{1|N<4>,5|H<1>,7|C<4>}	107.6997	0.266	4	107.6997	0.071	4	107.6997	0.071	4	107.6997	0.071	4	107.6997	0.071	4	107.6997	0.071	4
980	466	878	0:SP3_SP-NON_SP3	N[4,5]	C[6]	Ga[4,5]	4:4:4:3:	4:4:4:1:	4:4:3:1:	Ga[4,5]-4:Ga[4,5]-4:C[6]-4:C[5]-3:	N[4,5]-4:C[6]-4:C[6]-4:H-1:	N[4,5]-4:N[4,5]-4:N[5]-3:Cl-1:	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H)	C[6](N[4,5]Ga[4,5]2C[5])(C[6]C[6]HH)2(H)	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl)	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H){2|C<3>,5|C<4>,5|H<1>}	C[6](N[4,5]Ga[4,5]2C[5])(C[6]C[6]HH)2(H){2|Cl<1>,1|C<3>,1|C<4>,1|N<4>,2|N<3>,5|H<1>}	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl){1|Cl<1>,1|C<3>,1|N<3>,6|C<4>,6|H<1>}	121.5590	0.393	2	121.5590	0.155	2	121.5590	0.155	2	121.5590	0.155	2	121.5590	0.155	2	112.5006	24.775	14
980	466	878	0:SP3_SP-NON_SP3	N[4,6]	C[6]	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6]-4:H-1:H-1:	N[4,6]-4:N[4,6]-4:H-1:H-1:	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2{3|C<4>,4|H<1>}	C[6](N[4,6]Ga[4]2C[6])(C[6]C[6]HH)(H)2{1|C<4>,1|N<4>,8|H<1>}	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2{10|H<1>,4|C<4>}	113.7160	0.951	4	113.7160	0.905	4	113.7160	0.905	4	113.7160	0.905	4	113.7160	0.905	4	112.5006	24.775	14
980	466	878	0:SP3_SP-NON_SP3	N[4]	C[6,6]	Ga[4]	4:4:4:3:	4:4:4:1:	4:4:4:4:	C[6,6]-4:Ga[4]-4:Ga[4]-4:N[6]-3:	C[3x6]-4:C[3x6]-4:N[4]-4:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2)	C[6,6](C[3x6]C[6,6]2H)2(N[4]Ga[4]2N[6])(H)	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2){1|N<3>,6|H<1>,7|C<4>}	C[6,6](C[3x6]C[6,6]2H)2(N[4]Ga[4]2N[6])(H){1|N<4>,8|C<4>,8|H<1>}	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2{10|C<4>,2|H<1>}	109.6283	3.447	8	109.6283	11.883	8	109.6283	11.883	8	109.6283	11.883	8	109.6283	11.883	8	112.5006	24.775	14
980	466	951	0:SP3_SP-NON_SP3	N[4,6,6]	C[6,6]	H	4:4:4:1:	4:4:1:1:	4:	B[4,6,6]-4:B[4,6,6]-4:C[6,6]-4:H-1:	B[4,6,6]-4:N[4,6,6]-4:H-1:H-1:	N[4,6,6]-4:	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H)	C[6,6](B[4,6,6]N[4,6,6]2H)(N[4,6,6]B[4,6,6]2H)(H)2	H(N[4,6,6]B[4,6,6]2C[6,6])	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H){1|C<4>,2|N<4>,6|H<1>}	C[6,6](B[4,6,6]N[4,6,6]2H)(N[4,6,6]B[4,6,6]2H)(H)2{1|B<4>,1|N<4>,2|C<4>,4|H<1>}	H(N[4,6,6]B[4,6,6]2C[6,6])	110.5466	0.745	8	110.5466	0.555	8	110.5466	0.555	8	110.5466	0.555	8	110.5466	0.555	8	110.5466	0.555	8
980	474	474	0:SP3_SP3_SP3	N[4,5,5]	C[5]	C[5]	5:5:4:4:	4:4:1:1:	4:4:1:1:	Ge[4,5,5]-5:Ge[4,5,5]-5:C[5]-4:C[5]-4:	N[4,5,5]-4:C[5]-4:H-1:H-1:	N[4,5,5]-4:C[5]-4:H-1:H-1:	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2{4|Si<4>,4|C<4>,4|H<1>}	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2{1|Si<4>,2|Cl<1>,1|C<4>,1|N<4>,2|H<1>,3|N<3>}	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2{1|Si<4>,2|Cl<1>,1|C<4>,1|N<4>,2|H<1>,3|N<3>}	112.4500	0.000	1	112.4500	0.000	1	112.4500	0.000	1	112.4500	0.000	1	112.4500	0.000	1	112.4500	0.000	1
980	474	474	5:SP3_SP3_SP3	N[4,5]	C[5]	C[5]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4,5a]-4:B[4,5a]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2	N[4,5](B[4,5a]N[4,5]O[5a]2)2(C[5]C[5]HH)2{2|C<4>,4|C<3>,4|H<1>}	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2{1|N<4>,4|H<1>,4|O<2>}	C[5](N[4,5]B[4,5a]2C[5])(C[5]C[5]HH)(H)2{1|N<4>,4|H<1>,4|O<2>}	103.4735	0.053	2	103.4735	0.003	2	103.4735	0.003	2	102.0300	3.008	6	102.0300	3.008	6	102.0300	3.008	6
980	474	474	5:SP3_SP3_SP3	N[4,5]	C[5]	C[5]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2{2|C<4>,4|H<1>}	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2{4|Br<1>,1|N<4>,4|H<1>}	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2{4|Br<1>,1|N<4>,4|H<1>}	100.4735	0.217	2	100.4735	0.047	2	100.4735	0.047	2	102.0300	3.008	6	102.0300	3.008	6	102.0300	3.008	6
980	474	474	5:SP3_SP3_SP3	N[4,5]	C[5]	C[5]	4:4:4:4:	4:4:1:1:	4:4:1:1:	C[4,6,6]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2{3|C<4>,5|C<3>,8|H<1>}	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2{2|C<3>,3|C<4>,4|H<1>}	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2{2|C<3>,3|C<4>,4|H<1>}	100.4180	0.000	1	100.4180	0.000	1	100.4180	0.000	1	102.0300	3.008	6	102.0300	3.008	6	102.0300	3.008	6
980	474	474	5:SP3_SP3_SP3	N[4,5]	C[5]	C[5]	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Si[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2{1|C<3>,4|H<1>}	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2{1|C<2>,1|C<4>,2|C<3>,5|H<1>}	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2{1|C<2>,1|C<4>,2|C<3>,5|H<1>}	103.8680	0.000	1	103.8680	0.000	1	103.8680	0.000	1	102.0300	3.008	6	102.0300	3.008	6	102.0300	3.008	6
980	474	478	0:SP3_SP3_SP3	N[4,5]	C[5]	C[4,6,6]	4:4:4:4:	4:4:1:1:	4:4:4:4:	C[4,6,6]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	C[4,6]-4:N[4,5]-4:C[6,6]-4:C[6]-4:	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,5]B[4]C[5]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2{3|C<4>,5|C<3>,8|H<1>}	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2{2|C<3>,3|C<4>,4|H<1>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,5]B[4]C[5]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	116.9880	4.937	2	116.9880	24.374	2	116.9880	24.374	2	116.9880	24.374	2	116.9880	24.374	2	115.0045	10.405	10
980	474	478	0:SP3_SP3_SP3	N[4,5]	C[5]	C[4]	4:4:4:4:	3:4:1:1:	4:4:1:1:	B[5,5a]-4:C[5]-4:C[4]-4:C[4]-4:	C[5,6a]-3:N[4,5]-4:H-1:H-1:	N[4,5]-4:C[4]-4:H-1:H-1:	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2	C[5](C[5,6a]C[5,6a]C[6a])(N[4,5]B[5,5a]C[4]2)(H)2	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2{2|C<4>,4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[4,5]B[5,5a]C[4]2)(H)2{1|C<4>,2|C<3>,2|O<2>,5|H<1>}	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2{2|C<3>,2|O<2>,4|H<1>}	114.8985	1.405	4	114.8985	1.974	4	114.8985	1.974	4	114.8985	1.974	4	114.8985	1.974	4	115.0045	10.405	10
980	474	478	0:SP3_SP3_SP3	N[4]	C[5]	C[4]	4:4:4:4:	3:4:4:1:	4:4:1:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	C[5,6a]-3:C[5]-4:N[4]-4:H-1:	N[4]-4:C[4]-4:H-1:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H){1|C<4>,3|C<3>,6|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2{1|C<4>,2|C<3>,2|H<1>}	114.7870	4.827	2	114.7870	23.297	2	114.7870	23.297	2	114.7870	23.297	2	114.1188	17.431	4	115.0045	10.405	10
980	474	478	0:SP3_SP3_SP3	N[4]	C[5]	C[4]	4:4:4:4:	3:4:4:1:	4:4:3:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	C[5,6a]-3:C[5]-4:N[4]-4:H-1:	N[4]-4:C[4]-4:C-3:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H)	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H){1|C<4>,3|C<3>,6|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H){1|C<3>,1|C<4>,3|H<1>}	113.4505	5.216	2	113.4505	27.210	2	113.4505	27.210	2	113.4505	27.210	2	114.1188	17.431	4	115.0045	10.405	10
980	474	490	0:SP3_SP3_SP3	N[4]	C[5]	C	4:4:4:4:	3:4:4:1:	4:1:1:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	C[5,6a]-3:C[5]-4:N[4]-4:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H)	C(N[4]C[4]2C[5])(H)3	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]HH)(N[4]C[4]2C)(H){1|C<4>,3|C<3>,6|H<1>}	C(N[4]C[4]2C[5])(H)3	111.9620	2.903	2	111.9620	8.430	2	111.9620	8.430	2	111.9620	8.430	2	111.9620	8.430	2	111.9620	8.430	2
980	474	679	5:SP3_SP3_SP3	N[4,5]	C[5]	B[5,5a]	4:4:4:4:	3:4:1:1:	3:4:2:2:	B[5,5a]-4:C[5]-4:C[4]-4:C[4]-4:	C[5,6a]-3:N[4,5]-4:H-1:H-1:	C[5,6a]-3:N[4,5]-4:O[5a]-2:O[5a]-2:	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2	C[5](C[5,6a]C[5,6a]C[6a])(N[4,5]B[5,5a]C[4]2)(H)2	B[5,5a](C[5,6a]C[5,6a]C[6a])(N[4,5]C[4]2C[5])(O[5a]C[5a,6a])2	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2{2|C<4>,4|C<3>}	C[5](C[5,6a]C[5,6a]C[6a])(N[4,5]B[5,5a]C[4]2)(H)2{1|C<4>,2|C<3>,2|O<2>,5|H<1>}	B[5,5a](C[5,6a]C[5,6a]C[6a])(N[4,5]C[4]2C[5])(O[5a]C[5a,6a])2{1|C<4>,4|C<3>,7|H<1>}	104.7145	0.491	2	104.7145	0.242	2	104.7145	0.242	2	104.7145	0.242	2	104.7145	0.242	2	104.7145	0.242	2
980	474	686	5:SP3_SP3_SPD5	N[4,5,5]	C[5]	Ge[4,5,5]	5:5:4:4:	4:4:1:1:	4:4:3:3:1:	Ge[4,5,5]-5:Ge[4,5,5]-5:C[5]-4:C[5]-4:	N[4,5,5]-4:C[5]-4:H-1:H-1:	N[4,5,5]-4:N[4,5,5]-4:N[5]-3:N[5]-3:Cl-1:	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl)	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2{4|Si<4>,4|C<4>,4|H<1>}	C[5](N[4,5,5]Ge[4,5,5]2C[5])(C[5]N[5]HH)(H)2{1|Si<4>,2|Cl<1>,1|C<4>,1|N<4>,2|H<1>,3|N<3>}	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl){12|H<1>,1|Cl<1>,2|C<4>,2|N<3>}	110.7013	5.189	4	110.7013	26.924	4	110.7013	26.924	4	110.7013	26.924	4	110.7013	26.924	4	110.7013	26.924	4
980	474	742	0:SP3_SP3_SP3	N[4,5]	C[5]	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:N[4,5]-4:Br-1:Br-1:	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2	B[4](N[4,5]B[4]C[5]2)2(Br)2	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2{2|C<4>,4|H<1>}	C[5](N[4,5]B[4]2C[5])(C[5]C[5]HH)(H)2{4|Br<1>,1|N<4>,4|H<1>}	B[4](N[4,5]B[4]C[5]2)2(Br)2{2|Br<1>,4|C<4>,8|H<1>}	117.6889	1.372	8	117.6889	1.884	8	117.6889	1.884	8	117.6889	1.884	8	117.7342	17.854	10	117.7342	17.854	10
980	474	742	0:SP3_SP3_SP3	N[4,5]	C[5]	B[4]	4:4:4:4:	4:4:1:1:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	C[4,6]-4:N[4,5]-4:C[6a]-3:C[6a]-3:	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,5]C[4,6,6]C[5]2)(C[6a]C[6a]2)2	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2{3|C<4>,5|C<3>,8|H<1>}	C[5](N[4,5]C[4,6,6]B[4]C[5])(C[5]C[5]HH)(H)2{2|C<3>,3|C<4>,4|H<1>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,5]C[4,6,6]C[5]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	117.9155	12.142	2	117.9155	147.422	2	117.9155	147.422	2	117.9155	147.422	2	117.7342	17.854	10	117.7342	17.854	10
980	474	878	0:SP3_SP-NON_SP3	N[4,5]	C[5]	Ga[4]	4:4:4:4:	4:4:1:1:	4:3:4:1:	Ga[4]-4:Si[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[4]-3:C-4:H-1:	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2	Ga[4](N[4,5]Si[4]C[5]2)(C[4]Si[4]C)(CC3)(H)	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2{1|C<3>,4|H<1>}	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2{1|C<2>,1|C<4>,2|C<3>,5|H<1>}	Ga[4](N[4,5]Si[4]C[5]2)(C[4]Si[4]C)(CC3)(H){1|C<2>,1|C<3>,2|C<4>,4|H<1>}	116.4230	11.329	2	116.4230	128.352	2	116.4230	128.352	2	116.4230	128.352	2	116.4230	128.352	2	116.4230	128.352	2
980	474	996	0:SP3_SP3_SP3	N[4,5]	C[5]	Si[4]	4:4:4:4:	4:4:1:1:	4:3:3:2:	Ga[4]-4:Si[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[5]-4:H-1:H-1:	N[4,5]-4:C[4]-3:C-3:C-2:	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2	Si[4](N[4,5]Ga[4]C[5]2)(C[4]Ga[4]C)(CGaC)(CC)	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2{1|C<3>,4|H<1>}	C[5](N[4,5]Ga[4]Si[4]C[5])(C[5]C[5]HH)(H)2{1|C<2>,1|C<4>,2|C<3>,5|H<1>}	Si[4](N[4,5]Ga[4]C[5]2)(C[4]Ga[4]C)(CGaC)(CC){3|C<4>,5|H<1>}	116.2325	2.658	2	116.2325	7.065	2	116.2325	7.065	2	116.2325	7.065	2	116.2325	7.065	2	116.2325	7.065	2
980	478	478	4:SP3_SP3_SP3	N[4,5]	C[4]	C[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[5,5a]-4:C[5]-4:C[4]-4:C[4]-4:	N[4,5]-4:C[4]-4:H-1:H-1:	N[4,5]-4:C[4]-4:H-1:H-1:	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2{2|C<4>,4|C<3>}	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2{2|C<3>,2|O<2>,4|H<1>}	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2{2|C<3>,2|O<2>,4|H<1>}	89.7460	0.007	2	89.7460	0.000	2	89.7460	0.000	2	89.7460	0.000	2	89.7460	0.000	2	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4,6]	C[4]	4:4:4:1:	4:4:4:1:	4:4:3:1:	C[4,6]-4:C[4]-4:C-4:H-1:	C[4,6]-4:C[6]-4:N[4]-4:H-1:	C[4,6]-4:N[4]-4:C-3:H-1:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H)	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H)	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>,2|H<1>}	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	90.5659	0.000	1	90.5659	0.000	1	90.5659	0.000	1	90.5659	0.000	1	90.5659	0.000	1	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:3:4:1:	4:3:4:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:C[6a]-3:N[4]-4:H-1:	C[4]-4:C[6a]-3:N[4]-4:H-1:	N[4](C[4]C[6a]C[4]H)2(H)2	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H)	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H)	N[4](C[4]C[6a]C[4]H)2(H)2{1|H<1>,5|C<3>}	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H){3|H<1>,5|C<3>}	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H){3|H<1>,5|C<3>}	88.9931	0.000	1	88.9931	0.000	1	88.9931	0.000	1	88.9931	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:4:1:1:	4:4:1:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2	N[4](C[4]C[4]HH)2(H)2{1|C<4>,1|H<1>}	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2{2|C<4>,3|H<1>}	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2{2|C<4>,3|H<1>}	90.2632	0.755	4	90.2632	0.571	4	90.7423	0.545	10	90.7423	0.545	10	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:4:1:1:	4:4:1:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2	N[4](C[4]C[4]HH)2(H)2{2|F<1>}	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2{2|H<1>}	91.3091	0.303	3	91.3091	0.092	3	90.7423	0.545	10	90.7423	0.545	10	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:4:1:1:	4:4:1:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2	N[4](C[4]C[4]HH)2(H)2{1|F<1>,1|H<1>}	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2{2|H<1>}	89.9562	0.000	1	89.9562	0.000	1	90.7423	0.545	10	90.7423	0.545	10	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:4:1:1:	4:4:1:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2	N[4](C[4]C[4]HH)2(H)2{2|N<3>}	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2{2|H<1>}	91.2433	0.073	2	91.2433	0.005	2	90.7423	0.545	10	90.7423	0.545	10	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:1:1:	4:4:1:1:	4:4:4:1:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:C-4:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]HH)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]HH)(CH3)(H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]HH)(H)2{1|C<4>,1|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]HH)(CH3)(H){2|H<1>}	90.0108	0.000	1	90.0108	0.000	1	90.0108	0.000	1	90.0108	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:4:1:	4:4:1:1:	4:4:4:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:C-4:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H){2|H<1>}	88.5721	0.000	1	88.5721	0.000	1	88.5721	0.000	1	88.5721	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:4:1:	4:4:4:1:	4:4:1:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	89.6453	0.000	1	89.6453	0.000	1	89.6453	0.000	1	89.6453	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:4:4:	3:4:4:1:	4:4:1:1:	C[4]-4:C[4]-4:B-4:C-4:	C[6a]-3:C[4]-4:N[4]-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H)	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H){1|C<4>,2|C<3>,3|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2{1|C<3>,1|H<1>}	87.4092	0.000	1	87.4092	0.000	1	87.4092	0.000	1	87.4092	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:4:4:	4:4:1:1:	4:4:3:1:	C[4]-4:C[4]-4:C-4:C-4:	C[4]-4:N[4]-4:H-1:H-1:	C[4]-4:N[4]-4:C-3:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2{1|C<3>,1|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H){2|H<1>}	87.6639	0.000	1	87.6639	0.000	1	87.6639	0.000	1	87.6639	0.000	1	89.6890	2.329	18	89.7362	2.016	21
980	478	478	4:SP3_SP3_SP3	N[4]	C[4]	C[4]	4:4:4:4:	4:4:3:1:	4:4:1:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	N[4]-4:C[4]-4:C-3:H-1:	N[4]-4:C[4]-4:H-1:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H){1|C<3>,1|C<4>,3|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2{1|C<4>,2|C<3>,2|H<1>}	87.3418	1.203	2	87.3418	1.447	2	87.3418	1.447	2	87.3418	1.447	2	89.6890	2.329	18	89.7362	2.016	21
980	478	490	0:SP3_SP3_SP3	N[4]	C[4,6]	C	4:4:4:1:	4:4:4:1:	4:4:1:1:	C[4,6]-4:C[4]-4:C-4:H-1:	C[4,6]-4:C[6]-4:N[4]-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H)	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>,2|H<1>}	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:1:	4:4:1:1:	3:4:1:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[6a]-3:N[4]-4:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	120.6250	0.000	1	120.6250	0.000	1	120.6250	0.000	1	120.6250	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:1:	4:4:1:1:	4:4:1:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	C[5]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	113.4700	0.000	1	113.4700	0.000	1	113.4700	0.000	1	113.4700	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:1:	4:4:3:1:	4:4:1:1:	C[4,6]-4:C[4]-4:C-4:H-1:	C[4,6]-4:N[4]-4:C-3:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H)	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	114.5460	0.000	1	114.5460	0.000	1	114.5460	0.000	1	114.5460	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:1:	4:4:4:1:	3:4:1:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:C-4:H-1:	C[6a]-3:N[4]-4:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H)	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H){2|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	118.2280	0.000	1	118.2280	0.000	1	118.2280	0.000	1	118.2280	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:1:	4:4:4:1:	4:4:1:1:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:C-4:H-1:	C[5]-4:N[4]-4:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H)	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H){2|H<1>}	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	113.2950	0.000	1	113.2950	0.000	1	113.2950	0.000	1	113.2950	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	3:4:4:1:	4:1:1:1:	C[4]-4:C[4]-4:B-4:C-4:	C[6a]-3:C[4]-4:N[4]-4:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H)	C(N[4]C[4]2B)(H)3	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H){1|C<4>,2|C<3>,3|H<1>}	C(N[4]C[4]2B)(H)3	114.9180	0.000	1	114.9180	0.000	1	114.9180	0.000	1	114.9180	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	3:4:4:1:	4:4:1:1:	B[4]-4:C[4]-4:C-4:C-4:	C[6a]-3:C[4]-4:N[4]-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2	C[4](C[6a]C[6a]2)(C[4]B[4]HH)(N[4]B[4]CC)(H)	C(N[4]B[4]C[4]C)(CH3)(H)2	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2{2|H<1>,6|C<3>}	C[4](C[6a]C[6a]2)(C[4]B[4]HH)(N[4]B[4]CC)(H){2|H<1>,4|C<3>}	C(N[4]B[4]C[4]C)(CH3)(H)2	111.9748	0.204	6	111.9748	0.042	6	111.9748	0.042	6	111.9748	0.042	6	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:1:1:	3:4:4:1:	C[4]-4:C[4]-4:C-4:C-4:	C[4]-4:N[4]-4:H-1:H-1:	C[6a]-3:N[4]-4:C-4:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2{1|C<3>,1|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	113.5420	0.000	1	113.5420	0.000	1	113.5420	0.000	1	113.5420	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:1:1:	4:1:1:1:	C[4]-4:C[4]-4:B-4:C-4:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2	C(N[4]C[4]2B)(H)3	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2{1|C<3>,1|H<1>}	C(N[4]C[4]2B)(H)3	114.3340	0.000	1	114.3340	0.000	1	114.3340	0.000	1	111.9898	7.611	4	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:1:1:	4:1:1:1:	C[4]-4:C[4]-4:C-4:C-4:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2	C(N[4]C[4]2C)(H)3	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(H)2{1|C<3>,1|H<1>}	C(N[4]C[4]2C)(H)3	111.2180	0.000	1	111.2180	0.000	1	111.2180	0.000	1	111.9898	7.611	4	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:1:1:	4:1:1:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	N[4]-4:C[4]-4:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2	C(N[4]C[4]2C[5])(H)3	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(H)2{1|C<4>,2|C<3>,2|H<1>}	C(N[4]C[4]2C[5])(H)3	111.2035	3.938	2	111.2035	15.507	2	111.2035	15.507	2	111.9898	7.611	4	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:3:1:	3:4:4:1:	C[4]-4:C[4]-4:C-4:C-4:	C[4]-4:N[4]-4:C-3:H-1:	C[6a]-3:N[4]-4:C-4:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H)	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H){2|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	114.4610	0.000	1	114.4610	0.000	1	114.4610	0.000	1	114.4610	0.000	1	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:3:1:	4:1:1:1:	C[4]-4:C[4]-4:C-4:C-4:	C[4]-4:N[4]-4:C-3:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H)	C(N[4]C[4]2C)(H)3	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CC)(COO)(H){2|H<1>}	C(N[4]C[4]2C)(H)3	113.0330	0.000	1	113.0330	0.000	1	113.0330	0.000	1	114.9233	3.651	3	113.6982	6.793	21	113.8385	6.903	22
980	478	490	0:SP3_SP3_SP3	N[4]	C[4]	C	4:4:4:4:	4:4:3:1:	4:1:1:1:	C[5]-4:C[4]-4:C[4]-4:C-4:	N[4]-4:C[4]-4:C-3:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3)	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H)	C(N[4]C[4]2C[5])(H)3	N[4](C[5]C[5,6a]C[5]H)(C[4]C[4]CH)(C[4]C[4]HH)(CH3){1|C<4>,2|C<3>,4|H<1>}	C[4](N[4]C[4]C[5]C)(C[4]C[4]HH)(COO)(H){1|C<3>,1|C<4>,3|H<1>}	C(N[4]C[4]2C[5])(H)3	115.8685	1.394	2	115.8685	1.942	2	115.8685	1.942	2	114.9233	3.651	3	113.6982	6.793	21	113.8385	6.903	22
980	478	610	0:SP3_SP3_SP3	N[4]	C[4]	B	4:4:4:4:	3:4:4:1:	4:1:1:1:	C[4]-4:C[4]-4:B-4:C-4:	C[6a]-3:C[4]-4:N[4]-4:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H)	B(N[4]C[4]2C)(H)3	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C[4](C[6a]C[6a]2)(C[4]C[4]HH)(N[4]C[4]BC)(H){1|C<4>,2|C<3>,3|H<1>}	B(N[4]C[4]2C)(H)3	116.3260	0.000	1	116.3260	0.000	1	116.3260	0.000	1	116.3260	0.000	1	114.0265	10.575	2	114.0265	10.575	2
980	478	610	0:SP3_SP3_SP3	N[4]	C[4]	B	4:4:4:4:	4:4:1:1:	4:1:1:1:	C[4]-4:C[4]-4:B-4:C-4:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2	B(N[4]C[4]2C)(H)3	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]BC)(H)2{1|C<3>,1|H<1>}	B(N[4]C[4]2C)(H)3	111.7270	0.000	1	111.7270	0.000	1	111.7270	0.000	1	111.7270	0.000	1	114.0265	10.575	2	114.0265	10.575	2
980	478	679	0:SP3_SP3_SP3	N[4,5]	C[4]	B[5,5a]	4:4:4:4:	4:4:1:1:	3:4:2:2:	B[5,5a]-4:C[5]-4:C[4]-4:C[4]-4:	N[4,5]-4:C[4]-4:H-1:H-1:	C[5,6a]-3:N[4,5]-4:O[5a]-2:O[5a]-2:	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2	B[5,5a](C[5,6a]C[5,6a]C[6a])(N[4,5]C[4]2C[5])(O[5a]C[5a,6a])2	N[4,5](B[5,5a]C[5,6a]O[5a]2)(C[5]C[5,6a]HH)(C[4]C[4]HH)2{2|C<4>,4|C<3>}	C[4](N[4,5]B[5,5a]C[4]C[5])(C[4]C[4]CC)(H)2{2|C<3>,2|O<2>,4|H<1>}	B[5,5a](C[5,6a]C[5,6a]C[6a])(N[4,5]C[4]2C[5])(O[5a]C[5a,6a])2{1|C<4>,4|C<3>,7|H<1>}	116.3212	2.797	4	116.3212	7.821	4	116.3212	7.821	4	116.3212	7.821	4	116.3212	7.821	4	116.3212	7.821	4
980	478	742	4:SP3_SP3_SP3	N[4,5]	C[4,6,6]	B[4]	4:4:4:4:	4:4:4:4:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[5]-4:C[5]-4:	C[4,6]-4:N[4,5]-4:C[6,6]-4:C[6]-4:	C[4,6]-4:N[4,5]-4:C[6a]-3:C[6a]-3:	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,5]B[4]C[5]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,5]C[4,6,6]C[5]2)(C[6a]C[6a]2)2	N[4,5](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[5]C[5]HH)2{3|C<4>,5|C<3>,8|H<1>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,5]B[4]C[5]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,5]C[4,6,6]C[5]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	86.9085	0.000	1	86.9085	0.000	1	86.9085	0.000	1	86.9085	0.000	1	86.9085	0.000	1	85.4746	3.037	8
980	478	742	4:SP3_SP3_SP3	N[4,6]	C[4,6,6]	B[4]	4:4:4:4:	4:4:4:4:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	C[4,6]-4:N[4,6]-4:C[6,6]-4:C[6]-4:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{1|O<2>,3|C<4>,5|C<3>,8|H<1>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	86.0120	0.000	1	86.1218	0.024	2	86.1218	0.024	2	86.1218	0.024	2	86.1218	0.024	2	85.4746	3.037	8
980	478	742	4:SP3_SP3_SP3	N[4,6]	C[4,6,6]	B[4]	4:4:4:4:	4:4:4:4:	4:4:3:3:	C[4,6,6]-4:B[4]-4:C[6]-4:C[6]-4:	C[4,6]-4:N[4,6]-4:C[6,6]-4:C[6]-4:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH)	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6,6]C[4,6]C[6,6]C[6])(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{4|C<4>,5|C<3>,8|H<1>}	C[4,6,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6,6]C[6]2H)(C[6]C[6]HH){11|H<1>,3|C<3>,3|C<4>}	B[4](C[4,6]C[4,6,6]C[6]H)(N[4,6]C[4,6,6]C[6]2)(C[6a]C[6a]2)2{4|C<4>,4|F<1>,5|C<3>,5|H<1>}	86.2317	0.000	1	86.1218	0.024	2	86.1218	0.024	2	86.1218	0.024	2	86.1218	0.024	2	85.4746	3.037	8
980	478	742	4:SP3_SP3_SP3	N[4,6]	C[4,6]	B[4]	4:4:4:4:	4:4:4:1:	4:4:3:3:	C[4,6]-4:B[4]-4:C[6]-4:C[6]-4:	C[4,6]-4:N[4,6]-4:C[6]-4:H-1:	C[4,6]-4:N[4,6]-4:C[6a]-3:C[6a]-3:	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2	C[4,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6]C[6]HH)(H)	B[4](C[4,6]C[4,6]C[6]H)(N[4,6]C[4,6]C[6]2)(C[6a]C[6a]2)2	N[4,6](C[4,6]C[4,6]C[6]H)(B[4]C[4,6]C[6a]2)(C[6]C[6]HH)2{3|C<4>,4|C<3>,7|H<1>}	C[4,6](C[4,6]B[4]C[6]H)(N[4,6]B[4]C[6]2)(C[6]C[6]HH)(H){2|C<3>,3|C<4>,8|H<1>}	B[4](C[4,6]C[4,6]C[6]H)(N[4,6]C[4,6]C[6]2)(C[6a]C[6a]2)2{4|C<3>,4|C<4>,4|F<1>,7|H<1>}	82.3112	0.000	1	82.3112	0.000	1	82.3112	0.000	1	82.3112	0.000	1	82.3112	0.000	1	85.4746	3.037	8
980	478	742	4:SP3_SP3_SP3	N[4,6]	C[4]	B[4]	4:4:4:4:	4:3:4:1:	4:3:3:4:	B[4]-4:C[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:C[6a]-3:C[4]-4:H-1:	N[4,6]-4:C[6a]-3:C[6a]-3:C[4]-4:	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2	C[4](N[4,6]B[4]C[6]2)(C[6a]C[6a]2)(C[4]B[4]CC)(H)	B[4](N[4,6]C[4]C[6]2)(C[6a]C[6a]2)2(C[4]C[4]CC)	N[4,6](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(C[6]C[6]HH)2{3|C<4>,4|H<1>,6|C<3>}	C[4](N[4,6]B[4]C[6]2)(C[6a]C[6a]2)(C[4]B[4]CC)(H){2|C<4>,4|C<3>,6|H<1>}	B[4](N[4,6]C[4]C[6]2)(C[6a]C[6a]2)2(C[4]C[4]CC){2|C<4>,4|F<1>,5|C<3>,5|H<1>}	88.0753	0.000	1	88.0753	0.000	1	88.0753	0.000	1	88.0753	0.000	1	88.0753	0.000	1	85.4746	3.037	8
980	478	742	4:SP3_SP3_SP3	N[4]	C[4]	B[4]	4:4:4:4:	3:4:4:1:	3:3:4:4:	B[4]-4:C[4]-4:C-4:C-4:	C[6a]-3:C[4]-4:N[4]-4:H-1:	C[6a]-3:C[6a]-3:C[4]-4:N[4]-4:	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2	C[4](C[6a]C[6a]2)(C[4]B[4]HH)(N[4]B[4]CC)(H)	B[4](C[6a]C[6a]2)2(C[4]C[4]HH)(N[4]C[4]CC)	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2{2|H<1>,6|C<3>}	C[4](C[6a]C[6a]2)(C[4]B[4]HH)(N[4]B[4]CC)(H){2|H<1>,4|C<3>}	B[4](C[6a]C[6a]2)2(C[4]C[4]HH)(N[4]C[4]CC){1|H<1>,4|F<1>,5|C<3>}	84.7527	0.043	3	84.7527	0.002	3	84.7527	0.002	3	84.7527	0.002	3	84.7527	0.002	3	85.4746	3.037	8
980	478	846	4:SP3_SP2_SP3	N[4,4,6]	C[3x4]	C[3x4]	4:3:4:4:	6:4:2:1:	6:4:2:	C[3x4]-4:C[3x4]-3:C[6]-4:C[6]-4:	C[3,3,4,4]-6:N[4,4,6]-4:H[4,4]-2:H-1:	C[3,3,4,4]-6:N[4,4,6]-4:H[4,4]-2:	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])(H)	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])	N[4,4,6](C[3x4]C[3,3,4,4]H[4,4]H)(C[3x4]C[3,3,4,4]H[4,4])(C[6]C[6]HH)2{1|C<4>,1|H<2>,1|O<2>,2|O<3>,4|H<1>}	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4])(H){2|C<4>,5|H<1>}	C[3x4](C[3,3,4,4]C[3x4]O[3,3]H[3]O[3]C)(N[4,4,6]C[3x4]C[6]2)(H[4,4]C[3x4]){2|C<4>,6|H<1>}	31.2341	0.000	1	31.2341	0.000	1	31.2341	0.000	1	31.2341	0.000	1	31.2341	0.000	1	31.2341	0.000	1
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4,6]	H	4:4:4:1:	4:4:4:1:	4:	C[4,6]-4:C[4]-4:C-4:H-1:	C[4,6]-4:C[6]-4:N[4]-4:H-1:	N[4]-4:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H)	H(N[4]C[4,6]C[4]C)	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C[4,6](C[4,6]C[4]C[6]H)(C[6]C[6]ClH)(N[4]C[4]CH)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>,2|H<1>}	H(N[4]C[4,6]C[4]C)	111.1450	0.000	1	111.1450	0.000	1	111.1450	0.000	1	111.1450	0.000	1	111.1450	0.000	1	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:3:4:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:C[6a]-3:N[4]-4:H-1:	N[4]-4:	N[4](C[4]C[6a]C[4]H)2(H)2	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H)	H(N[4]C[4]2H)	N[4](C[4]C[6a]C[4]H)2(H)2{1|H<1>,5|C<3>}	C[4](C[4]C[6a]C[4]H)(C[6a]C[6a]2)(N[4]C[4]HH)(H){3|H<1>,5|C<3>}	H(N[4]C[4]2H)	114.2392	1.822	4	114.2392	3.318	4	114.2392	3.318	4	114.2392	3.318	4	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]HH)(H)2	H(N[4]C[4]2H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]HH)(H)2{1|C<4>,1|H<1>}	H(N[4]C[4]2H)	113.6160	0.011	2	113.6160	0.000	2	113.4904	3.673	39	113.4904	3.673	39	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{1|C<4>,1|H<1>}	C[4](C[4]C[4]2H)(N[4]C[4]HH)(H)2{2|C<4>,3|H<1>}	H(N[4]C[4]2H)	113.4906	2.867	16	113.4906	8.219	16	113.4904	3.673	39	113.4904	3.673	39	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{2|F<1>}	C[4](C[4]C[4]FF)(N[4]C[4]HH)(H)2{2|H<1>}	H(N[4]C[4]2H)	113.4089	0.055	11	113.4089	0.003	11	113.4904	3.673	39	113.4904	3.673	39	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{1|F<1>,1|H<1>}	C[4](C[4]C[4]FH)(N[4]C[4]HH)(H)2{2|H<1>}	H(N[4]C[4]2H)	113.7357	2.301	4	113.7357	5.297	4	113.4904	3.673	39	113.4904	3.673	39	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{2|N<3>}	C[4](C[4]C[4]NN)(N[4]C[4]HH)(H)2{2|H<1>}	H(N[4]C[4]2H)	113.4337	0.017	6	113.4337	0.000	6	113.4904	3.673	39	113.4904	3.673	39	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:1:1:	4:4:4:1:	4:	C[4]-4:C[4]-4:H-1:H-1:	C[4]-4:N[4]-4:C-4:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2	C[4](C[4]C[4]HH)(N[4]C[4]HH)(CH3)(H)	H(N[4]C[4]2H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2{2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]HH)(CH3)(H){2|H<1>}	H(N[4]C[4]2H)	113.6540	0.048	2	113.6540	0.002	2	113.6540	0.002	2	113.6540	0.002	2	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:4:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	H(N[4]C[4]2C)	113.6700	0.000	1	113.6700	0.000	1	111.5070	9.357	2	111.5070	9.357	2	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:4:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(H)2{1|C<4>,1|H<1>}	H(N[4]C[4]2C)	109.3440	0.000	1	109.3440	0.000	1	111.5070	9.357	2	111.5070	9.357	2	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:4:1:	4:4:3:1:	4:	C[4,6]-4:C[4]-4:C-4:H-1:	C[4,6]-4:N[4]-4:C-3:H-1:	N[4]-4:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H)	H(N[4]C[4,6]C[4]C)	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C[4](C[4,6]C[4,6]C[6]H)(N[4]C[4,6]CH)(CCH)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(N[4]C[4,6]C[4]C)	111.1940	0.000	1	111.1940	0.000	1	111.1940	0.000	1	111.1940	0.000	1	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:4:1:	4:4:4:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:C-4:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H)	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CC[6a]2O)(H){2|H<1>}	H(N[4]C[4]2C)	122.1650	0.000	1	122.1650	0.000	1	115.5635	87.160	2	115.5635	87.160	2	113.5145	5.511	50	113.4680	5.511	51
980	478	951	0:SP3_SP-NON_SP3	N[4]	C[4]	H	4:4:4:1:	4:4:4:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[4]-4:N[4]-4:C-4:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H)	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C[4](C[4]C[4]HH)(N[4]C[4]CH)(CH3)(H){2|H<1>}	H(N[4]C[4]2C)	108.9620	0.000	1	108.9620	0.000	1	115.5635	87.160	2	115.5635	87.160	2	113.5145	5.511	50	113.4680	5.511	51
980	490	490	0:SP3_SP3_SP3	N[4,4,5,5]	C	C	5:5:4:4:	4:1:1:1:	4:1:1:1:	C[4x4,6x5,6]-5:C[4x4,6x5,6]-5:C-4:C-4:	N[4,4,5,5]-4:H-1:H-1:H-1:	N[4,4,5,5]-4:H-1:H-1:H-1:	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2{1|N<5>,4|H<1>}	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	109.9410	0.000	1	109.9410	0.000	1	109.9410	0.000	1	109.9410	0.000	1	109.9410	0.000	1	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	3:4:4:4:	4:1:1:1:	4:1:1:1:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	C(N[4]C[4,6a]B[4]C)(H)3	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2{1|H<1>,6|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	C(N[4]C[4,6a]B[4]C)(H)3	109.5480	0.450	2	109.5480	0.202	2	109.5673	0.102	3	109.5673	0.102	3	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	3:4:4:4:	4:1:1:1:	4:1:1:1:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	C(N[4]C[4,6a]B[4]C)(H)3	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2{1|H<1>,2|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	C(N[4]C[4,6a]B[4]C)(H)3	109.6060	0.000	1	109.6060	0.000	1	109.5673	0.102	3	109.5673	0.102	3	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	3:4:4:1:	4:1:1:1:	C[4]-4:C[4]-4:C-4:C-4:	C[6a]-3:N[4]-4:C-4:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3)	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	C(N[4]C[4]2C)(H)3	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]CH)(CH3){2|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2C)(CH3)(H)	C(N[4]C[4]2C)(H)3	114.1760	0.000	1	114.1760	0.000	1	114.1760	0.000	1	114.1760	0.000	1	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:1:1:1:	4:1:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](B[4]N[4]Br2)2(CH3)2	C(N[4]B[4]2C)(H)3	C(N[4]B[4]2C)(H)3	N[4](B[4]N[4]Br2)2(CH3)2{2|C<4>}	C(N[4]B[4]2C)(H)3	C(N[4]B[4]2C)(H)3	105.9480	0.000	1	105.9480	0.000	1	107.9547	3.020	3	107.9547	3.020	3	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:1:1:1:	4:1:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](B[4]N[4]HH)2(CH3)2	C(N[4]B[4]2C)(H)3	C(N[4]B[4]2C)(H)3	N[4](B[4]N[4]HH)2(CH3)2{2|C<4>}	C(N[4]B[4]2C)(H)3	C(N[4]B[4]2C)(H)3	108.9580	0.000	2	108.9580	0.000	2	107.9547	3.020	3	107.9547	3.020	3	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CCHH)2	C(N[4]B[4]2C)(CHHP)(H)2	C(N[4]B[4]2C)(CHHP)(H)2	N[4](B[4]N[4]HH)2(CCHH)2{2|C<4>}	C(N[4]B[4]2C)(CHHP)(H)2	C(N[4]B[4]2C)(CHHP)(H)2	112.6420	0.000	1	112.6420	0.000	1	112.6420	0.000	1	112.3312	0.096	8	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:C[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2	C(N[4]B[4]C[4]C)(CH3)(H)2	C(N[4]B[4]C[4]C)(CH3)(H)2	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2{2|H<1>,6|C<3>}	C(N[4]B[4]C[4]C)(CH3)(H)2	C(N[4]B[4]C[4]C)(CH3)(H)2	112.2167	0.101	3	112.2167	0.010	3	112.2167	0.010	3	112.3312	0.096	8	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](Ga[4]N[4]CH)2(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	N[4](Ga[4]N[4]CH)2(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	112.6410	0.000	1	112.6410	0.000	1	112.3395	0.171	4	112.3312	0.096	8	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	112.4680	0.280	2	112.4680	0.078	2	112.3395	0.171	4	112.3312	0.096	8	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:C-4:H-1:H-1:	N[4](Ga[4]N[4]ClC)2(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	N[4](Ga[4]N[4]ClC)2(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	C(N[4]Ga[4]2C)(CH3)(H)2	111.7810	0.000	1	111.7810	0.000	1	112.3395	0.171	4	112.3312	0.096	8	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	5:4:4:4:	4:1:1:1:	4:1:1:1:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](Ga[4]C[4]C[5]2Fe)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	N[4](Ga[4]C[4]C[5]2Fe)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	109.2870	0.000	1	109.2870	0.000	1	109.1150	0.024	4	109.1150	0.024	4	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	5:4:4:4:	4:1:1:1:	4:1:1:1:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](Ga[4]C[4]C[5]2Ru)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	N[4](Ga[4]C[4]C[5]2Ru)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	108.9460	0.000	1	108.9460	0.000	1	109.1150	0.024	4	109.1150	0.024	4	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	5:4:4:4:	4:1:1:1:	4:1:1:1:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](Ga[4]C[4]C[6]2Cr)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	N[4](Ga[4]C[4]C[6]2Cr)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	109.0300	0.000	1	109.0300	0.000	1	109.1150	0.024	4	109.1150	0.024	4	110.6238	4.264	19	110.5897	4.063	20
980	490	490	0:SP3_SP3_SP3	N[4]	C	C	5:4:4:4:	4:1:1:1:	4:1:1:1:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](Ga[4]C[4]C[6]2V)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	N[4](Ga[4]C[4]C[6]2V)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	C(N[4]Ga[4]Si[4]C)(H)3	109.1970	0.000	1	109.1970	0.000	1	109.1150	0.024	4	109.1150	0.024	4	110.6238	4.264	19	110.5897	4.063	20
980	490	610	0:SP3_SP3_SP3	N[4]	C	B	4:4:4:4:	4:1:1:1:	4:1:1:1:	C[4]-4:C[4]-4:B-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:H-1:H-1:H-1:	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3)	C(N[4]C[4]2B)(H)3	B(N[4]C[4]2C)(H)3	N[4](C[4]C[6a]C[4]H)(C[4]C[4]HH)(BH3)(CH3){2|C<3>,2|H<1>}	C(N[4]C[4]2B)(H)3	B(N[4]C[4]2C)(H)3	110.4460	0.000	1	110.4460	0.000	1	110.4460	0.000	1	110.4460	0.000	1	110.4460	0.000	1	110.4460	0.000	1
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	3:4:4:4:	4:1:1:1:	3:4:1:1:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4,6a]-3:N[4]-4:Cl-1:Cl-1:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(Cl)2	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2{1|H<1>,2|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(Cl)2{1|H<1>,2|C<3>}	117.6445	0.391	2	117.6445	0.153	2	117.6445	0.153	2	117.6445	0.153	2	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	3:4:4:4:	4:1:1:1:	3:4:3:3:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4,6a]-3:N[4]-4:C[6a]-3:C[6a]-3:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(C[6a]C[6a]2)2	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2{1|H<1>,6|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(C[6a]C[6a]2)2{1|H<1>,4|F<1>,6|C<3>}	119.1762	0.997	4	119.1762	0.994	4	119.1762	0.994	4	119.1762	0.994	4	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	4:4:4:1:	4:4:4:4:	4:4:1:1:	B[4]-4:B[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CC3)(H)	C(N[4]B[4]2H)(CH3)3	B[4](N[4]B[4]CH)2(H)2	N[4](B[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]B[4]2H)(CH3)3	B[4](N[4]B[4]CH)2(H)2{2|H<1>}	121.8430	0.334	2	121.8430	0.111	2	121.8430	0.111	2	121.8430	0.111	2	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	4:4:4:4:	4:1:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:N[4]-4:Br-1:Br-1:	N[4](B[4]N[4]Br2)2(CH3)2	C(N[4]B[4]2C)(H)3	B[4](N[4]B[4]CC)2(Br)2	N[4](B[4]N[4]Br2)2(CH3)2{2|C<4>}	C(N[4]B[4]2C)(H)3	B[4](N[4]B[4]CC)2(Br)2{2|Br<1>}	115.7385	0.141	2	115.7385	0.020	2	115.7385	0.020	2	115.2151	0.210	10	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	4:4:4:4:	4:1:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CH3)2	C(N[4]B[4]2C)(H)3	B[4](N[4]B[4]CC)2(H)2	N[4](B[4]N[4]HH)2(CH3)2{2|C<4>}	C(N[4]B[4]2C)(H)3	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	115.0842	0.411	8	115.0842	0.169	8	115.0842	0.169	8	115.2151	0.210	10	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	4:4:4:4:	4:4:1:1:	3:3:4:4:	B[4]-4:C[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	C[6a]-3:C[6a]-3:C[4]-4:N[4]-4:	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2	C(N[4]B[4]C[4]C)(CH3)(H)2	B[4](C[6a]C[6a]2)2(C[4]C[4]HH)(N[4]C[4]CC)	N[4](B[4]C[6a]2C[4])(C[4]C[6a]C[4]H)(CCHH)2{2|H<1>,6|C<3>}	C(N[4]B[4]C[4]C)(CH3)(H)2	B[4](C[6a]C[6a]2)2(C[4]C[4]HH)(N[4]C[4]CC){1|H<1>,4|F<1>,5|C<3>}	116.4805	3.036	6	116.4805	9.218	6	116.4805	9.218	6	116.4805	9.218	6	116.4803	6.967	28	116.4803	6.967	28
980	490	742	0:SP3_SP3_SP3	N[4]	C	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CCHH)2	C(N[4]B[4]2C)(CHHP)(H)2	B[4](N[4]B[4]CC)2(H)2	N[4](B[4]N[4]HH)2(CCHH)2{2|C<4>}	C(N[4]B[4]2C)(CHHP)(H)2	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	113.6838	0.308	4	113.6838	0.095	4	113.6838	0.095	4	113.6838	0.095	4	116.4803	6.967	28	116.4803	6.967	28
980	490	769	0:SP3_SP2_SP3	N[4]	C	C[4,6a]	3:4:4:4:	4:1:1:1:	3:3:4:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4,6a]-3:C[6a]-3:N[4]-4:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC)	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2{1|H<1>,6|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC){2|H<1>,3|C<3>}	111.0885	1.149	4	111.0885	1.321	4	111.7677	1.930	6	111.7677	1.930	6	111.7677	1.930	6	111.7677	1.930	6
980	490	769	0:SP3_SP2_SP3	N[4]	C	C[4,6a]	3:4:4:4:	4:1:1:1:	3:3:4:	C[4,6a]-3:B[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4,6a]-3:C[6a]-3:N[4]-4:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2	C(N[4]C[4,6a]B[4]C)(H)3	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC)	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2{1|H<1>,2|C<3>}	C(N[4]C[4,6a]B[4]C)(H)3	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC){2|Cl<1>,1|C<3>,2|H<1>}	113.1260	0.386	2	113.1260	0.149	2	111.7677	1.930	6	111.7677	1.930	6	111.7677	1.930	6	111.7677	1.930	6
980	490	794	0:SP3_SP3_SPD5	N[4,4,5,5]	C	C[4x4,6x5,6]	5:5:4:4:	4:1:1:1:	5:5:4:2:2:	C[4x4,6x5,6]-5:C[4x4,6x5,6]-5:C-4:C-4:	N[4,4,5,5]-4:H-1:H-1:H-1:	C[4x4,5,5]-5:C[4x4,5,5]-5:N[4,4,5,5]-4:H[3x5,6]-2:H[3x5,6]-2:	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2{1|N<5>,4|H<1>}	C(N[4,4,5,5]C[4x4,6x5,6]2C)(H)3	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2{1|H<1>,2|C<4>}	111.9990	13.419	2	111.9990	180.082	2	111.9990	180.082	2	111.9990	180.082	2	111.9990	180.082	2	111.9990	180.082	2
980	490	818	0:SP3_SP2_SP3	N[4,5]	C	C[5]	4:4:3:4:	4:4:4:4:	4:3:1:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:C-4:C-4:C-4:	N[4,5]-4:C[5]-3:H-1:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H)	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H){2|Cl<1>,1|C<4>,1|N<3>,1|N<4>}	108.9866	3.587	14	108.9866	12.865	14	108.9866	12.865	14	109.0701	12.051	15	109.0701	12.051	15	109.0701	12.051	15
980	490	818	0:SP3_SP2_SP3	N[4,5]	C	C[5]	4:4:3:4:	4:4:4:4:	4:3:1:	Si[4,5]-4:Si[4,5]-4:C[5]-3:C-4:	N[4,5]-4:C-4:C-4:C-4:	N[4,5]-4:C[5]-3:H-1:	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3)	C(N[4,5]Si[4,5]2C[5])(CH3)3	C[5](N[4,5]Si[4,5]2C)(C[5]N[5]H)(H)	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C(N[4,5]Si[4,5]2C[5])(CH3)3	C[5](N[4,5]Si[4,5]2C)(C[5]N[5]H)(H){1|C<4>,1|N<3>,1|N<4>,2|N<2>}	110.2400	0.000	1	110.2400	0.000	1	110.2400	0.000	1	109.0701	12.051	15	109.0701	12.051	15	109.0701	12.051	15
980	490	878	0:SP3_SP-NON_SP3	N[4,5]	C	Ga[4,5,5]	4:4:3:4:	4:4:4:4:	4:4:3:3:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:C-4:C-4:C-4:	N[4,5]-4:N[4,5]-4:N[5]-3:N[5]-3:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2{2|Cl<1>,4|H<1>}	124.9256	2.605	14	124.9256	6.787	14	124.9256	6.787	14	124.9256	6.787	14	124.9256	6.787	14	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4,5]	C	Ga[4]	4:4:3:4:	4:4:4:4:	4:4:1:1:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:C-4:C-4:C-4:	N[4,5]-4:N[4,5]-4:Cl-1:Cl-1:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C(N[4,5]Ga[4,5,5]Ga[4]C[5])(CH3)3	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2{2|C<3>,2|H<1>,2|N<3>}	121.4220	1.578	14	121.4220	2.491	14	121.4220	2.491	14	121.4220	2.491	14	121.4220	2.491	14	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:Cl-1:H-1:	N[4](Ga[4]N[4]ClH)2(CCHH)(H)	C(N[4]Ga[4]2H)(CC3)(H)2	Ga[4](N[4]Ga[4]CH)2(Cl)(H)	N[4](Ga[4]N[4]ClH)2(CCHH)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CC3)(H)2	Ga[4](N[4]Ga[4]CH)2(Cl)(H){1|Cl<1>,1|H<1>}	116.4075	0.267	2	116.4075	0.071	2	116.4075	0.071	2	116.8617	0.654	3	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](Ga[4]N[4]HH)2(CCHH)(H)	C(N[4]Ga[4]2H)(CC3)(H)2	Ga[4](N[4]Ga[4]CH)2(H)2	N[4](Ga[4]N[4]HH)2(CCHH)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CC3)(H)2	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	117.7700	0.000	1	117.7700	0.000	1	117.7700	0.000	1	116.8617	0.654	3	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:1:	4:4:4:4:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[4]N[4]Cl2)2(CC3)(H)	C(N[4]Ga[4]2H)(CH3)3	Ga[4](N[4]Ga[4]CH)2(Cl)2	N[4](Ga[4]N[4]Cl2)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CH3)3	Ga[4](N[4]Ga[4]CH)2(Cl)2{2|Cl<1>}	124.8660	0.601	2	124.8660	0.361	2	124.8660	0.361	2	123.6610	2.076	4	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:1:	4:4:4:4:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:N[4]-4:H-1:H-1:	N[4](Ga[4]N[4]HH)2(CC3)(H)	C(N[4]Ga[4]2H)(CH3)3	Ga[4](N[4]Ga[4]CH)2(H)2	N[4](Ga[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CH3)3	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	122.4560	0.243	2	122.4560	0.059	2	122.4560	0.059	2	123.6610	2.076	4	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(Cl)2	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(Cl)2{1|Cl<1>,1|C<4>}	113.3377	0.818	4	113.3377	0.669	4	113.3377	0.669	4	113.3377	0.669	4	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:C-4:Cl-1:	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl)	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl){2|Cl<1>}	112.7185	2.111	4	112.7185	4.456	4	112.9115	2.272	8	112.8929	4.332	12	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:C-4:Cl-1:	N[4](Ga[4]N[4]ClC)2(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl)	N[4](Ga[4]N[4]ClC)2(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl){1|Cl<1>,1|C<4>}	113.1045	0.863	4	113.1045	0.746	4	112.9115	2.272	8	112.8929	4.332	12	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:H-1:	N[4]-4:N[4]-4:C-4:H-1:	N[4](Ga[4]N[4]CH)2(CCHH)2	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(H)	N[4](Ga[4]N[4]CH)2(CCHH)2{2|C<4>}	C(N[4]Ga[4]2C)(CH3)(H)2	Ga[4](N[4]Ga[4]CC)2(CC3)(H){1|C<4>,1|H<1>}	112.8558	3.253	4	112.8558	10.580	4	112.8558	10.580	4	112.8929	4.332	12	115.7413	22.129	24	119.7434	28.028	52
980	490	878	0:SP3_SP-NON_SP3	N[4]	C	Ga[4]	5:4:4:1:	4:4:4:4:	4:4:1:1:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[3,4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2{1|Cl<1>,1|C<3>,1|N<3>}	124.4970	0.000	1	124.4970	0.000	1	124.4970	0.000	1	124.4970	0.000	1	115.7413	22.129	24	119.7434	28.028	52
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	3:4:1:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[6a]-3:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H)	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[6a]HH)(H){2|H<1>}	C(C[6a]C[6a]2)(N[4]C[4]2H)(H)2	H(N[4]C[4]2C)	109.3620	0.000	1	109.3620	0.000	1	109.3620	0.000	1	109.3620	0.000	1	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:1:1:	4:	C[4,6]-4:C[4]-4:C-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4]-4:	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H)	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	H(N[4]C[4,6]C[4]C)	N[4](C[4,6]C[4,6]C[6]H)(C[4]C[4,6]CH)(CCHH)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>}	C(N[4]C[4,6]C[4]H)(CCHH)(H)2	H(N[4]C[4,6]C[4]C)	111.1170	0.000	1	111.1170	0.000	1	111.1170	0.000	1	107.9150	7.938	4	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:1:1:	4:	C[4]-4:C[4]-4:C-4:H-1:	C[5]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H)	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	H(N[4]C[4]2C)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(CC[5]HH)(H){2|H<1>}	C(C[5]C[5]2Fe)(N[4]C[4]2H)(H)2	H(N[4]C[4]2C)	104.5370	0.000	1	104.5370	0.000	1	104.5370	0.000	1	107.9150	7.938	4	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]ClH)2(CCHH)(H)	C(N[4]Ga[4]2H)(CC3)(H)2	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]ClH)2(CCHH)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CC3)(H)2	H(N[4]Ga[4]2C)	109.0360	0.000	1	109.0360	0.000	1	108.0030	2.134	2	107.9150	7.938	4	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:H-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]HH)2(CCHH)(H)	C(N[4]Ga[4]2H)(CC3)(H)2	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]HH)2(CCHH)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CC3)(H)2	H(N[4]Ga[4]2C)	106.9700	0.000	1	106.9700	0.000	1	108.0030	2.134	2	107.9150	7.938	4	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:4:4:	4:	B[4]-4:B[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:	N[4](B[4]N[4]HH)2(CC3)(H)	C(N[4]B[4]2H)(CH3)3	H(N[4]B[4]2C)	N[4](B[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]B[4]2H)(CH3)3	H(N[4]B[4]2C)	104.8750	0.000	1	104.8750	0.000	1	104.8750	0.000	1	104.7740	1.120	3	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:4:4:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:	N[4](Ga[4]N[4]Cl2)2(CC3)(H)	C(N[4]Ga[4]2H)(CH3)3	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]Cl2)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CH3)3	H(N[4]Ga[4]2C)	103.6690	0.000	1	103.6690	0.000	1	104.7235	2.224	2	104.7740	1.120	3	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	4:4:4:1:	4:4:4:4:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:	N[4](Ga[4]N[4]HH)2(CC3)(H)	C(N[4]Ga[4]2H)(CH3)3	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	C(N[4]Ga[4]2H)(CH3)3	H(N[4]Ga[4]2C)	105.7780	0.000	1	105.7780	0.000	1	104.7235	2.224	2	104.7740	1.120	3	106.7452	6.493	9	106.7452	6.493	9
980	490	951	0:SP3_SP-NON_SP3	N[4]	C	H	5:4:4:1:	4:4:4:4:	4:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	N[4]-4:C-4:C-4:C-4:	N[4]-4:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	H(N[4]Ga[3,3,4]Ga[4]C)	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	C(N[4]Ga[3,3,4]Ga[4]H)(CH3)3	H(N[4]Ga[3,3,4]Ga[4]C)	105.3630	0.000	1	105.3630	0.000	1	105.3630	0.000	1	105.3630	0.000	1	106.7452	6.493	9	106.7452	6.493	9
980	490	996	0:SP3_SP3_SP3	N[4,5]	C	Si[4,5]	4:4:3:4:	4:4:4:4:	4:4:3:2:	Si[4,5]-4:Si[4,5]-4:C[5]-3:C-4:	N[4,5]-4:C-4:C-4:C-4:	N[4,5]-4:N[4,5]-4:N[5]-3:N-2:	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3)	C(N[4,5]Si[4,5]2C[5])(CH3)3	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a])	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C(N[4,5]Si[4,5]2C[5])(CH3)3	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a]){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	121.9310	2.302	2	121.9310	5.301	2	121.9310	5.301	2	121.9310	5.301	2	121.9310	5.301	2	116.7108	8.791	10
980	490	996	0:SP3_SP3_SP3	N[4]	C	Si[4]	5:4:4:4:	4:1:1:1:	4:4:4:4:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]C[4]C[5]2Fe)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2	N[4](Ga[4]C[4]C[5]2Fe)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2{1|Fe<11>,2|C<4>}	115.4870	1.426	2	115.4870	2.032	2	115.4057	0.814	8	115.4057	0.814	8	115.4057	0.814	8	116.7108	8.791	10
980	490	996	0:SP3_SP3_SP3	N[4]	C	Si[4]	5:4:4:4:	4:1:1:1:	4:4:4:4:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]C[4]C[5]2Ru)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2	N[4](Ga[4]C[4]C[5]2Ru)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2{1|Ru<11>,2|C<4>}	115.5870	1.110	2	115.5870	1.232	2	115.4057	0.814	8	115.4057	0.814	8	115.4057	0.814	8	116.7108	8.791	10
980	490	996	0:SP3_SP3_SP3	N[4]	C	Si[4]	5:4:4:4:	4:1:1:1:	4:4:4:4:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]C[4]C[6]2Cr)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2	N[4](Ga[4]C[4]C[6]2Cr)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2{1|Cr<13>,2|C<4>}	115.3235	1.261	2	115.3235	1.590	2	115.4057	0.814	8	115.4057	0.814	8	115.4057	0.814	8	116.7108	8.791	10
980	490	996	0:SP3_SP3_SP3	N[4]	C	Si[4]	5:4:4:4:	4:1:1:1:	4:4:4:4:	Ga[4]-5:Si[4]-4:C-4:C-4:	N[4]-4:H-1:H-1:H-1:	C[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]C[4]C[6]2V)(Si[4]C[4]CC)(CH3)2	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2	N[4](Ga[4]C[4]C[6]2V)(Si[4]C[4]CC)(CH3)2{2|Si<4>,4|C<4>}	C(N[4]Ga[4]Si[4]C)(H)3	Si[4](C[4]Ga[4]Si2)(N[4]Ga[4]CC)(CH3)2{1|V<13>,2|C<4>}	115.2255	0.827	2	115.2255	0.683	2	115.4057	0.814	8	115.4057	0.814	8	115.4057	0.814	8	116.7108	8.791	10
980	643	694	0:SP3_SP2_SP2	N[4,4]	C[6a]	B[4]	3:3:3:3:	4:3:3:	4:3:3:	Ge[4,4]-3:Ge[4,4]-3:C[6a]-3:B[4]-3:	N[4,4]-4:C[6a]-3:C[6a]-3:	N[4,4]-4:N[4]-3:N-3:	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N)	C[6a](N[4,4]Ge[4,4]2B[4])(C[6a]C[6a]C)2	B[4](N[4,4]Ge[4,4]2C[6a])(N[4]Ge[4,4]C[6a])(NCC)	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N){1|B<3>,2|C<4>,5|C<3>}	C[6a](N[4,4]Ge[4,4]2B[4])(C[6a]C[6a]C)2{1|C<3>,1|N<4>,2|H<1>,3|N<3>}	B[4](N[4,4]Ge[4,4]2C[6a])(N[4]Ge[4,4]C[6a])(NCC){1|N<3>,1|N<4>,4|C<3>}	121.1250	0.000	1	121.1250	0.000	1	121.1250	0.000	1	121.1250	0.000	1	121.1250	0.000	1	121.1250	0.000	1
980	643	857	0:SP3_SP2_SP2	N[4,4]	C[6a]	Ge[4,4]	3:3:3:3:	4:3:3:	4:4:3:	Ge[4,4]-3:Ge[4,4]-3:C[6a]-3:B[4]-3:	N[4,4]-4:C[6a]-3:C[6a]-3:	N[4,4]-4:N[4,4]-4:N[4]-3:	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N)	C[6a](N[4,4]Ge[4,4]2B[4])(C[6a]C[6a]C)2	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4])	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N){1|B<3>,2|C<4>,5|C<3>}	C[6a](N[4,4]Ge[4,4]2B[4])(C[6a]C[6a]C)2{1|C<3>,1|N<4>,2|H<1>,3|N<3>}	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4]){3|N<3>,6|C<3>}	120.7545	2.193	2	120.7545	4.808	2	120.7545	4.808	2	120.7545	4.808	2	120.7545	4.808	2	120.7545	4.808	2
980	643	878	0:SP3_SP-NON_SP2	N[4,6,6]	C[6a]	Ga[4,6,6]	4:4:4:3:	4:3:3:	4:4:3:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,6]-4:C[6a]-3:	N[4,6,6]-4:C[6a]-3:C[6a]-3:	N[4,6,6]-4:N[4,6,6]-4:N[4,6]-3:C-4:	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2)	C[6a](N[4,6,6]Ga[4,6,6]2Ga[4,6])(C[6a]C[6a]H)2	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3)	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2){3|Ga<4>,2|H<1>,7|C<3>}	C[6a](N[4,6,6]Ga[4,6,6]2Ga[4,6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>,2|N<4>,3|C<4>,3|N<3>}	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3){1|N<4>,4|C<4>,4|N<3>,5|C<3>}	112.4220	3.383	2	112.4220	11.443	2	112.4220	11.443	2	112.4220	11.443	2	112.4220	11.443	2	114.3513	16.889	3
980	643	878	0:SP3_SP-NON_SP2	N[4,6,6]	C[6a]	Ga[4,6]	4:4:4:3:	4:3:3:	4:3:3:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,6]-4:C[6a]-3:	N[4,6,6]-4:C[6a]-3:C[6a]-3:	N[4,6,6]-4:N[4,6]-3:N[6]-3:C-4:	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2)	C[6a](N[4,6,6]Ga[4,6,6]2Ga[4,6])(C[6a]C[6a]H)2	Ga[4,6](N[4,6,6]Ga[4,6,6]2C[6a])(N[4,6]Ga[4,6,6]C[6])(N[6]C[6a]C[6])(CH3)	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2){3|Ga<4>,2|H<1>,7|C<3>}	C[6a](N[4,6,6]Ga[4,6,6]2Ga[4,6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>,2|N<4>,3|C<4>,3|N<3>}	Ga[4,6](N[4,6,6]Ga[4,6,6]2C[6a])(N[4,6]Ga[4,6,6]C[6])(N[6]C[6a]C[6])(CH3){2|C<4>,2|N<3>,2|N<4>,6|C<3>}	118.2100	0.000	1	118.2100	0.000	1	118.2100	0.000	1	118.2100	0.000	1	118.2100	0.000	1	114.3513	16.889	3
980	686	686	5:SP3_SPD5_SPD5	N[4,5,5]	Ge[4,5,5]	Ge[4,5,5]	5:5:4:4:	4:4:3:3:1:	4:4:3:3:1:	Ge[4,5,5]-5:Ge[4,5,5]-5:C[5]-4:C[5]-4:	N[4,5,5]-4:N[4,5,5]-4:N[5]-3:N[5]-3:Cl-1:	N[4,5,5]-4:N[4,5,5]-4:N[5]-3:N[5]-3:Cl-1:	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl)	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl)	N[4,5,5](Ge[4,5,5]N[4,5,5]N[5]2Cl)2(C[5]C[5]HH)2{4|Si<4>,4|C<4>,4|H<1>}	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl){12|H<1>,1|Cl<1>,2|C<4>,2|N<3>}	Ge[4,5,5](N[4,5,5]Ge[4,5,5]C[5]2)2(N[5]C[5]Si)2(Cl){12|H<1>,1|Cl<1>,2|C<4>,2|N<3>}	99.9958	0.000	1	99.9958	0.000	1	99.9958	0.000	1	99.9958	0.000	1	99.9958	0.000	1	99.9958	0.000	1
980	694	857	4:SP3_SP2_SP2	N[4,4]	B[4]	Ge[4,4]	3:3:3:3:	4:3:3:	4:4:3:	Ge[4,4]-3:Ge[4,4]-3:C[6a]-3:B[4]-3:	N[4,4]-4:N[4]-3:N-3:	N[4,4]-4:N[4,4]-4:N[4]-3:	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N)	B[4](N[4,4]Ge[4,4]2C[6a])(N[4]Ge[4,4]C[6a])(NCC)	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4])	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N){1|B<3>,2|C<4>,5|C<3>}	B[4](N[4,4]Ge[4,4]2C[6a])(N[4]Ge[4,4]C[6a])(NCC){1|N<3>,1|N<4>,4|C<3>}	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4]){3|N<3>,6|C<3>}	97.4081	14.678	2	97.4081	215.445	2	97.4081	215.445	2	97.4081	215.445	2	97.4081	215.445	2	97.4081	215.445	2
980	718	818	5:SP3_SP2_SPD5	N[4,5,5]	P[4,5,5]	C[5]	5:4:3:3:	4:3:2:2:2:	4:3:1:	P[4,5,5]-5:B[4,5a]-4:C[5]-3:C[5]-3:	N[4,5,5]-4:N[4]-3:O[5]-2:O[5]-2:O-2:	N[4,5,5]-4:C[5]-3:H-1:	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2	P[4,5,5](N[4,5,5]B[4,5a]C[5]2)(N[4]B[4,5a]C[6a])(O[5]C[5])2(OC)	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H)	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2{2|C<4>,3|C<3>}	P[4,5,5](N[4,5,5]B[4,5a]C[5]2)(N[4]B[4,5a]C[6a])(O[5]C[5])2(OC){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H){1|C<3>,1|H<1>,1|N<3>,4|O<2>}	105.9430	0.095	2	105.9430	0.009	2	105.9430	0.009	2	105.9430	0.009	2	105.9430	0.009	2	105.9430	0.009	2
980	742	742	4:SP3_SP3_SP3	N[4,5]	B[4]	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:N[4,5]-4:Br-1:Br-1:	N[4,5]-4:N[4,5]-4:Br-1:Br-1:	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2	B[4](N[4,5]B[4]C[5]2)2(Br)2	B[4](N[4,5]B[4]C[5]2)2(Br)2	N[4,5](B[4]N[4,5]Br2)2(C[5]C[5]HH)2{2|C<4>,4|H<1>}	B[4](N[4,5]B[4]C[5]2)2(Br)2{2|Br<1>,4|C<4>,8|H<1>}	B[4](N[4,5]B[4]C[5]2)2(Br)2{2|Br<1>,4|C<4>,8|H<1>}	86.8109	0.008	2	86.8109	0.000	2	86.8109	0.000	2	86.8109	0.000	2	86.8109	0.000	2	87.2685	0.312	13
980	742	742	4:SP3_SP3_SP3	N[4,6,6]	B[4,6,6]	B[4,6,6]	4:4:4:1:	4:4:4:1:	4:4:4:1:	B[4,6,6]-4:B[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H)	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H)	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H)	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H){1|C<4>,2|N<4>,6|H<1>}	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H){1|C<4>,2|B<4>,6|H<1>}	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H){1|C<4>,2|B<4>,6|H<1>}	87.5977	0.140	6	87.5977	0.020	6	87.5977	0.020	6	87.5977	0.020	6	87.5977	0.020	6	87.2685	0.312	13
980	742	742	4:SP3_SP3_SP3	N[4]	B[4]	B[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CC3)(H)	B[4](N[4]B[4]CH)2(H)2	B[4](N[4]B[4]CH)2(H)2	N[4](B[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	B[4](N[4]B[4]CH)2(H)2{2|H<1>}	B[4](N[4]B[4]CH)2(H)2{2|H<1>}	87.8817	0.000	1	87.8817	0.000	1	87.8817	0.000	1	87.8817	0.000	1	87.0565	0.587	5	87.2685	0.312	13
980	742	742	4:SP3_SP3_SP3	N[4]	B[4]	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:N[4]-4:Br-1:Br-1:	N[4]-4:N[4]-4:Br-1:Br-1:	N[4](B[4]N[4]Br2)2(CH3)2	B[4](N[4]B[4]CC)2(Br)2	B[4](N[4]B[4]CC)2(Br)2	N[4](B[4]N[4]Br2)2(CH3)2{2|C<4>}	B[4](N[4]B[4]CC)2(Br)2{2|Br<1>}	B[4](N[4]B[4]CC)2(Br)2{2|Br<1>}	87.6988	0.000	1	87.6988	0.000	1	87.6988	0.000	1	86.8502	0.499	4	87.0565	0.587	5	87.2685	0.312	13
980	742	742	4:SP3_SP3_SP3	N[4]	B[4]	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CCHH)2	B[4](N[4]B[4]CC)2(H)2	B[4](N[4]B[4]CC)2(H)2	N[4](B[4]N[4]HH)2(CCHH)2{2|C<4>}	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	87.1661	0.000	1	87.1661	0.000	1	86.5673	0.269	3	86.8502	0.499	4	87.0565	0.587	5	87.2685	0.312	13
980	742	742	4:SP3_SP3_SP3	N[4]	B[4]	B[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	B[4]-4:B[4]-4:C-4:C-4:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](B[4]N[4]HH)2(CH3)2	B[4](N[4]B[4]CC)2(H)2	B[4](N[4]B[4]CC)2(H)2	N[4](B[4]N[4]HH)2(CH3)2{2|C<4>}	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	B[4](N[4]B[4]CC)2(H)2{2|H<1>}	86.2679	0.000	2	86.2679	0.000	2	86.5673	0.269	3	86.8502	0.499	4	87.0565	0.587	5	87.2685	0.312	13
980	742	769	4:SP3_SP2_SP3	N[4]	B[4]	C[4,6a]	3:4:4:4:	3:4:1:1:	3:3:4:	C[4,6a]-3:B[4]-4:C-4:C-4:	C[4,6a]-3:N[4]-4:Cl-1:Cl-1:	C[4,6a]-3:C[6a]-3:N[4]-4:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(Cl)2	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC)	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]Cl2)(CH3)2{1|H<1>,2|C<3>}	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(Cl)2{1|H<1>,2|C<3>}	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC){2|Cl<1>,1|C<3>,2|H<1>}	83.4359	0.000	1	83.4359	0.000	1	83.4359	0.000	1	83.4359	0.000	1	83.6331	0.038	3	83.6331	0.038	3
980	742	769	4:SP3_SP2_SP3	N[4]	B[4]	C[4,6a]	3:4:4:4:	3:4:3:3:	3:3:4:	C[4,6a]-3:B[4]-4:C-4:C-4:	C[4,6a]-3:N[4]-4:C[6a]-3:C[6a]-3:	C[4,6a]-3:C[6a]-3:N[4]-4:	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(C[6a]C[6a]2)2	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC)	N[4](C[4,6a]C[4,6a]C[6a])(B[4]C[4,6a]C[6a]2)(CH3)2{1|H<1>,6|C<3>}	B[4](C[4,6a]C[4,6a]C[6a])(N[4]C[4,6a]CC)(C[6a]C[6a]2)2{1|H<1>,4|F<1>,6|C<3>}	C[4,6a](C[4,6a]C[6a]B[4])(C[6a]C[6a]H)(N[4]B[4]CC){2|H<1>,3|C<3>}	83.7317	0.131	2	83.7317	0.017	2	83.7317	0.017	2	83.7317	0.017	2	83.6331	0.038	3	83.6331	0.038	3
980	742	846	4:SP3_SP2_SP3	N[4,6]	B[4]	C[4,5]	3:4:4:4:	4:4:1:1:	4:4:3:	C[4,5]-3:B[4]-4:C[6]-4:C[6]-4:	C[4,5]-4:N[4,6]-4:F-1:F-1:	C[4,5]-4:N[4,6]-4:C[5]-3:	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2	B[4](C[4,5]C[4,5]C[5]N[6])(N[4,6]C[4,5]C[6]2)(F)2	C[4,5](C[4,5]B[4]C[5]N[6])(N[4,6]B[4]C[6]2)(C[5]B[5]N[6])	N[4,6](C[4,5]C[4,5]C[5])(B[4]C[4,5]FF)(C[6]C[6]HH)2{1|B<4>,1|C<3>,1|C<4>,2|N<3>,4|H<1>}	B[4](C[4,5]C[4,5]C[5]N[6])(N[4,6]C[4,5]C[6]2)(F)2{1|B<4>,1|C<3>,1|N<3>,4|C<4>,4|H<1>}	C[4,5](C[4,5]B[4]C[5]N[6])(N[4,6]B[4]C[6]2)(C[5]B[5]N[6]){1|N<3>,2|C<3>,2|F<1>,4|H<1>,6|C<4>}	84.0187	0.000	1	84.0187	0.000	1	84.0187	0.000	1	84.0187	0.000	1	84.0187	0.000	1	86.1818	3.534	3
980	742	846	4:SP3_SP2_SP3	N[4,6]	B[4]	C[4]	4:4:4:3:	4:3:3:1:	4:3:3:	B[4]-4:C[6]-4:C[6]-4:C[4]-3:	N[4,6]-4:C[4]-3:C[6a]-3:Cl-1:	N[4,6]-4:C[4]-3:B-3:	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B)	B[4](N[4,6]C[4]C[6]2)(C[4]C[4]N[6])(C[6a]C[6a]2)(Cl)	C[4](N[4,6]B[4]C[6]2)(C[4]B[4]N[6])(BC[6a]Cl)	N[4,6](B[4]C[6a]C[4]Cl)(C[6]C[6]HH)2(C[4]C[4]B){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	B[4](N[4,6]C[4]C[6]2)(C[4]C[4]N[6])(C[6a]C[6a]2)(Cl){1|B<3>,2|C<3>,4|H<1>,6|C<4>}	C[4](N[4,6]B[4]C[6]2)(C[4]B[4]N[6])(BC[6a]Cl){1|Cl<1>,1|C<3>,4|C<4>,4|H<1>}	87.2634	0.221	2	87.2634	0.049	2	87.2634	0.049	2	87.2634	0.049	2	87.2634	0.049	2	86.1818	3.534	3
980	742	951	0:SP3_SP-NON_SP3	N[4,6,6]	B[4,6,6]	H	4:4:4:1:	4:4:4:1:	4:	B[4,6,6]-4:B[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-4:C[6,6]-4:H-1:	N[4,6,6]-4:	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H)	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H)	H(N[4,6,6]B[4,6,6]2C[6,6])	N[4,6,6](B[4,6,6]N[4,6,6]C[6,6]H)2(C[6,6]B[4,6,6]HH)(H){1|C<4>,2|N<4>,6|H<1>}	B[4,6,6](N[4,6,6]B[4,6,6]C[6,6]H)2(C[6,6]N[4,6,6]HH)(H){1|C<4>,2|B<4>,6|H<1>}	H(N[4,6,6]B[4,6,6]2C[6,6])	112.8303	0.969	16	112.8303	0.938	16	112.8303	0.938	16	112.8303	0.938	16	112.8303	0.938	16	112.4897	1.866	18
980	742	951	0:SP3_SP-NON_SP3	N[4]	B[4]	H	4:4:4:1:	4:4:1:1:	4:	B[4]-4:B[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](B[4]N[4]HH)2(CC3)(H)	B[4](N[4]B[4]CH)2(H)2	H(N[4]B[4]2C)	N[4](B[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	B[4](N[4]B[4]CH)2(H)2{2|H<1>}	H(N[4]B[4]2C)	109.7650	0.972	2	109.7650	0.944	2	109.7650	0.944	2	109.7650	0.944	2	109.7650	0.944	2	112.4897	1.866	18
980	794	794	4:SP3_SPD5_SPD5	N[4,4,5,5]	C[4x4,6x5,6]	C[4x4,6x5,6]	5:5:4:4:	5:5:4:2:2:	5:5:4:2:2:	C[4x4,6x5,6]-5:C[4x4,6x5,6]-5:C-4:C-4:	C[4x4,5,5]-5:C[4x4,5,5]-5:N[4,4,5,5]-4:H[3x5,6]-2:H[3x5,6]-2:	C[4x4,5,5]-5:C[4x4,5,5]-5:N[4,4,5,5]-4:H[3x5,6]-2:H[3x5,6]-2:	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2	N[4,4,5,5](C[4x4,6x5,6]C[4x4,5,5]2H[3x5,6]2)2(CH3)2{1|N<5>,4|H<1>}	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2{1|H<1>,2|C<4>}	C[4x4,6x5,6](C[4x4,5,5]C[4x4,6x5,6]N[4,4]HH)2(N[4,4,5,5]C[4x4,6x5,6]CC)(H[3x5,6]H[3x5,6])2{1|H<1>,2|C<4>}	21.5167	0.000	1	21.5167	0.000	1	21.5167	0.000	1	21.5167	0.000	1	21.5167	0.000	1	21.5167	0.000	1
980	818	818	0:SP3_SP2_SP2	N[4,5,5]	C[5]	C[5]	5:4:3:3:	4:3:1:	4:3:1:	P[4,5,5]-5:B[4,5a]-4:C[5]-3:C[5]-3:	N[4,5,5]-4:C[5]-3:H-1:	N[4,5,5]-4:C[5]-3:H-1:	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H)	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H)	N[4,5,5](P[4,5,5]N[4]O[5]2O)(B[4,5a]O[5a]2N[4])(C[5]C[5]H)2{2|C<4>,3|C<3>}	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H){1|C<3>,1|H<1>,1|N<3>,4|O<2>}	C[5](N[4,5,5]P[4,5,5]B[4,5a]C[5])(C[5]O[5]C)(H){1|C<3>,1|H<1>,1|N<3>,4|O<2>}	115.4910	0.000	1	115.4910	0.000	1	115.4910	0.000	1	115.4910	0.000	1	115.4910	0.000	1	115.4910	0.000	1
980	818	878	0:SP3_SP-NON_SP2	N[4,5]	C[5]	Ga[4]	4:4:3:4:	4:3:1:	4:4:1:1:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:C[5]-3:H-1:	N[4,5]-4:N[4,5]-4:Cl-1:Cl-1:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H)	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H){2|Cl<1>,1|C<4>,1|N<3>,1|N<4>}	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2{2|C<3>,2|H<1>,2|N<3>}	106.5841	1.848	14	106.5841	3.415	14	106.5841	3.415	14	106.5841	3.415	14	106.5841	3.415	14	106.5841	3.415	14
980	818	878	5:SP3_SP-NON_SP2	N[4,5]	C[5]	Ga[4,5,5]	4:4:3:4:	4:3:1:	4:4:3:3:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:C[5]-3:H-1:	N[4,5]-4:N[4,5]-4:N[5]-3:N[5]-3:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H)	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C[5](N[4,5]Ga[4,5,5]Ga[4]C)(C[5]N[5]H)(H){2|Cl<1>,1|C<4>,1|N<3>,1|N<4>}	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2{2|Cl<1>,4|H<1>}	99.0599	1.028	14	99.0599	1.058	14	99.0599	1.058	14	99.0599	1.058	14	99.0599	1.058	14	99.7006	6.280	16
980	818	878	5:SP3_SP-NON_SP2	N[4,5]	C[5]	Ga[4,5]	4:4:4:3:	4:3:1:	4:4:3:1:	Ga[4,5]-4:Ga[4,5]-4:C[6]-4:C[5]-3:	N[4,5]-4:C[5]-3:H-1:	N[4,5]-4:N[4,5]-4:N[5]-3:Cl-1:	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H)	C[5](N[4,5]Ga[4,5]2C[6])(C[5]N[5]H)(H)	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl)	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H){2|C<3>,5|C<4>,5|H<1>}	C[5](N[4,5]Ga[4,5]2C[6])(C[5]N[5]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|N<4>,3|C<4>}	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl){1|Cl<1>,1|C<3>,1|N<3>,6|C<4>,6|H<1>}	104.1855	5.871	2	104.1855	34.470	2	104.1855	34.470	2	104.1855	34.470	2	104.1855	34.470	2	99.7006	6.280	16
980	818	996	5:SP3_SP2_SP3	N[4,5]	C[5]	Si[4,5]	4:4:3:4:	4:3:1:	4:4:3:2:	Si[4,5]-4:Si[4,5]-4:C[5]-3:C-4:	N[4,5]-4:C[5]-3:H-1:	N[4,5]-4:N[4,5]-4:N[5]-3:N-2:	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3)	C[5](N[4,5]Si[4,5]2C)(C[5]N[5]H)(H)	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a])	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	C[5](N[4,5]Si[4,5]2C)(C[5]N[5]H)(H){1|C<4>,1|N<3>,1|N<4>,2|N<2>}	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a]){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	100.6285	0.808	2	100.6285	0.653	2	100.6285	0.653	2	100.6285	0.653	2	100.6285	0.653	2	100.6285	0.653	2
980	856	878	0:SP3_SP-NON_SP3	N[4]	N[6]	Ga[4]	4:4:4:3:	4:4:4:	4:4:4:4:	C[6,6]-4:Ga[4]-4:Ga[4]-4:N[6]-3:	N[4]-4:C[6]-4:C[6]-4:	N[4]-4:N[4]-4:C-4:C-4:	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2)	N[6](N[4]C[6,6]Ga[4]2)(C[6]C[6]HH)2	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2){1|N<3>,6|H<1>,7|C<4>}	N[6](N[4]C[6,6]Ga[4]2)(C[6]C[6]HH)2{1|N<4>,5|H<1>,7|C<4>}	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2{10|C<4>,2|H<1>}	120.7669	2.070	8	120.7669	4.283	8	120.7669	4.283	8	120.7669	4.283	8	120.7669	4.283	8	120.7669	4.283	8
980	857	857	4:SP3_SP2_SP2	N[4,4]	Ge[4,4]	Ge[4,4]	3:3:3:3:	4:4:3:	4:4:3:	Ge[4,4]-3:Ge[4,4]-3:C[6a]-3:B[4]-3:	N[4,4]-4:N[4,4]-4:N[4]-3:	N[4,4]-4:N[4,4]-4:N[4]-3:	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N)	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4])	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4])	N[4,4](Ge[4,4]N[4,4]N[4])2(C[6a]C[6a]2)(B[4]N[4]N){1|B<3>,2|C<4>,5|C<3>}	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4]){3|N<3>,6|C<3>}	Ge[4,4](N[4,4]Ge[4,4]C[6a]B[4])2(N[4]C[6a]B[4]){3|N<3>,6|C<3>}	90.1613	0.000	1	90.1613	0.000	1	90.1613	0.000	1	90.1613	0.000	1	90.1613	0.000	1	95.2052	50.881	2
980	857	857	4:SP3_SP2_SP2	N[4]	Ge[4]	Ge[4]	3:3:1:1:	4:4:3:	4:4:3:	Ge[4]-3:Ge[4]-3:H-1:H-1:	N[4]-4:N[4]-4:C[6a]-3:	N[4]-4:N[4]-4:C[6a]-3:	N[4](Ge[4]C[6a]N[4])2(H)2	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2)	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2)	N[4](Ge[4]C[6a]N[4])2(H)2{2|H<1>,4|C<3>}	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2){5|C<3>}	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2){5|C<3>}	100.2490	0.000	1	100.2490	0.000	1	100.2490	0.000	1	100.2490	0.000	1	100.2490	0.000	1	95.2052	50.881	2
980	857	951	0:SP3_SP-NON_SP2	N[4]	Ge[4]	H	3:3:1:1:	4:4:3:	4:	Ge[4]-3:Ge[4]-3:H-1:H-1:	N[4]-4:N[4]-4:C[6a]-3:	N[4]-4:	N[4](Ge[4]C[6a]N[4])2(H)2	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2)	H(N[4]Ge[4]2H)	N[4](Ge[4]C[6a]N[4])2(H)2{2|H<1>,4|C<3>}	Ge[4](N[4]Ge[4]HH)2(C[6a]C[6a]2){5|C<3>}	H(N[4]Ge[4]2H)	112.6213	3.077	4	112.6213	9.469	4	112.6213	9.469	4	112.6213	9.469	4	112.6213	9.469	4	112.6213	9.469	4
980	878	878	4:SP3_SP-NON_SP-NON	N[4,5]	Ga[4,5,5]	Ga[4]	4:4:3:4:	4:4:3:3:	4:4:1:1:	Ga[4,5,5]-4:Ga[4]-4:C[5]-3:C-4:	N[4,5]-4:N[4,5]-4:N[5]-3:N[5]-3:	N[4,5]-4:N[4,5]-4:Cl-1:Cl-1:	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3)	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2	N[4,5](Ga[4,5,5]N[4,5]N[5]2)(Ga[4]N[4,5]Cl2)(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	Ga[4,5,5](N[4,5]Ga[4]C[5]C)2(N[5]C[5]C)2{2|Cl<1>,4|H<1>}	Ga[4](N[4,5]Ga[4,5,5]C[5]C)2(Cl)2{2|C<3>,2|H<1>,2|N<3>}	92.3726	0.620	14	92.3726	0.385	14	92.3726	0.385	14	92.3726	0.385	14	92.3726	0.385	14	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4,6]	Ga[4]	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C[6]-4:C[6]-4:	N[4,6]-4:N[4,6]-4:H-1:H-1:	N[4,6]-4:N[4,6]-4:H-1:H-1:	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2	N[4,6](Ga[4]N[4,6]HH)2(C[6]C[6]HH)2{3|C<4>,4|H<1>}	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2{10|H<1>,4|C<4>}	Ga[4](N[4,6]Ga[4]C[6]2)2(H)2{10|H<1>,4|C<4>}	91.2238	0.000	1	91.2238	0.000	1	91.2238	0.000	1	91.2238	0.000	1	91.2238	0.000	1	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:1:1:	4:4:3:1:	4:4:3:1:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:N[4]-4:C[6a]-3:H-1:	N[4]-4:N[4]-4:C[6a]-3:H-1:	N[4](Ga[4]C[6a]N[4]H)2(H)2	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H)	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H)	N[4](Ga[4]C[6a]N[4]H)2(H)2{2|H<1>,4|C<3>}	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H){1|H<1>,5|C<3>}	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H){1|H<1>,5|C<3>}	94.8138	0.000	1	94.8138	0.000	1	94.8138	0.000	1	94.8138	0.000	1	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:1:1:	4:4:3:4:	4:4:3:4:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:N[4]-4:N-3:C-4:	N[4]-4:N[4]-4:N-3:C-4:	N[4](Ga[4]N[4]CN)2(H)2	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3)	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3)	N[4](Ga[4]N[4]CN)2(H)2{2|H<1>}	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3){1|C<4>,1|N<3>}	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3){1|C<4>,1|N<3>}	94.5383	0.000	1	94.5383	0.000	1	94.5383	0.000	1	94.5383	0.000	1	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:3:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](Ga[4]N[4]HH)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(H)2	Ga[4](N[4]Ga[4]HN)2(H)2	N[4](Ga[4]N[4]HH)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(H)2{2|H<1>}	Ga[4](N[4]Ga[4]HN)2(H)2{2|H<1>}	92.8416	1.097	2	92.8416	1.204	2	92.8416	1.204	2	92.8416	1.204	2	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:3:1:	4:4:3:3:	4:4:3:3:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:N-3:N-3:	N[4]-4:N[4]-4:N-3:N-3:	N[4](Ga[4]N[4]NN)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN)	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN)	N[4](Ga[4]N[4]NN)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN){2|N<3>}	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN){2|N<3>}	95.2373	1.825	2	95.2373	3.332	2	95.2373	3.332	2	95.2373	3.332	2	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:3:1:	4:4:4:4:	4:4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]CC)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(CH3)2	Ga[4](N[4]Ga[4]HN)2(CH3)2	N[4](Ga[4]N[4]CC)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CH3)2{2|C<4>}	Ga[4](N[4]Ga[4]HN)2(CH3)2{2|C<4>}	93.4536	0.000	1	93.4536	0.000	1	96.7170	11.826	3	96.7170	11.826	3	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:3:1:	4:4:4:4:	4:4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]CC)2(NCH)(H)	Ga[4](N[4]Ga[4]HN)2(CC3)2	Ga[4](N[4]Ga[4]HN)2(CC3)2	N[4](Ga[4]N[4]CC)2(NCH)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CC3)2{2|C<4>}	Ga[4](N[4]Ga[4]HN)2(CC3)2{2|C<4>}	98.3487	2.771	2	98.3487	7.678	2	96.7170	11.826	3	96.7170	11.826	3	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[4]N[4]Cl2)2(CC3)(H)	Ga[4](N[4]Ga[4]CH)2(Cl)2	Ga[4](N[4]Ga[4]CH)2(Cl)2	N[4](Ga[4]N[4]Cl2)2(CC3)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)2{2|Cl<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)2{2|Cl<1>}	93.2040	0.000	1	93.2040	0.000	1	93.2040	0.000	1	92.8672	5.480	5	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:Cl-1:H-1:	N[4]-4:N[4]-4:Cl-1:H-1:	N[4](Ga[4]N[4]ClH)2(CCHH)(H)	Ga[4](N[4]Ga[4]CH)2(Cl)(H)	Ga[4](N[4]Ga[4]CH)2(Cl)(H)	N[4](Ga[4]N[4]ClH)2(CCHH)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)(H){1|Cl<1>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)(H){1|Cl<1>,1|H<1>}	96.5108	0.000	1	96.5108	0.000	1	96.5108	0.000	1	92.8672	5.480	5	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](Ga[4]N[4]HH)2(CC3)(H)	Ga[4](N[4]Ga[4]CH)2(H)2	Ga[4](N[4]Ga[4]CH)2(H)2	N[4](Ga[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	92.8129	0.000	1	92.8129	0.000	1	92.1783	0.805	2	92.8672	5.480	5	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4](Ga[4]N[4]HH)2(CCHH)(H)	Ga[4](N[4]Ga[4]CH)2(H)2	Ga[4](N[4]Ga[4]CH)2(H)2	N[4](Ga[4]N[4]HH)2(CCHH)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	91.5437	0.000	1	91.5437	0.000	1	92.1783	0.805	2	92.8672	5.480	5	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:1:	4:4:1:1:	4:4:1:1:	Ga[4]-4:Ga[4]-4:Si-4:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H)	Ga[4](N[4]Ga[4]SiH)2(Cl)2	Ga[4](N[4]Ga[4]SiH)2(Cl)2	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H){1|Si<4>,1|H<1>}	Ga[4](N[4]Ga[4]SiH)2(Cl)2{2|Cl<1>}	Ga[4](N[4]Ga[4]SiH)2(Cl)2{2|Cl<1>}	90.2644	0.000	1	90.2644	0.000	1	90.2644	0.000	1	92.8672	5.480	5	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:3:	4:4:4:4:	4:4:4:4:	C[6,6]-4:Ga[4]-4:Ga[4]-4:N[6]-3:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:N[4]-4:C-4:C-4:	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2)	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2	N[4](C[6,6]C[3x6]2H)(Ga[4]N[4]CC)2(N[6]C[6]2){1|N<3>,6|H<1>,7|C<4>}	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2{10|C<4>,2|H<1>}	Ga[4](N[4]C[6,6]Ga[4]N[6])2(CH3)2{10|C<4>,2|H<1>}	86.8259	0.106	4	86.8259	0.011	4	86.8259	0.011	4	86.8259	0.011	4	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:4:	4:4:1:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:N[4]-4:C-4:Cl-1:	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2	Ga[4](N[4]Ga[4]CC)2(Cl)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl)	N[4](Ga[4]N[4]Cl2)(Ga[4]N[4]ClC)(CCHH)2{2|C<4>}	Ga[4](N[4]Ga[4]CC)2(Cl)2{1|Cl<1>,1|C<4>}	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl){2|Cl<1>}	90.4898	0.293	2	90.4898	0.086	2	90.4898	0.086	2	90.4898	0.086	2	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:4:	4:4:4:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:N[4]-4:C-4:Cl-1:	N[4]-4:N[4]-4:C-4:Cl-1:	N[4](Ga[4]N[4]ClC)2(CCHH)2	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl)	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl)	N[4](Ga[4]N[4]ClC)2(CCHH)2{2|C<4>}	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl){1|Cl<1>,1|C<4>}	Ga[4](N[4]Ga[4]CC)2(CC3)(Cl){1|Cl<1>,1|C<4>}	91.1937	0.000	1	91.1937	0.000	1	91.1937	0.000	1	91.1998	0.000	2	92.3036	12.780	22	92.3005	7.628	37
980	878	878	4:SP3_SP-NON_SP-NON	N[4]	Ga[4]	Ga[4]	4:4:4:4:	4:4:4:1:	4:4:4:1:	Ga[4]-4:Ga[4]-4:C-4:C-4:	N[4]-4:N[4]-4:C-4:H-1:	N[4]-4:N[4]-4:C-4:H-1:	N[4](Ga[4]N[4]CH)2(CCHH)2	Ga[4](N[4]Ga[4]CC)2(CC3)(H)	Ga[4](N[4]Ga[4]CC)2(CC3)(H)	N[4](Ga[4]N[4]CH)2(CCHH)2{2|C<4>}	Ga[4](N[4]Ga[4]CC)2(CC3)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CC)2(CC3)(H){1|C<4>,1|H<1>}	91.2060	0.000	1	91.2060	0.000	1	91.2060	0.000	1	91.1998	0.000	2	92.3036	12.780	22	92.3005	7.628	37
980	878	878	5:SP3_SP-NON_SP-NON	N[4,5]	Ga[4,5]	Ga[4,5]	4:4:4:3:	4:4:3:1:	4:4:3:1:	Ga[4,5]-4:Ga[4,5]-4:C[6]-4:C[5]-3:	N[4,5]-4:N[4,5]-4:N[5]-3:Cl-1:	N[4,5]-4:N[4,5]-4:N[5]-3:Cl-1:	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H)	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl)	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl)	N[4,5](Ga[4,5]N[4,5]N[5]Cl)2(C[6]C[6]2H)(C[5]C[5]H){2|C<3>,5|C<4>,5|H<1>}	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl){1|Cl<1>,1|C<3>,1|N<3>,6|C<4>,6|H<1>}	Ga[4,5](N[4,5]Ga[4,5]C[5]C[6])2(N[5]C[5]C[6])(Cl){1|Cl<1>,1|C<3>,1|N<3>,6|C<4>,6|H<1>}	92.2371	0.000	1	92.2371	0.000	1	92.2371	0.000	1	92.2371	0.000	1	92.2371	0.000	1	92.2371	0.000	1
980	878	878	6:SP3_SP-NON_SP-NON	N[4,4,6]	Ga[4,4,6]	Ga[4,4,6]	4:4:4:1:	4:4:3:4:	4:4:3:4:	Ga[4,4,6]-4:Ga[4,4,6]-4:Ga[4,6,6]-4:H-1:	N[4,4,6]-4:N[4,4,6]-4:N[4,6,6]-3:C-4:	N[4,4,6]-4:N[4,4,6]-4:N[4,6,6]-3:C-4:	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3)	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H){4|Ga<4>,2|H<1>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3){2|N<3>,2|N<4>,4|C<4>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3){2|N<3>,2|N<4>,4|C<4>}	90.0578	0.000	1	90.0578	0.000	1	90.0578	0.000	1	90.0578	0.000	1	90.0578	0.000	1	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,4,6]	Ga[4,6,6]	Ga[4,4,6]	4:4:4:1:	4:3:4:4:	4:4:3:4:	Ga[4,4,6]-4:Ga[4,4,6]-4:Ga[4,6,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-4:C-4:	N[4,4,6]-4:N[4,4,6]-4:N[4,6,6]-3:C-4:	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3)	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H){4|Ga<4>,2|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3){2|N<4>,3|N<3>,5|C<4>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3){2|N<3>,2|N<4>,4|C<4>}	107.8762	24.422	2	107.8762	596.423	2	107.8762	596.423	2	107.8762	596.423	2	107.8762	596.423	2	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	Ga[4,4,6]	4:4:4:1:	4:3:3:4:	3:3:4:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-3:C-4:	N[4,4,6]-3:N[4,4,6]-3:N[4,6,6]-4:C-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3){2|N<3>,3|N<4>,5|C<4>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3){2|N<3>,2|N<4>,4|C<4>}	91.5954	0.000	1	91.5954	0.000	1	91.5954	0.000	1	91.5954	0.000	1	107.1842	486.021	2	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	Ga[4,4,6]	4:4:4:1:	4:3:4:4:	3:3:4:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-4:C-4:	N[4,4,6]-3:N[4,4,6]-3:N[4,6,6]-4:C-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3){2|N<4>,3|N<3>,5|C<4>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3){2|N<3>,2|N<4>,4|C<4>}	122.7730	0.000	1	122.7730	0.000	1	122.7730	0.000	1	122.7730	0.000	1	107.1842	486.021	2	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	Ga[4,6,6]	4:4:4:1:	4:3:4:4:	4:3:3:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-4:C-4:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-3:C-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3){2|N<4>,3|N<3>,5|C<4>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3){2|N<3>,3|N<4>,5|C<4>}	123.8520	0.000	1	123.8520	0.000	1	123.8520	0.000	1	123.8520	0.000	1	121.2045	14.019	2	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	Ga[4,6,6]	4:4:4:3:	4:4:3:4:	4:4:3:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,6]-4:C[6a]-3:	N[4,6,6]-4:N[4,6,6]-4:N[4,6]-3:C-4:	N[4,6,6]-4:N[4,6,6]-4:N[4,6]-3:C-4:	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2)	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3)	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3)	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2){3|Ga<4>,2|H<1>,7|C<3>}	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3){1|N<4>,4|C<4>,4|N<3>,5|C<3>}	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3){1|N<4>,4|C<4>,4|N<3>,5|C<3>}	118.5570	0.000	1	118.5570	0.000	1	118.5570	0.000	1	118.5570	0.000	1	121.2045	14.019	2	106.2586	259.090	9
980	878	878	6:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6]	Ga[4,6,6]	4:4:4:3:	4:3:3:4:	4:4:3:4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,6]-4:C[6a]-3:	N[4,6,6]-4:N[4,6]-3:N[6]-3:C-4:	N[4,6,6]-4:N[4,6,6]-4:N[4,6]-3:C-4:	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2)	Ga[4,6](N[4,6,6]Ga[4,6,6]2C[6a])(N[4,6]Ga[4,6,6]C[6])(N[6]C[6a]C[6])(CH3)	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3)	N[4,6,6](Ga[4,6,6]N[4,6,6]N[4,6]C)2(Ga[4,6]N[4,6]N[6]C)(C[6a]C[6a]2){3|Ga<4>,2|H<1>,7|C<3>}	Ga[4,6](N[4,6,6]Ga[4,6,6]2C[6a])(N[4,6]Ga[4,6,6]C[6])(N[6]C[6a]C[6])(CH3){2|C<4>,2|N<3>,2|N<4>,6|C<3>}	Ga[4,6,6](N[4,6,6]Ga[4,6,6]Ga[4,6]C[6a])2(N[4,6]Ga[4,6]C[6])(CH3){1|N<4>,4|C<4>,4|N<3>,5|C<3>}	96.8701	9.154	2	96.8701	83.797	2	96.8701	83.797	2	96.8701	83.797	2	96.8701	83.797	2	106.2586	259.090	9
980	878	880	0:SP3_SP-NON_SP3	N[4]	Ga[4]	Si	4:4:4:1:	4:4:1:1:	4:3:4:4:	Ga[4]-4:Ga[4]-4:Si-4:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:C[6a]-3:C-4:C-4:	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H)	Ga[4](N[4]Ga[4]SiH)2(Cl)2	Si(N[4]Ga[4]2H)(C[6a]C[6a]2)(CH3)2	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H){1|Si<4>,1|H<1>}	Ga[4](N[4]Ga[4]SiH)2(Cl)2{2|Cl<1>}	Si(N[4]Ga[4]2H)(C[6a]C[6a]2)(CH3)2	123.6675	5.073	2	123.6675	25.740	2	123.6675	25.740	2	123.6675	25.740	2	123.6675	25.740	2	123.6675	25.740	2
980	878	951	0:SP3_SP-NON_SP-NON	N[4,4,6]	Ga[4,4,6]	H	4:4:4:1:	4:4:3:4:	4:	Ga[4,4,6]-4:Ga[4,4,6]-4:Ga[4,6,6]-4:H-1:	N[4,4,6]-4:N[4,4,6]-4:N[4,6,6]-3:C-4:	N[4,4,6]-4:	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3)	H(N[4,4,6]Ga[4,4,6]2Ga[4,6,6])	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H){4|Ga<4>,2|H<1>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6]H)2(N[4,6,6]Ga[4,6,6]2)(CC3){2|N<3>,2|N<4>,4|C<4>}	H(N[4,4,6]Ga[4,4,6]2Ga[4,6,6])	115.6660	2.185	2	115.6660	4.774	2	115.6660	4.774	2	115.6660	4.774	2	115.6660	4.774	2	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4,4,6]	Ga[4,6,6]	H	4:4:4:1:	4:3:4:4:	4:	Ga[4,4,6]-4:Ga[4,4,6]-4:Ga[4,6,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-4:C-4:	N[4,4,6]-4:	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3)	H(N[4,4,6]Ga[4,4,6]2Ga[4,6,6])	N[4,4,6](Ga[4,4,6]N[4,4,6]N[4,6,6]C)2(Ga[4,6,6]N[4,6,6]2C)(H){4|Ga<4>,2|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3){2|N<4>,3|N<3>,5|C<4>}	H(N[4,4,6]Ga[4,4,6]2Ga[4,6,6])	113.9070	0.000	1	113.9070	0.000	1	113.9070	0.000	1	113.9070	0.000	1	113.9070	0.000	1	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,4,6]	H	4:4:4:1:	3:3:4:4:	4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,4,6]-3:N[4,4,6]-3:N[4,6,6]-4:C-4:	N[4,6,6]-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3)	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,4,6](N[4,4,6]Ga[4,4,6]Ga[4,6,6])2(N[4,6,6]Ga[4,6,6]2H)(CC3){2|N<3>,2|N<4>,4|C<4>}	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	101.9640	0.000	1	101.9640	0.000	1	101.9640	0.000	1	101.9640	0.000	1	101.9640	0.000	1	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	H	4:4:4:1:	4:3:3:4:	4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-3:C-4:	N[4,6,6]-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3)	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2)(CC3){2|N<3>,3|N<4>,5|C<4>}	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	107.1640	0.000	1	107.1640	0.000	1	107.1640	0.000	1	107.1640	0.000	1	106.9770	0.070	2	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4,6,6]	Ga[4,6,6]	H	4:4:4:1:	4:3:4:4:	4:	Ga[4,6,6]-4:Ga[4,6,6]-4:Ga[4,4,6]-4:H-1:	N[4,6,6]-4:N[4,6,6]-3:N[4,4,6]-4:C-4:	N[4,6,6]-4:	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H)	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3)	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	N[4,6,6](Ga[4,6,6]N[4,4,6]N[4,6,6]C)2(Ga[4,4,6]N[4,4,6]2C)(H){5|Ga<4>,1|H<1>}	Ga[4,6,6](N[4,6,6]Ga[4,4,6]Ga[4,6,6]H)(N[4,6,6]Ga[4,4,6]Ga[4,6,6])(N[4,4,6]Ga[4,4,6]2H)(CC3){2|N<4>,3|N<3>,5|C<4>}	H(N[4,6,6]Ga[4,4,6]Ga[4,6,6]2)	106.7900	0.000	1	106.7900	0.000	1	106.7900	0.000	1	106.7900	0.000	1	106.9770	0.070	2	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:1:1:	4:4:3:1:	4:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:N[4]-4:C[6a]-3:H-1:	N[4]-4:	N[4](Ga[4]C[6a]N[4]H)2(H)2	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H)	H(N[4]Ga[4]2H)	N[4](Ga[4]C[6a]N[4]H)2(H)2{2|H<1>,4|C<3>}	Ga[4](N[4]Ga[4]HH)2(C[6a]C[6a]2)(H){1|H<1>,5|C<3>}	H(N[4]Ga[4]2H)	115.1352	0.338	4	115.1352	0.114	4	115.1352	0.114	4	115.1352	0.114	4	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:1:1:	4:4:3:4:	4:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:N[4]-4:N-3:C-4:	N[4]-4:	N[4](Ga[4]N[4]CN)2(H)2	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3)	H(N[4]Ga[4]2H)	N[4](Ga[4]N[4]CN)2(H)2{2|H<1>}	Ga[4](N[4]Ga[4]HH)2(NSi2)(CH3){1|C<4>,1|N<3>}	H(N[4]Ga[4]2H)	112.8153	0.034	4	112.8153	0.001	4	112.8153	0.001	4	112.8153	0.001	4	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:3:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]HH)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(H)2	H(N[4]Ga[4]2N)	N[4](Ga[4]N[4]HH)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(H)2{2|H<1>}	H(N[4]Ga[4]2N)	110.5315	6.832	4	110.5315	46.681	4	110.5315	46.681	4	110.5315	46.681	4	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:3:1:	4:4:3:3:	4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:N-3:N-3:	N[4]-4:	N[4](Ga[4]N[4]NN)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN)	H(N[4]Ga[4]2N)	N[4](Ga[4]N[4]NN)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN){2|N<3>}	H(N[4]Ga[4]2N)	105.9073	0.822	4	105.9073	0.675	4	105.9073	0.675	4	105.9073	0.675	4	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:3:1:	4:4:4:4:	4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:	N[4](Ga[4]N[4]CC)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(CH3)2	H(N[4]Ga[4]2N)	N[4](Ga[4]N[4]CC)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CH3)2{2|C<4>}	H(N[4]Ga[4]2N)	108.8520	2.015	2	108.8520	4.061	2	115.5205	56.838	6	115.5205	56.838	6	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:3:1:	4:4:4:4:	4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:	N[4](Ga[4]N[4]CC)2(NCH)(H)	Ga[4](N[4]Ga[4]HN)2(CC3)2	H(N[4]Ga[4]2N)	N[4](Ga[4]N[4]CC)2(NCH)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CC3)2{2|C<4>}	H(N[4]Ga[4]2N)	118.8547	6.993	4	118.8547	48.907	4	115.5205	56.838	6	115.5205	56.838	6	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:	N[4](Ga[4]N[4]Cl2)2(CC3)(H)	Ga[4](N[4]Ga[4]CH)2(Cl)2	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]Cl2)2(CC3)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)2{2|Cl<1>}	H(N[4]Ga[4]2C)	103.6055	0.029	2	103.6055	0.001	2	103.6055	0.001	2	107.5485	13.783	10	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:Cl-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]ClH)2(CCHH)(H)	Ga[4](N[4]Ga[4]CH)2(Cl)(H)	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]ClH)2(CCHH)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(Cl)(H){1|Cl<1>,1|H<1>}	H(N[4]Ga[4]2C)	108.8235	4.593	2	108.8235	21.093	2	108.8235	21.093	2	107.5485	13.783	10	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]HH)2(CC3)(H)	Ga[4](N[4]Ga[4]CH)2(H)2	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]HH)2(CC3)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	H(N[4]Ga[4]2C)	105.7080	0.007	2	105.7080	0.000	2	108.4075	12.603	4	107.5485	13.783	10	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:C-4:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:	N[4](Ga[4]N[4]HH)2(CCHH)(H)	Ga[4](N[4]Ga[4]CH)2(H)2	H(N[4]Ga[4]2C)	N[4](Ga[4]N[4]HH)2(CCHH)(H){1|C<4>,1|H<1>}	Ga[4](N[4]Ga[4]CH)2(H)2{2|H<1>}	H(N[4]Ga[4]2C)	111.1070	2.943	2	111.1070	8.661	2	108.4075	12.603	4	107.5485	13.783	10	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	4:4:4:1:	4:4:1:1:	4:	Ga[4]-4:Ga[4]-4:Si-4:H-1:	N[4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H)	Ga[4](N[4]Ga[4]SiH)2(Cl)2	H(N[4]Ga[4]2Si)	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H){1|Si<4>,1|H<1>}	Ga[4](N[4]Ga[4]SiH)2(Cl)2{2|Cl<1>}	H(N[4]Ga[4]2Si)	108.4985	5.103	2	108.4985	26.043	2	108.4985	26.043	2	107.5485	13.783	10	110.6499	31.477	33	110.5796	30.928	39
980	878	951	0:SP3_SP-NON_SP-NON	N[4]	Ga[4]	H	5:4:4:1:	4:4:1:1:	4:	Ga[3,3,4]-5:Ga[4]-4:C-4:H-1:	N[3,4]-4:N[4]-4:Cl-1:Cl-1:	N[4]-4:	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H)	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2	H(N[4]Ga[3,3,4]Ga[4]C)	N[4](Ga[3,3,4]B[3,3]N[3,4]N[3]Cl)(Ga[4]N[3,4]Cl2)(CC3)(H){1|C<3>,2|C<4>}	Ga[4](N[3,4]Ga[3,3,4]B[3,3]C)(N[4]Ga[3,3,4]CH)(Cl)2{1|Cl<1>,1|C<3>,1|N<3>}	H(N[4]Ga[3,3,4]Ga[4]C)	105.2810	0.000	1	105.2810	0.000	1	105.2810	0.000	1	105.2810	0.000	1	110.6499	31.477	33	110.5796	30.928	39
980	878	956	0:SP3_SP-NON_SP3	N[4]	Ga[4]	N	4:4:3:1:	4:4:1:1:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:H-1:H-1:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]HH)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(H)2	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]HH)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(H)2{2|H<1>}	N(N[4]Ga[4]2H)(CH3)2	115.7312	2.028	4	115.7312	4.112	4	115.7312	4.112	4	115.7312	4.112	4	117.7884	6.865	14	117.7884	6.865	14
980	878	956	0:SP3_SP-NON_SP3	N[4]	Ga[4]	N	4:4:3:1:	4:4:3:3:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:N-3:N-3:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]NN)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN)	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]NN)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(NGa[4]N)(NHN){2|N<3>}	N(N[4]Ga[4]2H)(CH3)2	121.1030	0.817	4	121.1030	0.668	4	121.1030	0.668	4	121.1030	0.668	4	117.7884	6.865	14	117.7884	6.865	14
980	878	956	0:SP3_SP-NON_SP3	N[4]	Ga[4]	N	4:4:3:1:	4:4:4:4:	4:4:1:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:C-4:H-1:	N[4](Ga[4]N[4]CC)2(NCH)(H)	Ga[4](N[4]Ga[4]HN)2(CC3)2	N(N[4]Ga[4]2H)(CH3)(H)	N[4](Ga[4]N[4]CC)2(NCH)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CC3)2{2|C<4>}	N(N[4]Ga[4]2H)(CH3)(H)	116.4502	1.385	4	116.4502	1.917	4	116.4502	1.917	4	116.4502	1.917	4	117.7884	6.865	14	117.7884	6.865	14
980	878	956	0:SP3_SP-NON_SP3	N[4]	Ga[4]	N	4:4:3:1:	4:4:4:4:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:N[4]-4:C-4:C-4:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]CC)2(NCC)(H)	Ga[4](N[4]Ga[4]HN)2(CH3)2	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]CC)2(NCC)(H){1|H<1>,1|N<3>}	Ga[4](N[4]Ga[4]HN)2(CH3)2{2|C<4>}	N(N[4]Ga[4]2H)(CH3)2	117.9495	1.030	2	117.9495	1.061	2	117.9495	1.061	2	117.9495	1.061	2	117.7884	6.865	14	117.7884	6.865	14
980	878	996	4:SP3_SP-NON_SP3	N[4,5]	Ga[4]	Si[4]	4:4:4:4:	4:3:4:1:	4:3:3:2:	Ga[4]-4:Si[4]-4:C[5]-4:C[5]-4:	N[4,5]-4:C[4]-3:C-4:H-1:	N[4,5]-4:C[4]-3:C-3:C-2:	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2	Ga[4](N[4,5]Si[4]C[5]2)(C[4]Si[4]C)(CC3)(H)	Si[4](N[4,5]Ga[4]C[5]2)(C[4]Ga[4]C)(CGaC)(CC)	N[4,5](Ga[4]C[4]CH)(Si[4]C[4]CC)(C[5]C[5]HH)2{1|C<3>,4|H<1>}	Ga[4](N[4,5]Si[4]C[5]2)(C[4]Si[4]C)(CC3)(H){1|C<2>,1|C<3>,2|C<4>,4|H<1>}	Si[4](N[4,5]Ga[4]C[5]2)(C[4]Ga[4]C)(CGaC)(CC){3|C<4>,5|H<1>}	87.5097	0.000	1	87.5097	0.000	1	87.5097	0.000	1	87.5097	0.000	1	87.5097	0.000	1	87.5097	0.000	1
980	880	951	0:SP3_SP-NON_SP3	N[4]	Si	H	4:4:4:1:	4:3:4:4:	4:	Ga[4]-4:Ga[4]-4:Si-4:H-1:	N[4]-4:C[6a]-3:C-4:C-4:	N[4]-4:	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H)	Si(N[4]Ga[4]2H)(C[6a]C[6a]2)(CH3)2	H(N[4]Ga[4]2Si)	N[4](Ga[4]N[4]Cl2)2(SiC[6a]CC)(H){1|Si<4>,1|H<1>}	Si(N[4]Ga[4]2H)(C[6a]C[6a]2)(CH3)2	H(N[4]Ga[4]2Si)	100.9440	0.000	1	100.9440	0.000	1	100.9440	0.000	1	100.9440	0.000	1	100.9440	0.000	1	100.9440	0.000	1
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	3:3:1:1:	4:	4:	Ge[4]-3:Ge[4]-3:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](Ge[4]C[6a]N[4])2(H)2	H(N[4]Ge[4]2H)	H(N[4]Ge[4]2H)	N[4](Ge[4]C[6a]N[4])2(H)2{2|H<1>,4|C<3>}	H(N[4]Ge[4]2H)	H(N[4]Ge[4]2H)	106.0830	0.000	1	106.0830	0.000	1	106.0830	0.000	1	106.0830	0.000	1	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[4]CH)(C[4]C[4]HH)(H)2{2|H<1>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	110.9140	0.000	1	110.9140	0.000	1	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{1|C<4>,1|H<1>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	111.0463	2.329	4	110.8264	1.847	10	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{1|F<1>,1|H<1>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	110.5350	0.000	1	110.8264	1.847	10	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{2|F<1>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	110.7113	0.052	3	110.8264	1.847	10	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[4]HH)2(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[4]HH)2(H)2{2|N<3>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	110.7050	0.004	2	110.8264	1.847	10	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	C[4]-4:C[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](C[4]C[6a]C[4]H)2(H)2	H(N[4]C[4]2H)	H(N[4]C[4]2H)	N[4](C[4]C[6a]C[4]H)2(H)2{1|H<1>,5|C<3>}	H(N[4]C[4]2H)	H(N[4]C[4]2H)	109.6320	0.000	1	109.6320	0.000	1	110.7342	1.632	12	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](Ga[4]C[6a]N[4]H)2(H)2	H(N[4]Ga[4]2H)	H(N[4]Ga[4]2H)	N[4](Ga[4]C[6a]N[4]H)2(H)2{2|H<1>,4|C<3>}	H(N[4]Ga[4]2H)	H(N[4]Ga[4]2H)	102.2510	0.000	1	102.2510	0.000	1	106.2745	32.377	2	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	951	0:SP3_SP-NON_SP-NON	N[4]	H	H	4:4:1:1:	4:	4:	Ga[4]-4:Ga[4]-4:H-1:H-1:	N[4]-4:	N[4]-4:	N[4](Ga[4]N[4]CN)2(H)2	H(N[4]Ga[4]2H)	H(N[4]Ga[4]2H)	N[4](Ga[4]N[4]CN)2(H)2{2|H<1>}	H(N[4]Ga[4]2H)	H(N[4]Ga[4]2H)	110.2980	0.000	1	110.2980	0.000	1	106.2745	32.377	2	110.0971	6.494	14	109.8295	7.105	15	109.8295	7.105	15
980	951	956	0:SP3_SP-NON_SP3	N[4]	H	N	4:4:3:1:	4:	4:4:1:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:	N[4]-4:C-4:H-1:	N[4](Ga[4]N[4]CC)2(NCH)(H)	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)(H)	N[4](Ga[4]N[4]CC)2(NCH)(H){1|H<1>,1|N<3>}	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)(H)	88.1591	16.629	2	88.1591	276.529	2	88.1591	276.529	2	88.1591	276.529	2	102.3803	146.236	7	102.3803	146.236	7
980	951	956	0:SP3_SP-NON_SP3	N[4]	H	N	4:4:3:1:	4:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]CC)2(NCC)(H)	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]CC)2(NCC)(H){1|H<1>,1|N<3>}	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	108.7480	0.000	1	108.7480	0.000	1	108.0688	8.652	5	108.0688	8.652	5	102.3803	146.236	7	102.3803	146.236	7
980	951	956	0:SP3_SP-NON_SP3	N[4]	H	N	4:4:3:1:	4:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]HH)2(NCC)(H)	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]HH)2(NCC)(H){1|H<1>,1|N<3>}	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	109.8580	4.209	2	109.8580	17.713	2	108.0688	8.652	5	108.0688	8.652	5	102.3803	146.236	7	102.3803	146.236	7
980	951	956	0:SP3_SP-NON_SP3	N[4]	H	N	4:4:3:1:	4:	4:4:4:	Ga[4]-4:Ga[4]-4:N-3:H-1:	N[4]-4:	N[4]-4:C-4:C-4:	N[4](Ga[4]N[4]NN)2(NCC)(H)	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	N[4](Ga[4]N[4]NN)2(NCC)(H){1|H<1>,1|N<3>}	H(N[4]Ga[4]2N)	N(N[4]Ga[4]2H)(CH3)2	105.9400	0.984	2	105.9400	0.969	2	108.0688	8.652	5	108.0688	8.652	5	102.3803	146.236	7	102.3803	146.236	7
980	996	996	5:SP3_SP3_SP3	N[4,5]	Si[4,5]	Si[4,5]	4:4:3:4:	4:4:3:2:	4:4:3:2:	Si[4,5]-4:Si[4,5]-4:C[5]-3:C-4:	N[4,5]-4:N[4,5]-4:N[5]-3:N-2:	N[4,5]-4:N[4,5]-4:N[5]-3:N-2:	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3)	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a])	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a])	N[4,5](Si[4,5]N[4,5]N[5]N)2(C[5]C[5]H)(CC3){1|H<1>,2|C<3>,3|C<4>}	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a]){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	Si[4,5](N[4,5]Si[4,5]C[5]C)2(N[5]C[5]C)(NB[5a]){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	97.6967	0.000	1	97.6967	0.000	1	97.6967	0.000	1	97.6967	0.000	1	97.6967	0.000	1	97.6967	0.000	1
981	27	27	3:SP3_SPD6_SPD6	B[3,4a,6a]	B[4x3,4a,5]	B[4x3,5,6a]	6:6:4:1:	6:6:6:5:4:1:	6:6:6:4:5:1:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[4x3,5,6a]-6:B[4x3,5,6a]-6:B[5x3,6a]-6:B[3,3,4a,6a]-5:B[3,4a,6a]-4:H-1:	B[4x3,4a,5]-6:B[5x3,6a]-6:B[3x3,5]-6:B[3,4a,6a]-4:B[3]-5:H-1:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H)	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H)	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H){1|Rh<10>,2|C<4>,2|H<2>,3|H<1>}	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H){2|C<4>,2|H<2>,3|H<1>}	57.7335	0.000	1	57.7335	0.000	1	57.7335	0.000	1	57.7335	0.000	1	57.7335	0.000	1	57.7335	0.000	1
981	27	623	4:SP3_SP3_SPD6	B[3,4a,6a]	B[4x3,4a,5]	N[4a,6a]	6:6:4:1:	6:6:6:5:4:1:	5:4:4:4:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[4x3,5,6a]-6:B[4x3,5,6a]-6:B[5x3,6a]-6:B[3,3,4a,6a]-5:B[3,4a,6a]-4:H-1:	B[3,3,4a,6a]-5:B[3,4a,6a]-4:C-4:C-4:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H)	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H){1|Rh<10>,2|C<4>,2|H<2>,3|H<1>}	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2{1|B<5>,3|B<6>,3|H<1>}	99.6015	0.000	1	99.6015	0.000	1	99.6015	0.000	1	99.6015	0.000	1	99.6015	0.000	1	99.6015	0.000	1
981	27	623	6:SP3_SP3_SPD6	B[3,4a,6a]	B[4x3,5,6a]	N[4a,6a]	6:6:4:1:	6:6:6:4:5:1:	5:4:4:4:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[4x3,4a,5]-6:B[5x3,6a]-6:B[3x3,5]-6:B[3,4a,6a]-4:B[3]-5:H-1:	B[3,3,4a,6a]-5:B[3,4a,6a]-4:C-4:C-4:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H)	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H){2|C<4>,2|H<2>,3|H<1>}	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2{1|B<5>,3|B<6>,3|H<1>}	141.1910	0.000	1	141.1910	0.000	1	141.1910	0.000	1	141.1910	0.000	1	141.1910	0.000	1	141.1910	0.000	1
981	27	778	3:SP3_SPD5_SPD6	B[3,5,6,6,6a,6a]	B[4x3,5,5,6,6,6a,6a]	C[3x3,5,5,6,6]	6:5:4:1:	6:5:6:4:5:1:	6:5:6:4:1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[5x3,5,6,6,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6a]-6:B[3,5,6,6,6a,6a]-4:B[3x3,5,6]-5:H-1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6,6,6a]-6:B[3,5,6,6,6a,6a]-4:H-1:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H)	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H)	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H){1|B<4>,1|C<4>,4|H<1>}	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H){1|B<5>,1|C<4>,1|H<2>,5|H<1>}	56.9848	0.197	2	56.9848	0.039	2	56.9848	0.039	2	56.9848	0.039	2	56.9848	0.039	2	56.9848	0.039	2
981	27	951	0:SP3_SP-NON_SPD6	B[3,4a,6a]	B[4x3,4a,5]	H	6:6:4:1:	6:6:6:5:4:1:	4:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[4x3,5,6a]-6:B[4x3,5,6a]-6:B[5x3,6a]-6:B[3,3,4a,6a]-5:B[3,4a,6a]-4:H-1:	B[3,4a,6a]-4:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H)	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	B[4x3,4a,5](B[4x3,5,6a]B[3,3,4a,6a]B[5x3,6a]B[3,3,5]H[3]H)(B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]B[3x3,5]B[3]H)(B[5x3,6a]B[4x3,5,6a]2B[3,3,5]B[3x3,5]H)(B[3,3,4a,6a]B[4x3,5,6a]N[4a,6a]H[3]H)(B[3,4a,6a]B[4x3,5,6a]N[4a,6a]H)(H){1|Rh<10>,2|C<4>,2|H<2>,3|H<1>}	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	116.3130	0.000	1	116.3130	0.000	1	116.3130	0.000	1	116.3130	0.000	1	116.3130	0.000	1	112.3505	8.256	4
981	27	951	0:SP3_SP-NON_SPD6	B[3,4a,6a]	B[4x3,5,6a]	H	6:6:4:1:	6:6:6:4:5:1:	4:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[4x3,4a,5]-6:B[5x3,6a]-6:B[3x3,5]-6:B[3,4a,6a]-4:B[3]-5:H-1:	B[3,4a,6a]-4:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H)	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	B[4x3,5,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]B[3,4a,6a]B[5x3,6a]H)(B[5x3,6a]B[4x3,4a,5]B[4x3,5,6a]B[3,3,5]B[3x3,5]H)(B[3x3,5]B[5x3,6a]B[3,3,5]B[3]RhH)(B[3,4a,6a]B[4x3,4a,5]N[4a,6a]H)(B[3]B[3x3,5]RhHH)(H){2|C<4>,2|H<2>,3|H<1>}	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	110.9410	0.000	1	110.9410	0.000	1	110.9410	0.000	1	110.9410	0.000	1	110.9410	0.000	1	112.3505	8.256	4
981	27	951	0:SP3_SP-NON_SPD6	B[3,5,6,6,6a,6a]	B[4x3,5,5,6,6,6a,6a]	H	6:5:4:1:	6:5:6:4:5:1:	4:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[5x3,5,6,6,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6a]-6:B[3,5,6,6,6a,6a]-4:B[3x3,5,6]-5:H-1:	B[3,5,6,6,6a,6a]-4:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H)	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H){1|B<4>,1|C<4>,4|H<1>}	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	111.0740	1.954	2	111.0740	3.820	2	111.0740	3.820	2	111.0740	3.820	2	111.0740	3.820	2	112.3505	8.256	4
981	27	998	6:SP3_SP3_SPD6	B[3,5,6,6,6a,6a]	B[4x3,5,5,6,6,6a,6a]	N[5,6,6,6a,6a]	6:5:4:1:	6:5:6:4:5:1:	4:4:4:1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[5x3,5,6,6,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6a]-6:B[3,5,6,6,6a,6a]-4:B[3x3,5,6]-5:H-1:	B[3,5,6,6,6a,6a]-4:B[3,5,6,6,6a,6a]-4:C-4:H-1:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H)	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H)	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	B[4x3,5,5,6,6,6a,6a](B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]2B[5x3,5,6a]H)(C[3x3,5,5,6,6]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(B[5x3,5,6a]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[3x3,5,6]2H)(B[3,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a]H)(B[3x3,5,6]B[5x3,5,6a]B[3x3,5,6]H[3]H)(H){1|B<4>,1|C<4>,4|H<1>}	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H){2|B<5>,2|B<6>,4|H<1>}	130.6610	0.233	2	130.6610	0.054	2	130.6610	0.054	2	130.6610	0.054	2	130.6610	0.054	2	130.6610	0.054	2
981	623	951	0:SP3_SP-NON_SP3	B[3,4a,6a]	N[4a,6a]	H	6:6:4:1:	5:4:4:4:	4:	B[4x3,4a,5]-6:B[4x3,5,6a]-6:N[4a,6a]-4:H-1:	B[3,3,4a,6a]-5:B[3,4a,6a]-4:C-4:C-4:	B[3,4a,6a]-4:	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H)	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	B[3,4a,6a](B[4x3,4a,5]B[3,3,4a,6a]B[4x3,5,6a]2B[5x3,6a]H)(B[4x3,5,6a]B[4x3,4a,5]B[5x3,6a]B[3x3,5]B[3]H)(N[4a,6a]B[3,3,4a,6a]CC)(H){1|Rh<10>,1|B<6>,2|H<2>,5|H<1>}	N[4a,6a](B[3,3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H[3]H)(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]H)(CCHH)2{1|B<5>,3|B<6>,3|H<1>}	H(B[3,4a,6a]B[4x3,4a,5]B[4x3,5,6a]N[4a,6a])	107.3940	0.000	1	107.3940	0.000	1	107.3940	0.000	1	107.3940	0.000	1	107.3940	0.000	1	107.3940	0.000	1
981	643	818	0:SP3_SP2_SP2	B[3a]	C[6a]	C[5]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2{2|H<1>,2|N<3>,3|C<3>}	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2{2|H<1>,4|C<3>}	114.9720	0.000	1	114.9720	0.000	1	114.9720	0.000	1	114.9720	0.000	1	114.9720	0.000	1	114.9720	0.000	1
981	643	853	0:SP3_SP2_SP2	B[3a]	C[6a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2{2|H<1>,2|N<3>,3|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,2|N<3>,6|C<3>}	124.9680	0.000	1	121.7105	21.223	2	121.7105	21.223	2	124.4230	17.423	4	124.4230	17.423	4	124.4230	17.423	4
981	643	853	0:SP3_SP2_SP2	B[3a]	C[6a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[6a](B[3a]C[3a]2C[5])(C[6a]C[6a]C)2{2|H<1>,2|N<3>,3|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,2|N<3>,6|C<3>}	118.4530	0.000	1	121.7105	21.223	2	121.7105	21.223	2	124.4230	17.423	4	124.4230	17.423	4	124.4230	17.423	4
981	643	853	0:SP3_SP2_SP2	B[3a]	C[6a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	126.2370	0.000	1	127.1355	1.615	2	127.1355	1.615	2	124.4230	17.423	4	124.4230	17.423	4	124.4230	17.423	4
981	643	853	0:SP3_SP2_SP2	B[3a]	C[6a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	128.0340	0.000	1	127.1355	1.615	2	127.1355	1.615	2	124.4230	17.423	4	124.4230	17.423	4	124.4230	17.423	4
981	643	856	0:SP3_SP2_SP2	B[3a]	C[6a]	N[6]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[6a]-3:C[6a]-3:	B[3a]-4:C[6]-3:C[6]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[6a](B[3a]C[3a]2N[6])(C[6a]C[6a]C)2{2|H<1>,5|C<3>}	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2{2|H<1>,5|C<3>}	109.2960	0.000	1	109.2960	0.000	1	109.2960	0.000	1	109.2960	0.000	1	109.2960	0.000	1	109.2960	0.000	1
981	778	951	0:SP3_SP-NON_SPD5	B[3,5,6,6,6a,6a]	C[3x3,5,5,6,6]	H	6:5:4:1:	6:5:6:4:1:	4:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6,6,6a]-6:B[3,5,6,6,6a,6a]-4:H-1:	B[3,5,6,6,6a,6a]-4:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H)	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H){1|B<5>,1|C<4>,1|H<2>,5|H<1>}	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	119.3270	0.925	2	119.3270	0.855	2	119.3270	0.855	2	119.3270	0.855	2	119.3270	0.855	2	119.3270	0.855	2
981	778	998	6:SP3_SP3_SPD5	B[3,5,6,6,6a,6a]	C[3x3,5,5,6,6]	N[5,6,6,6a,6a]	6:5:4:1:	6:5:6:4:1:	4:4:4:1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:B[5x3,5,6,6,6a]-6:B[3,5,6,6,6a,6a]-4:H-1:	B[3,5,6,6,6a,6a]-4:B[3,5,6,6,6a,6a]-4:C-4:H-1:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H)	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H)	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	C[3x3,5,5,6,6](B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[3,5,6,6,6a,6a]B[5x3,5,6,6,6a]H)(B[5x3,5,6,6,6a]B[4x3,5,5,6,6,6a,6a]2C[3x3,5,5,6,6]B[5x3,5,6a]H)(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]N[5,6,6,6a,6a]H)(H){1|B<5>,1|C<4>,1|H<2>,5|H<1>}	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H){2|B<5>,2|B<6>,4|H<1>}	102.2590	0.349	2	102.2590	0.122	2	102.2590	0.122	2	102.2590	0.122	2	102.2590	0.122	2	102.2590	0.122	2
981	818	818	0:SP3_SP2_SP2	B[3a]	C[5]	C[5]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2{4|C<3>,4|C<4>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|C<4>,2|N<3>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|C<4>,2|N<3>}	112.5440	0.000	1	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2
981	818	818	0:SP3_SP2_SP2	B[3a]	C[5]	C[5]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2{4|C<3>,4|C<4>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|H<1>,2|N<3>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|H<1>,2|N<3>}	113.9640	0.000	1	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2	113.2540	1.008	2
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN)	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{2|B<3>,2|H<1>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN){2|N<3>}	117.3590	0.668	2	117.3590	0.446	2	116.5332	4.187	4	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN)	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|B<3>,1|C<3>,2|H<1>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN){2|C<3>,2|N<3>}	117.8740	0.000	1	117.8740	0.000	1	116.5332	4.187	4	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN)	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|Si<4>,1|B<3>,2|H<1>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN){2|N<3>}	113.5410	0.000	1	113.5410	0.000	1	116.5332	4.187	4	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|B<3>,1|C<3>,2|H<1>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>}	115.8110	0.000	1	115.8110	0.000	1	115.8110	0.000	1	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2{2|H<1>,4|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,2|N<3>,6|C<3>}	115.3170	0.000	1	116.9560	5.373	2	116.9560	5.373	2	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[5](B[3a]C[3a]2C[6a])(N[5]C[5]C)2{2|H<1>,4|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,2|N<3>,6|C<3>}	118.5950	0.000	1	116.9560	5.373	2	116.9560	5.373	2	116.5509	3.135	7	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:4:	C[3a]-3:C[3a]-3:C[5]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3)	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2{4|C<3>,4|C<4>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|C<4>,2|N<3>}	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3){4|N<3>}	120.2578	3.566	4	120.0463	10.327	8	120.0463	10.327	8	119.9291	9.159	9	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:4:	C[3a]-3:C[3a]-3:C[5]-3:C[5]-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3)	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2{4|C<3>,4|C<4>}	C[5](B[3a]C[3a]2C[5])(N[5]C[5]C)2{2|Si<4>,2|H<1>,2|N<3>}	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3){4|N<3>}	119.8347	3.356	4	120.0463	10.327	8	120.0463	10.327	8	119.9291	9.159	9	118.4511	9.135	16	118.4511	9.135	16
981	818	853	0:SP3_SP2_SP2	B[3a]	C[5]	C[3a]	3:3:3:3:	4:3:3:	4:3:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3)	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|Si<4>,1|B<3>,2|H<1>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3){2|N<3>}	118.9920	0.000	1	118.9920	0.000	1	118.9920	0.000	1	119.9291	9.159	9	118.4511	9.135	16	118.4511	9.135	16
981	818	956	0:SP3_SP2_SP2	B[3a]	C[5]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{2|B<3>,2|H<1>}	N(B[3a]C[3a]2C[5])(SiC3)2	110.5240	0.000	1	110.5240	0.000	1	110.5240	0.000	1	110.5240	0.000	1	110.5240	0.000	1	110.5240	0.000	1
981	818	956	0:SP3_SP2_SP3	B[3a]	C[5]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|B<3>,1|C<3>,2|H<1>}	N(B[3a]C[3a]2C[5])(SiC3)2	110.7730	0.000	1	110.7730	0.000	1	111.3585	0.686	2	111.3585	0.686	2	111.3585	0.686	2	111.3585	0.686	2
981	818	956	0:SP3_SP2_SP3	B[3a]	C[5]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:N[5]-3:N[5]-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[5](B[3a]C[3a]2N)(N[5]C[5]C)2{1|Si<4>,1|B<3>,2|H<1>}	N(B[3a]C[3a]2C[5])(SiC3)2	111.9440	0.000	1	111.9440	0.000	1	111.3585	0.686	2	111.3585	0.686	2	111.3585	0.686	2	111.3585	0.686	2
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:B-3:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN)	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN){2|N<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN){2|N<3>}	49.8937	0.000	1	49.8937	0.000	1	49.8937	0.000	1	49.3523	0.503	4	49.1847	0.451	7	49.1847	0.451	7
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN)	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN){2|C<3>,2|N<3>}	49.2387	0.000	1	49.2387	0.000	1	49.2387	0.000	1	49.3523	0.503	4	49.1847	0.451	7	49.1847	0.451	7
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:C[5]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2)	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(C[5]N[5]2){4|C<4>,8|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,2|N<3>,6|C<3>}	C[3a](B[3a]C[3a]C[6a]C[5])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,2|N<3>,6|C<3>}	48.3931	0.000	1	48.3931	0.000	1	48.3931	0.000	1	49.3523	0.503	4	49.1847	0.451	7	49.1847	0.451	7
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	49.8836	0.000	1	49.8836	0.000	1	49.8836	0.000	1	49.3523	0.503	4	49.1847	0.451	7	49.1847	0.451	7
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:4:	4:3:3:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a]-4:C[3a]-3:B-3:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN)	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3){2|N<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN){2|N<3>}	49.7387	0.000	1	49.7387	0.000	1	49.7387	0.000	1	49.7387	0.000	1	49.1847	0.451	7	49.1847	0.451	7
981	853	853	3:SP3_SP2_SP2	B[3a]	C[3a]	C[3a]	3:3:3:3:	4:3:4:	4:3:4:	C[3a]-3:C[3a]-3:C[5]-3:C[5]-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a]-4:C[3a]-3:Si-4:	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3)	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3)	B[3a](C[3a]C[3a]Si)2(C[5]N[5]2)2{4|C<3>,4|C<4>}	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3){4|N<3>}	C[3a](B[3a]C[3a]C[5]2)(C[3a]B[3a]Si)(SiC3){4|N<3>}	48.5725	0.165	2	48.5725	0.027	2	48.5725	0.027	2	48.5725	0.027	2	49.1847	0.451	7	49.1847	0.451	7
981	853	856	0:SP3_SP2_SP2	B[3a]	C[3a]	N[6]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:C[6]-3:C[6]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|C<4>,8|C<3>}	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2{2|H<1>,5|C<3>}	116.0620	0.000	1	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2
981	853	856	0:SP3_SP2_SP2	B[3a]	C[3a]	N[6]	3:3:3:3:	4:3:3:	4:3:3:	C[3a]-3:C[3a]-3:C[6a]-3:N[6]-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:C[6]-3:C[6]-3:	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2)	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2)	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2	B[3a](C[3a]C[3a]C[6a])2(C[6a]C[6a]2)(N[6]C[6]2){2|C<4>,2|H<1>,8|C<3>}	C[3a](B[3a]C[3a]C[6a]N[6])(C[3a]B[3a]C[6a])(C[6a]C[6a]2){2|H<1>,8|C<3>}	N[6](B[3a]C[3a]2C[6a])(C[6]C[6]H)2{2|H<1>,5|C<3>}	115.9840	0.000	1	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2	116.0230	0.003	2
981	853	956	0:SP3_SP2_SP2	B[3a]	C[3a]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:B-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN)	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]B)2(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(BNN){2|N<3>}	N(B[3a]C[3a]2C[5])(SiC3)2	124.7900	0.522	2	124.7900	0.272	2	124.7900	0.272	2	124.7900	0.272	2	124.7900	0.272	2	124.7900	0.272	2
981	853	956	0:SP3_SP2_SP3	B[3a]	C[3a]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:B-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN)	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]C[6a])(BNN){2|C<3>,2|N<3>}	N(B[3a]C[3a]2C[5])(SiC3)2	123.9210	0.000	1	123.9210	0.000	1	125.0955	2.759	2	125.6183	2.200	3	124.9980	3.006	4	124.9980	3.006	4
981	853	956	0:SP3_SP2_SP3	B[3a]	C[3a]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:B-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN)	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]Si)(BNN){2|N<3>}	N(B[3a]C[3a]2C[5])(SiC3)2	126.2700	0.000	1	126.2700	0.000	1	125.0955	2.759	2	125.6183	2.200	3	124.9980	3.006	4	124.9980	3.006	4
981	853	956	0:SP3_SP2_SP3	B[3a]	C[3a]	N	3:3:3:3:	4:3:3:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:C[6a]-3:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2)	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]C[6a])(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<4>,4|C<3>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(C[6a]C[6a]2){2|C<3>,2|H<1>,2|N<3>}	N(B[3a]C[3a]2C[5])(SiC3)2	126.6640	0.000	1	126.6640	0.000	1	126.6640	0.000	1	125.6183	2.200	3	124.9980	3.006	4	124.9980	3.006	4
981	853	956	0:SP3_SP2_SP3	B[3a]	C[3a]	N	3:3:3:3:	4:3:4:	4:4:4:	C[3a]-3:C[3a]-3:C[5]-3:N-3:	B[3a]-4:C[3a]-3:Si-4:	B[3a]-4:Si-4:Si-4:	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2)	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3)	N(B[3a]C[3a]2C[5])(SiC3)2	B[3a](C[3a]C[3a]Si)(C[3a]C[3a]B)(C[5]N[5]2)(NSi2){2|C<3>,2|C<4>}	C[3a](B[3a]C[3a]C[5]N)(C[3a]B[3a]B)(SiC3){2|N<3>}	N(B[3a]C[3a]2C[5])(SiC3)2	123.1370	0.000	1	123.1370	0.000	1	123.1370	0.000	1	123.1370	0.000	1	124.9980	3.006	4	124.9980	3.006	4
981	951	998	0:SP3_SP-NON_SP3	B[3,5,6,6,6a,6a]	H	N[5,6,6,6a,6a]	6:5:4:1:	4:	4:4:4:1:	B[4x3,5,5,6,6,6a,6a]-6:C[3x3,5,5,6,6]-5:N[5,6,6,6a,6a]-4:H-1:	B[3,5,6,6,6a,6a]-4:	B[3,5,6,6,6a,6a]-4:B[3,5,6,6,6a,6a]-4:C-4:H-1:	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H)	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H)	B[3,5,6,6,6a,6a](B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]B[5x3,5,6a]B[3x3,5,6]H)(C[3x3,5,5,6,6]B[4x3,5,5,6,6,6a,6a]B[5x3,5,6,6,6a]C[3x3,5,5,6,6]H)(N[5,6,6,6a,6a]B[3,5,6,6,6a,6a]CH)(H){1|B<5>,1|B<6>,1|H<2>,5|H<1>}	H(B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]N[5,6,6,6a,6a])	N[5,6,6,6a,6a](B[3,5,6,6,6a,6a]B[4x3,5,5,6,6,6a,6a]C[3x3,5,5,6,6]H)2(CC3)(H){2|B<5>,2|B<6>,4|H<1>}	117.6820	2.048	2	117.6820	4.193	2	117.6820	4.193	2	117.6820	4.193	2	117.6820	4.193	2	117.6820	4.193	2
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,4]	N[3]	N[3]	5:3:3:3:4:	5:4:3:	5:4:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|C<4>,2|N<3>,5|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|C<4>,2|N<3>,5|C<3>}	76.4129	0.012	2	76.4129	0.000	2	76.4129	0.000	2	76.4129	0.000	2	76.7903	0.220	4	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,4]	N[3]	N[3]	5:3:3:4:2:	5:4:3:	5:4:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	76.9549	0.000	1	76.9549	0.000	1	76.9549	0.000	1	76.9549	0.000	1	76.7903	0.220	4	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,4]	N[3]	N[3]	5:3:3:4:4:	5:4:3:	5:4:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,1|O<2>,2|N<3>,3|C<4>,4|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,1|O<2>,2|N<3>,3|C<4>,4|C<3>}	77.3803	0.000	1	77.3803	0.000	1	77.3803	0.000	1	77.3803	0.000	1	76.7903	0.220	4	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	N[3]	3:3:3:3:4:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:N[5]-3:N[5]-3:B[3,3]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N)	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N){2|H<1>,8|C<3>}	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,7|C<3>}	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,7|C<3>}	76.0791	0.108	2	76.0791	0.012	2	76.0791	0.012	2	76.0791	0.012	2	75.9576	0.418	6	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	N[3]	3:3:3:4:3:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){1|B<3>,1|C<2>,1|N<3>,2|C<4>,4|C<3>}	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){1|B<3>,1|C<2>,1|N<3>,2|C<4>,4|C<3>}	75.1975	0.261	2	75.1975	0.068	2	75.1975	0.068	2	75.1975	0.068	2	75.9576	0.418	6	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	N[3]	3:3:4:4:4:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:B[3,3]-4:C[5]-4:C[5]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2{2|C<4>,4|C<3>}	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,4|H<1>,5|C<3>}	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,4|H<1>,5|C<3>}	76.5961	0.085	2	76.5961	0.007	2	76.5961	0.007	2	76.5961	0.007	2	75.9576	0.418	6	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3]	N[3]	N[3]	3:3:4:1:1:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:B[3,3]-4:I-1:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	77.8760	0.000	1	77.8760	0.000	1	77.8760	0.000	1	77.8760	0.000	1	77.3971	0.192	3	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3]	N[3]	N[3]	3:3:4:4:1:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	77.2991	0.000	1	77.2991	0.000	1	77.2991	0.000	1	77.2991	0.000	1	77.3971	0.192	3	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3,3]	N[3]	N[3]	3:3:4:4:2:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	77.0162	0.000	1	77.0162	0.000	1	77.0162	0.000	1	77.0162	0.000	1	77.3971	0.192	3	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP2	Ge[3x3]	N[3]	N[3]	5:3:3:3:4:	5:4:3:	5:4:3:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:B[3,3]-4:C[6a]-3:	Ge[3x3]-5:B[3,3]-4:C[6a]-3:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	76.2965	0.009	2	76.2965	0.000	2	76.2965	0.000	2	76.2965	0.000	2	76.2965	0.000	2	76.5127	0.552	15
982	138	138	0:SPD5_SP2_SP3	Ge[3,3]	N[3]	N[3]	3:3:4:2:2:	5:4:3:	5:4:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	77.0313	0.000	1	77.0313	0.000	1	77.0313	0.000	1	77.0313	0.000	1	77.0313	0.000	1	117.9755	539.309	5
982	138	138	0:SPD5_SP2_SP3	Ge[3x3]	N[3]	N[3]	5:3:3:3:4:	5:4:3:	5:5:4:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:B[3,3]-4:C[6a]-3:	Ge[3x3]-5:Ge[3x3]-5:C[3x6]-4:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3){2|N<3>,3|C<4>,4|C<3>,6|H<1>}	128.2115	4.535	4	128.2115	20.568	4	128.2115	20.568	4	128.2115	20.568	4	128.2115	20.568	4	117.9755	539.309	5
982	138	226	0:SPD5_SP2_SP3	Ge[3,3,4]	N[3]	O[4]	5:3:3:4:2:	5:4:3:	5:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:C[4]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C){1|B<4>,3|N<3>,4|C<3>}	113.6175	3.296	2	113.6175	10.862	2	113.6175	10.862	2	113.6175	10.862	2	113.6175	10.862	2	113.6175	10.862	2
982	138	474	0:SPD5_SP2_SP3	Ge[3,3,5]	N[3]	C[5]	3:3:4:4:4:	5:4:3:	5:3:1:1:	N[3]-3:N[3]-3:B[3,3]-4:C[5]-4:C[5]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:C[5]-3:H-1:H-1:	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2{2|C<4>,4|C<3>}	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,4|H<1>,5|C<3>}	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	122.5174	3.968	8	122.5174	15.742	8	122.5174	15.742	8	122.5174	15.742	8	122.5174	15.742	8	122.5174	15.742	8
982	138	478	0:SPD5_SP2_SP3	Ge[3,3,4]	N[3]	C[4]	5:3:3:4:4:	5:4:3:	5:2:3:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:O[4]-2:C[6a]-3:C-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,1|O<2>,2|N<3>,3|C<4>,4|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3){1|B<4>,2|H<1>,3|N<3>,4|C<3>}	127.5485	3.823	2	127.5485	14.618	2	127.5485	14.618	2	127.5485	14.618	2	127.5485	14.618	2	127.5485	14.618	2
982	138	490	0:SPD5_SP2_SP3	Ge[3,3]	N[3]	C	3:3:4:4:1:	5:4:3:	5:1:1:1:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:H-1:H-1:H-1:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	C(Ge[3,3]B[3,3]N[3]2I)(H)3	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	C(Ge[3,3]B[3,3]N[3]2I)(H)3	123.0130	1.991	2	123.0130	3.965	2	123.0130	3.965	2	123.0130	3.965	2	123.8978	2.814	4	123.8978	2.814	4
982	138	490	0:SPD5_SP2_SP3	Ge[3,3]	N[3]	C	3:3:4:4:2:	5:4:3:	5:4:4:4:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:C-4:C-4:C-4:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	124.7825	1.160	2	124.7825	1.346	2	124.7825	1.346	2	124.7825	1.346	2	123.8978	2.814	4	123.8978	2.814	4
982	138	542	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	N[5]	3:3:3:3:4:	5:4:3:	5:3:3:	N[3]-3:N[3]-3:N[5]-3:N[5]-3:B[3,3]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:C[6a]-3:C[5]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N)	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N){2|H<1>,8|C<3>}	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,7|C<3>}	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,1|N<3>,2|C<4>,5|C<3>}	124.2229	7.002	8	124.2229	49.032	8	124.2229	49.032	8	124.2229	49.032	8	121.6435	46.374	12	121.6435	46.374	12
982	138	542	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	N[5]	3:3:3:4:3:	5:4:3:	5:3:3:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:C[6a]-3:B[5]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){1|B<3>,1|C<2>,1|N<3>,2|C<4>,4|C<3>}	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N){1|C<2>,1|N<3>,2|C<4>,5|C<3>}	116.4847	1.551	4	116.4847	2.404	4	116.4847	2.404	4	116.4847	2.404	4	121.6435	46.374	12	121.6435	46.374	12
982	138	654	0:SPD5_SP3_SP3	Ge[3x3]	N[3]	B[3,3]	5:3:3:3:4:	5:5:4:	5:3:3:3:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:Ge[3x3]-5:C[3x6]-4:	Ge[3x3]-5:N[3]-3:N[3]-3:N-3:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3)	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3){2|N<3>,3|C<4>,4|C<3>,6|H<1>}	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	145.4030	3.963	2	145.4030	15.702	2	145.4030	15.702	2	145.4030	15.702	2	145.4030	15.702	2	145.4030	15.702	2
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,4]	N[3]	B[3,3]	5:3:3:3:4:	5:4:3:	5:3:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|C<4>,2|N<3>,5|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,2|N<3>,6|C<3>}	38.2360	0.089	4	38.2360	0.008	4	38.2360	0.008	4	38.2360	0.008	4	38.4200	0.088	8	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,4]	N[3]	B[3,3]	5:3:3:4:2:	5:4:3:	5:3:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	38.4821	0.025	2	38.4821	0.001	2	38.4821	0.001	2	38.4821	0.001	2	38.4200	0.088	8	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,4]	N[3]	B[3,3]	5:3:3:4:4:	5:4:3:	5:3:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,1|O<2>,2|N<3>,3|C<4>,4|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,1|O<2>,2|N<3>,5|C<3>}	38.7256	0.514	2	38.7256	0.265	2	38.7256	0.265	2	38.7256	0.265	2	38.4200	0.088	8	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,5]	N[3]	B[3,3]	3:3:3:3:4:	5:4:3:	5:3:3:3:	N[3]-3:N[3]-3:N[5]-3:N[5]-3:B[3,3]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N)	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,5]N[3]2N[5]2)(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N){2|H<1>,8|C<3>}	N[3](Ge[3,3,5]B[3,3]N[3]N[5]2)(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,7|C<3>}	B[3,3](Ge[3,3,5]N[3]2N[5]2)(N[3]Ge[3,3,5]C[6a])2(NCC){8|C<3>}	38.0578	0.201	4	38.0578	0.041	4	38.0578	0.041	4	38.0578	0.041	4	38.0075	0.146	12	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,5]	N[3]	B[3,3]	3:3:3:4:3:	5:4:3:	5:3:3:3:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){1|B<3>,1|C<2>,1|N<3>,2|C<4>,4|C<3>}	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC){1|B<3>,1|C<2>,1|N<3>,5|C<3>}	37.6609	0.430	4	37.6609	0.185	4	37.6609	0.185	4	37.6609	0.185	4	38.0075	0.146	12	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3,5]	N[3]	B[3,3]	3:3:4:4:4:	5:4:3:	5:3:3:3:	N[3]-3:N[3]-3:B[3,3]-4:C[5]-4:C[5]-4:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3,3,5]C[5]2N[3]2)(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2{2|C<4>,4|C<3>}	N[3](Ge[3,3,5]B[3,3]C[5]2N[3])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){2|C<4>,4|H<1>,5|C<3>}	B[3,3](Ge[3,3,5]C[5]2N[3]2)(N[3]Ge[3,3,5]C[6a])2(NCC){4|H<1>,6|C<3>}	38.3037	0.175	4	38.3037	0.031	4	38.3037	0.031	4	38.3037	0.031	4	38.0075	0.146	12	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3]	N[3]	B[3,3]	3:3:4:1:1:	5:4:3:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:I-1:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2II)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2II)(NCC){4|C<3>}	38.9382	0.016	2	38.9382	0.000	2	38.9382	0.000	2	38.9382	0.000	2	38.6969	0.042	7	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3]	N[3]	B[3,3]	3:3:4:2:2:	5:4:3:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC){4|C<3>}	38.6423	0.000	1	38.6423	0.000	1	38.6423	0.000	1	38.6423	0.000	1	38.6969	0.042	7	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3]	N[3]	B[3,3]	3:3:4:4:1:	5:4:3:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC){4|C<3>}	38.6594	0.261	2	38.6594	0.068	2	38.6594	0.068	2	38.6594	0.068	2	38.6969	0.042	7	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3,3]	N[3]	B[3,3]	3:3:4:4:2:	5:4:3:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC){4|C<3>}	38.5205	0.044	2	38.5205	0.002	2	38.5205	0.002	2	38.5205	0.002	2	38.6969	0.042	7	38.3082	0.160	31
982	138	654	3:SPD5_SP2_SP3	Ge[3x3]	N[3]	B[3,3]	5:3:3:3:4:	5:4:3:	5:3:3:3:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:B[3,3]-4:C[6a]-3:	Ge[3x3]-5:N[3]-3:N[3]-3:N-3:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2)	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	38.3068	0.150	4	38.3068	0.022	4	38.3068	0.022	4	38.3068	0.022	4	38.3068	0.022	4	38.3082	0.160	31
982	138	654	3:SPD5_SP3_SP3	Ge[3,3]	N[3]	B[3,3]	3:3:4:2:2:	5:4:3:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC){4|C<3>}	38.3898	0.000	1	38.3898	0.000	1	38.3898	0.000	1	38.3898	0.000	1	38.3898	0.000	1	38.3898	0.000	1
982	138	846	0:SPD5_SP2_SP2	Ge[3,3,4]	N[3]	C[4]	5:3:3:3:4:	5:4:3:	5:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:C[4]-3:C[6a]-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|C<4>,2|N<3>,5|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2){1|B<4>,2|H<1>,3|N<3>,6|C<3>}	122.6082	8.664	4	122.6082	75.067	4	122.6082	75.067	4	122.6082	75.067	4	122.6082	75.067	4	122.6082	75.067	4
982	138	909	0:SPD5_SP2_SP2	Ge[3,3]	N[3]	S	3:3:4:2:2:	5:4:3:	5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	117.0510	3.210	2	117.0510	10.306	2	117.0510	10.306	2	117.0510	10.306	2	117.0510	10.306	2	117.0510	10.306	2
982	138	909	0:SPD5_SP2_SP3	Ge[3,3]	N[3]	S	3:3:4:2:2:	5:4:3:	5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]SS)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	115.6350	5.903	2	115.6350	34.845	2	115.6350	34.845	2	115.6350	34.845	2	115.6350	34.845	2	115.6350	34.845	2
982	138	939	0:SPD5_SP2_SP2	Ge[3,3,5]	N[3]	Ge[5]	3:3:3:4:3:	5:4:3:	5:3:2:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,5]-5:N[5]-3:C-2:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2)	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[3](Ge[3,3,5]B[3,3]Ge[5]N[3]N[5])(B[3,3]Ge[3,3,5]N[3]N)(C[6a]C[6a]2){1|B<3>,1|C<2>,1|N<3>,2|C<4>,4|C<3>}	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN){2|N<3>,5|C<3>}	126.8340	9.817	4	126.8340	96.369	4	126.8340	96.369	4	126.8340	96.369	4	126.8340	96.369	4	126.8340	96.369	4
982	138	944	0:SPD5_SP-NON_SP2	Ge[3,3]	N[3]	I	3:3:4:1:1:	5:4:3:	5:	N[3]-3:N[3]-3:B[3,3]-4:I-1:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	I(Ge[3,3]B[3,3]N[3]2I)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2{4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]II)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	I(Ge[3,3]B[3,3]N[3]2I)	117.9650	2.519	4	117.9650	6.347	4	117.9650	6.347	4	117.9650	6.347	4	116.6417	8.011	6	116.6417	8.011	6
982	138	944	0:SPD5_SP-NON_SP2	Ge[3,3]	N[3]	I	3:3:4:4:1:	5:4:3:	5:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	I(Ge[3,3]B[3,3]N[3]2C)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CI)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	I(Ge[3,3]B[3,3]N[3]2C)	113.9950	0.031	2	113.9950	0.001	2	113.9950	0.001	2	113.9950	0.001	2	116.6417	8.011	6	116.6417	8.011	6
982	138	982	0:SPD5_SP2_SPD5	Ge[3,3,4]	N[3]	Ge[3,3,4]	5:3:3:3:4:	5:4:3:	5:3:3:3:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|C<4>,2|N<3>,5|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	133.7145	7.178	4	133.7145	51.530	4	133.7145	51.530	4	133.7145	51.530	4	134.2611	33.712	8	136.2752	34.490	12
982	138	982	0:SPD5_SP2_SPD5	Ge[3,3,4]	N[3]	Ge[3,3,4]	5:3:3:4:2:	5:4:3:	5:3:3:4:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]O[4])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	138.6960	0.276	2	138.6960	0.076	2	138.6960	0.076	2	138.6960	0.076	2	134.2611	33.712	8	136.2752	34.490	12
982	138	982	0:SPD5_SP2_SPD5	Ge[3,3,4]	N[3]	Ge[3,3,4]	5:3:3:4:4:	5:4:3:	5:3:3:4:2:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:B[3,3]-4:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	N[3](Ge[3,3,4]Ge[3,3,4]B[3,3]C[4]N[3])(B[3,3]Ge[3,3,4]N[3]N)(C[6a]C[6a]2){1|B<4>,1|O<2>,2|N<3>,3|C<4>,4|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	130.9195	4.296	2	130.9195	18.453	2	130.9195	18.453	2	130.9195	18.453	2	134.2611	33.712	8	136.2752	34.490	12
982	138	982	0:SPD5_SP2_SPD5	Ge[3x3]	N[3]	Ge[3x3]	5:3:3:3:4:	5:4:3:	5:3:3:3:4:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:B[3,3]-4:C[6a]-3:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)(B[3,3]Ge[3x3]N[3]N)(C[6a]C[6a]2){1|B<4>,2|N<3>,3|C<3>,3|C<4>}	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	140.3035	3.918	4	140.3035	15.347	4	140.3035	15.347	4	140.3035	15.347	4	140.3035	15.347	4	136.2752	34.490	12
982	138	982	3:SPD5_SP3_SPD5	Ge[3x3]	N[3]	Ge[3x3]	5:3:3:3:4:	5:5:4:	5:3:3:3:4:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:Ge[3x3]-5:C[3x6]-4:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	N[3](Ge[3x3]Ge[3x3]B[3,3]N[3]2)2(C[3x6]C[6,6]3){2|N<3>,3|C<4>,4|C<3>,6|H<1>}	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	50.2900	0.495	2	50.2900	0.245	2	50.2900	0.245	2	50.2900	0.245	2	50.2900	0.245	2	50.2900	0.245	2
982	138	983	0:SPD5_SP1_SP2	Ge[3,3]	N[3]	C	3:3:4:4:2:	5:4:3:	5:1:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:B[3,3]-4:C[6a]-3:	Ge[3,3]-5:N-1:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2)	C(Ge[3,3]B[3,3]N[3]2C)(N)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	N[3](Ge[3,3]B[3,3]N[3]CC)(B[3,3]Ge[3,3]N[3]N)(C[6a]C[6a]2){2|C<4>,3|C<3>}	C(Ge[3,3]B[3,3]N[3]2C)(N)	112.4190	1.877	2	112.4190	3.522	2	112.4190	3.522	2	112.4190	3.522	2	112.4190	3.522	2	112.4190	3.522	2
982	226	654	0:SPD5_SP3_SP3	Ge[3,3,4]	O[4]	B[3,3]	5:3:3:4:2:	5:4:	5:3:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:C[4]-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C)	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C){1|B<4>,3|N<3>,4|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	120.1070	0.000	1	120.1070	0.000	1	120.1070	0.000	1	120.1070	0.000	1	120.1070	0.000	1	120.1070	0.000	1
982	226	982	4:SPD5_SP3_SPD5	Ge[3,3,4]	O[4]	Ge[3,3,4]	5:3:3:4:2:	5:4:	5:3:3:4:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:C[4]-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	O[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a]C){1|B<4>,3|N<3>,4|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	75.5697	0.000	1	75.5697	0.000	1	75.5697	0.000	1	75.5697	0.000	1	75.5697	0.000	1	75.5697	0.000	1
982	262	262	6:SPD5_SP1_SP1	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	Ge[4,5,3x6]	4:4:2:2:3:	5:4:	5:5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6])	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]){1|Ge<5>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2{1|Ge<4>}	62.9919	0.032	2	62.9919	0.001	2	62.9919	0.001	2	62.9919	0.001	2	62.9919	0.001	2	62.9919	0.001	2
982	262	490	0:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	C	5:4:3:2:4:	5:5:	5:4:1:1:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6]-5:C-4:H-1:H-1:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	116.0085	0.583	2	116.0085	0.340	2	116.0085	0.340	2	116.0085	0.340	2	116.0085	0.340	2	116.0085	0.340	2
982	262	634	4:SPD5_SP1_SP3	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	Ge[3x3,4,5,5,6]	4:4:2:2:3:	5:4:	4:4:5:4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6])	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]){1|Ge<5>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2){1|C<3>}	68.2219	0.395	2	68.2219	0.156	2	68.2219	0.156	2	68.2219	0.156	2	86.1452	428.400	4	86.1452	428.400	4
982	262	634	4:SPD5_SP1_SP3	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	Ge[3x3,4,5,5,6]	4:4:2:2:3:	5:5:	4:4:5:5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2{1|Ge<4>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	104.0685	0.254	2	104.0685	0.064	2	104.0685	0.064	2	104.0685	0.064	2	86.1452	428.400	4	86.1452	428.400	4
982	262	634	5:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,3,4,4,5,5,6,6]	4:3:3:2:3:	5:4:	5:5:3:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){1|Ge<5>,2|C<3>}	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){2|C<3>}	115.0070	0.000	1	115.0070	0.000	1	115.0070	0.000	1	115.0070	0.000	1	115.6410	0.804	2	98.3725	895.002	3
982	262	634	5:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,3,4,4,5,5,6,6]	4:3:3:2:4:	5:5:	5:5:3:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	116.2750	0.000	1	116.2750	0.000	1	116.2750	0.000	1	116.2750	0.000	1	115.6410	0.804	2	98.3725	895.002	3
982	262	634	5:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,5,5,3x6]	5:4:3:2:4:	5:5:	4:5:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	63.8356	0.000	1	63.8356	0.000	1	63.8356	0.000	1	63.8356	0.000	1	63.8356	0.000	1	98.3725	895.002	3
982	262	634	6:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,3,4,4,5,5,6,6]	4:3:3:2:4:	5:5:	5:5:3:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	116.2440	0.000	1	116.2440	0.000	1	116.2440	0.000	1	116.2440	0.000	1	116.2440	0.000	1	106.7655	434.845	6
982	262	634	6:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,5,5,3x6]	5:4:3:2:4:	5:5:	4:5:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	64.2141	0.000	1	64.2141	0.000	1	64.2141	0.000	1	64.2141	0.000	1	64.2141	0.000	1	106.7655	434.845	6
982	262	634	6:SPD5_SP1_SP3	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	Ge[3x3,4,5,5,6]	4:4:2:2:3:	5:4:	4:4:5:5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6])	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]){1|Ge<5>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	114.8905	0.305	2	114.8905	0.093	2	114.8905	0.093	2	114.8905	0.093	2	115.0337	0.102	4	106.7655	434.845	6
982	262	634	6:SPD5_SP1_SP3	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	Ge[3x3,4,5,5,6]	4:4:2:2:3:	5:5:	4:4:5:4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2{1|Ge<4>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2){1|C<3>}	115.1770	0.362	2	115.1770	0.131	2	115.1770	0.131	2	115.1770	0.131	2	115.0337	0.102	4	106.7655	434.845	6
982	262	643	0:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	C[6a]	4:3:3:2:3:	5:4:	5:3:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){1|Ge<5>,2|C<3>}	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2{1|Ge<4>,1|Ge<5>,2|Ge<3>,1|C<3>,2|H<1>}	116.2240	0.000	1	116.2240	0.000	1	116.2240	0.000	1	116.2240	0.000	1	116.2240	0.000	1	116.2240	0.000	1
982	262	880	0:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Si	4:3:3:2:4:	5:5:	5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:C-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	114.1060	0.000	1	114.1060	0.000	1	114.1060	0.000	1	114.1060	0.000	1	117.0365	17.176	2	117.0365	17.176	2
982	262	880	0:SPD5_SP1_SP3	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Si	4:3:3:2:4:	5:5:	5:4:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6]-5:Si-4:Si-4:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	119.9670	0.000	1	119.9670	0.000	1	119.9670	0.000	1	119.9670	0.000	1	117.0365	17.176	2	117.0365	17.176	2
982	262	930	0:SPD5_SP1_SP2	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	C	4:4:2:2:3:	5:4:	5:3:1:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3,4,4,5,5,4x6]-5:C-3:H-1:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6])	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]){1|Ge<5>}	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	107.1255	0.276	2	107.1255	0.076	2	107.1255	0.076	2	107.1255	0.076	2	116.0918	107.221	4	116.0918	107.221	4
982	262	930	0:SPD5_SP1_SP2	Ge[3,4,4,5,5,4x6]	Ge[4,5,3x6]	C	4:4:2:2:3:	5:5:	5:3:1:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6]-5:C-3:H-1:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[4,5,3x6](Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]C)2{1|Ge<4>}	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	125.0580	0.103	2	125.0580	0.011	2	125.0580	0.011	2	125.0580	0.011	2	116.0918	107.221	4	116.0918	107.221	4
982	262	938	4:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:3:	5:4:	5:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){1|Ge<5>,2|C<3>}	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]){1|Sb<3>,2|C<3>}	68.3731	0.000	1	68.3731	0.000	1	68.3731	0.000	1	68.3731	0.000	1	72.2269	25.148	5	72.2269	25.148	5
982	262	938	4:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:5:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	76.1120	0.000	1	76.1120	0.000	1	77.5926	4.385	2	77.5926	4.385	2	72.2269	25.148	5	72.2269	25.148	5
982	262	938	4:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:5:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	79.0733	0.000	1	79.0733	0.000	1	77.5926	4.385	2	77.5926	4.385	2	72.2269	25.148	5	72.2269	25.148	5
982	262	938	4:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,4,5,5,6]	5:4:3:2:4:	5:5:	5:5:5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	68.7879	0.346	2	68.7879	0.119	2	68.7879	0.119	2	68.7879	0.119	2	72.2269	25.148	5	72.2269	25.148	5
982	262	938	5:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	64.4931	0.000	1	64.4931	0.000	1	64.4931	0.000	1	64.4931	0.000	1	64.4931	0.000	1	64.4931	0.000	1
982	262	938	6:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:3:	5:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C[6a])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]){1|Ge<5>,2|C<3>}	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){2|C<3>}	62.1295	0.000	1	62.1295	0.000	1	62.1295	0.000	1	62.1295	0.000	1	62.8787	1.123	2	62.8787	1.123	2
982	262	938	6:SPD5_SP1_SP2	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<5>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	63.6280	0.000	1	63.6280	0.000	1	63.6280	0.000	1	63.6280	0.000	1	62.8787	1.123	2	62.8787	1.123	2
982	262	982	5:SPD5_SP1_SPD5	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,3,4,4,5,5,6,6]	5:4:3:2:4:	5:5:	4:5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	111.2140	0.000	1	111.2140	0.000	1	111.2140	0.000	1	111.2140	0.000	1	111.2140	0.000	1	111.2140	0.000	1
982	262	982	6:SPD5_SP1_SPD5	Ge[3,4,4,3x5,4x6]	Ge[4,5,5,6,6]	Ge[3,3,4,4,5,5,6,6]	5:4:3:2:4:	5:5:	4:5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si){1|Ge<4>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	111.0510	0.000	1	111.0510	0.000	1	111.0510	0.000	1	111.0510	0.000	1	111.0510	0.000	1	111.0510	0.000	1
982	474	474	5:SPD5_SP3_SP3	Ge[3,3,5]	C[5]	C[5]	3:3:4:4:4:	5:3:1:1:	5:3:1:1:	N[3]-3:N[3]-3:B[3,3]-4:C[5]-4:C[5]-4:	Ge[3,3,5]-5:C[5]-3:H-1:H-1:	Ge[3,3,5]-5:C[5]-3:H-1:H-1:	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2{2|C<4>,4|C<3>}	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	93.7498	0.142	2	93.7498	0.020	2	93.7498	0.020	2	93.7498	0.020	2	93.7498	0.020	2	93.7498	0.020	2
982	474	654	0:SPD5_SP3_SP3	Ge[3,3,5]	C[5]	B[3,3]	3:3:4:4:4:	5:3:1:1:	5:3:3:3:	N[3]-3:N[3]-3:B[3,3]-4:C[5]-4:C[5]-4:	Ge[3,3,5]-5:C[5]-3:H-1:H-1:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2	B[3,3](Ge[3,3,5]C[5]2N[3]2)(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(C[5]C[5]HH)2{2|C<4>,4|C<3>}	C[5](Ge[3,3,5]B[3,3]C[5]N[3]2)(C[5]C[5]C)(H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	B[3,3](Ge[3,3,5]C[5]2N[3]2)(N[3]Ge[3,3,5]C[6a])2(NCC){4|H<1>,6|C<3>}	133.1207	0.796	4	133.1207	0.633	4	133.1207	0.633	4	133.1207	0.633	4	133.1207	0.633	4	133.1207	0.633	4
982	478	654	0:SPD5_SP3_SP3	Ge[3,3,4]	C[4]	B[3,3]	5:3:3:4:4:	5:2:3:4:	5:3:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:O[4]-2:C[6a]-3:C-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3){1|B<4>,2|H<1>,3|N<3>,4|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,1|O<2>,2|N<3>,5|C<3>}	143.0110	0.000	1	143.0110	0.000	1	143.0110	0.000	1	143.0110	0.000	1	143.0110	0.000	1	143.0110	0.000	1
982	478	982	4:SPD5_SP3_SPD5	Ge[3,3,4]	C[4]	Ge[3,3,4]	5:3:3:4:4:	5:2:3:4:	5:3:3:4:2:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:O[4]-2:C[6a]-3:C-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(O[4]Ge[3,3,4])(C[6a]C[6a]2)(CF3){1|B<4>,2|H<1>,3|N<3>,4|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	71.8146	0.000	1	71.8146	0.000	1	71.8146	0.000	1	71.8146	0.000	1	71.8146	0.000	1	71.8146	0.000	1
982	490	634	0:SPD5_SP3_SP3	Ge[3,4,4,3x5,4x6]	C	Ge[3,4,5,5,3x6]	5:4:3:2:4:	5:4:1:1:	4:5:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:C-4:H-1:H-1:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	128.8020	1.516	2	128.8020	2.298	2	128.8020	2.298	2	128.8020	2.298	2	128.8020	2.298	2	128.8020	2.298	2
982	490	654	0:SPD5_SP3_SP3	Ge[3,3]	C	B[3,3]	3:3:4:4:1:	5:1:1:1:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:H-1:H-1:H-1:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	C(Ge[3,3]B[3,3]N[3]2I)(H)3	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	C(Ge[3,3]B[3,3]N[3]2I)(H)3	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC){4|C<3>}	133.2790	0.000	1	133.2790	0.000	1	133.2790	0.000	1	133.2790	0.000	1	135.5695	10.493	2	135.5695	10.493	2
982	490	654	0:SPD5_SP3_SP3	Ge[3,3]	C	B[3,3]	3:3:4:4:2:	5:4:4:4:	3:3:5:3:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:C-4:C-4:C-4:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC){4|C<3>}	137.8600	0.000	1	137.8600	0.000	1	137.8600	0.000	1	137.8600	0.000	1	135.5695	10.493	2	135.5695	10.493	2
982	490	938	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	C	Ge[3,4,4,5,5,6]	5:4:3:2:4:	5:4:1:1:	5:5:5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:C-4:H-1:H-1:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	115.9810	1.301	2	115.9810	1.693	2	115.9810	1.693	2	115.9810	1.693	2	115.9810	1.693	2	115.9810	1.693	2
982	490	944	0:SPD5_SP-NON_SP3	Ge[3,3]	C	I	3:3:4:4:1:	5:1:1:1:	5:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	Ge[3,3]-5:H-1:H-1:H-1:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	C(Ge[3,3]B[3,3]N[3]2I)(H)3	I(Ge[3,3]B[3,3]N[3]2C)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	C(Ge[3,3]B[3,3]N[3]2I)(H)3	I(Ge[3,3]B[3,3]N[3]2C)	104.3630	0.000	1	104.3630	0.000	1	104.3630	0.000	1	104.3630	0.000	1	104.3630	0.000	1	104.3630	0.000	1
982	490	982	0:SPD5_SP3_SPD5	Ge[3,4,4,3x5,4x6]	C	Ge[3,3,4,4,5,5,6,6]	5:4:3:2:4:	5:4:1:1:	4:5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,4,4,3x5,4x6]-5:C-4:H-1:H-1:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	C(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(CH3)(H)2	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	128.2525	0.592	2	128.2525	0.350	2	128.2525	0.350	2	128.2525	0.350	2	128.2525	0.350	2	128.2525	0.350	2
982	490	983	0:SPD5_SP1_SP3	Ge[3,3]	C	C	3:3:4:4:2:	5:4:4:4:	5:1:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	Ge[3,3]-5:C-4:C-4:C-4:	Ge[3,3]-5:N-1:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	C(Ge[3,3]B[3,3]N[3]2C)(N)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	C(Ge[3,3]B[3,3]N[3]2C)(CH3)3	C(Ge[3,3]B[3,3]N[3]2C)(N)	104.0410	0.000	1	104.0410	0.000	1	104.0410	0.000	1	104.0410	0.000	1	104.0410	0.000	1	104.0410	0.000	1
982	542	542	5:SPD5_SP2_SP2	Ge[3,3,5]	N[5]	N[5]	3:3:3:3:4:	5:3:3:	5:3:3:	N[3]-3:N[3]-3:N[5]-3:N[5]-3:B[3,3]-4:	Ge[3,3,5]-5:C[6a]-3:C[5]-3:	Ge[3,3,5]-5:C[6a]-3:C[5]-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N)	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H)	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N){2|H<1>,8|C<3>}	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,1|N<3>,2|C<4>,5|C<3>}	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,1|N<3>,2|C<4>,5|C<3>}	89.3571	0.848	2	89.3571	0.719	2	89.3571	0.719	2	89.3571	0.719	2	89.3571	0.719	2	89.3571	0.719	2
982	542	654	0:SPD5_SP2_SP3	Ge[3,3,5]	N[5]	B[3,3]	3:3:3:3:4:	5:3:3:	5:3:3:3:	N[3]-3:N[3]-3:N[5]-3:N[5]-3:B[3,3]-4:	Ge[3,3,5]-5:C[6a]-3:C[5]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N)	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H)	B[3,3](Ge[3,3,5]N[3]2N[5]2)(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]C[5])2(B[3,3]N[3]2N){2|H<1>,8|C<3>}	N[5](Ge[3,3,5]B[3,3]N[3]2N[5])(C[6a]C[6a]2)(C[5]C[5]H){1|H<1>,1|N<3>,2|C<4>,5|C<3>}	B[3,3](Ge[3,3,5]N[3]2N[5]2)(N[3]Ge[3,3,5]C[6a])2(NCC){8|C<3>}	135.2335	4.104	4	135.2335	16.844	4	135.2335	16.844	4	135.2335	16.844	4	132.3377	30.354	6	132.3377	30.354	6
982	542	654	0:SPD5_SP2_SP3	Ge[3,3,5]	N[5]	B[3,3]	3:3:3:4:3:	5:3:3:	5:3:3:3:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:C[6a]-3:B[5]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N)	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N){1|C<2>,1|N<3>,2|C<4>,5|C<3>}	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC){1|B<3>,1|C<2>,1|N<3>,5|C<3>}	126.5460	0.781	2	126.5460	0.609	2	126.5460	0.609	2	126.5460	0.609	2	132.3377	30.354	6	132.3377	30.354	6
982	542	939	5:SPD5_SP2_SP2	Ge[3,3,5]	N[5]	Ge[5]	3:3:3:4:3:	5:3:3:	5:3:2:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:C[6a]-3:B[5]-3:	Ge[3,3,5]-5:N[5]-3:C-2:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N)	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	N[5](Ge[3,3,5]B[3,3]Ge[5]N[3]2)(C[6a]C[6a]2)(B[5]N[5]N){1|C<2>,1|N<3>,2|C<4>,5|C<3>}	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN){2|N<3>,5|C<3>}	95.9896	0.294	2	95.9896	0.086	2	95.9896	0.086	2	95.9896	0.086	2	95.9896	0.086	2	95.9896	0.086	2
982	634	634	3:SPD5_SP3_SP3	Ge[3,4,4,5,5,4x6]	Ge[3x3,4,5,5,6]	Ge[3x3,4,5,5,6]	4:4:2:2:3:	4:4:5:4:	4:4:5:5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2){1|C<3>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	62.0962	0.067	2	62.0962	0.005	2	62.0962	0.005	2	62.0962	0.005	2	62.1297	0.050	5	62.1297	0.050	5
982	634	634	3:SPD5_SP3_SP3	Ge[3,4,4,5,5,4x6]	Ge[3x3,4,5,5,6]	Ge[3x3,4,5,5,6]	4:4:3:3:4:	4:4:5:5:	4:4:5:5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-3:Ge[4,5,3x6]-3:Si-4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6]Pd)2(SiSi3)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6]Pd)2(SiSi3){1|Ge<3>,2|Si<4>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2{1|Pd<6>,1|Si<4>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2{1|Pd<6>,1|Si<4>}	62.1520	0.309	3	62.1520	0.096	3	62.1520	0.096	3	62.1520	0.096	3	62.1297	0.050	5	62.1297	0.050	5
982	634	634	6:SPD5_SP3_SP3	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	4:4:3:3:4:	5:5:3:3:	5:5:3:3:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	98.1746	0.225	4	98.1746	0.051	4	98.1746	0.051	4	98.1746	0.051	4	98.1746	0.051	4	98.1746	0.051	4
982	634	643	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	C[6a]	4:3:3:2:3:	5:5:3:3:	5:3:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){2|C<3>}	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2{1|Ge<4>,1|Ge<5>,2|Ge<3>,1|C<3>,2|H<1>}	119.3690	0.000	1	119.3690	0.000	1	119.3690	0.000	1	119.3690	0.000	1	119.3690	0.000	1	119.3690	0.000	1
982	634	880	0:SPD5_SP3_SP3	Ge[3,3,4,4,5,3x6]	Ge[3,3,4,4,5,5,6,6]	Si	4:3:3:3:4:	5:5:3:3:	5:4:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	120.4155	0.520	2	120.4155	0.270	2	120.4155	0.270	2	120.4155	0.270	2	120.4155	0.270	2	122.8073	37.114	20
982	634	880	0:SPD5_SP3_SP3	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	Si	4:4:3:3:4:	5:5:3:3:	5:4:4:4:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Si(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]2)(SiC3)3	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	Si(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]2)(SiC3)3	127.9711	3.949	8	127.9711	15.596	8	127.9711	15.596	8	127.9711	15.596	8	127.9711	15.596	8	122.8073	37.114	20
982	634	880	0:SPD5_SP3_SP3	Ge[3,3,4,4,5,5,6,6]	Ge[3,3,4,4,5,3x6]	Si	4:5:3:3:4:	5:4:3:3:	5:4:4:4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,5,6,6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6]){1|Ge<2>,1|Si<4>,1|C<4>}	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	125.1420	3.124	2	125.1420	9.759	2	125.1420	9.759	2	125.1420	9.759	2	125.1420	9.759	2	122.8073	37.114	20
982	634	880	0:SPD5_SP3_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Si	4:3:3:2:4:	5:5:3:3:	5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:C-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	122.6670	0.000	1	122.6670	0.000	1	122.6670	0.000	1	122.6670	0.000	1	123.0275	0.260	2	122.8073	37.114	20
982	634	880	0:SPD5_SP3_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Si	4:3:3:2:4:	5:5:3:3:	5:4:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6]-5:Si-4:Si-4:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	123.3880	0.000	1	123.3880	0.000	1	123.3880	0.000	1	123.3880	0.000	1	123.0275	0.260	2	122.8073	37.114	20
982	634	880	0:SPD5_SP3_SP3	Ge[3,4,4,5,5,4x6]	Ge[3x3,4,5,5,6]	Si	4:4:3:3:4:	4:4:5:5:	5:4:4:4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-3:Ge[4,5,3x6]-3:Si-4:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6]-5:Si-4:Si-4:Si-4:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6]Pd)2(SiSi3)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2	Si(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(SiC3)3	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6]Pd)2(SiSi3){1|Ge<3>,2|Si<4>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2Si)2{1|Pd<6>,1|Si<4>}	Si(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(SiC3)3	115.8680	3.493	6	115.8680	12.203	6	115.8680	12.203	6	115.8680	12.203	6	115.8680	12.203	6	122.8073	37.114	20
982	634	930	0:SPD5_SP2_SP3	Ge[3,4,4,5,5,4x6]	Ge[3x3,4,5,5,6]	C	4:4:2:2:3:	4:4:5:4:	5:3:1:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-4:	Ge[3,4,4,5,5,4x6]-5:C-3:H-1:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2)	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2){1|C<3>}	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	107.9500	0.078	2	107.9500	0.006	2	107.9500	0.006	2	107.9500	0.006	2	116.9620	108.340	4	116.9620	108.340	4
982	634	930	0:SPD5_SP2_SP3	Ge[3,4,4,5,5,4x6]	Ge[3x3,4,5,5,6]	C	4:4:2:2:3:	4:4:5:5:	5:3:1:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[4,5,3x6]-2:Ge[4,5,3x6]-2:C-3:	Ge[3x3,4,5,5,6]-4:Ge[3x3,4,5,5,6]-4:Ge[3,4,4,5,5,4x6]-5:Ge[3,4,4,5,5,4x6]-5:	Ge[3,4,4,5,5,4x6]-5:C-3:H-1:	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH)	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	Ge[3,4,4,5,5,4x6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2)2(Ge[4,5,3x6]Ge[3,4,4,5,5,4x6])2(CCH){1|Ge<2>,1|C<3>}	Ge[3x3,4,5,5,6](Ge[3x3,4,5,5,6]Ge[3,4,4,5,5,4x6]2Ge[3x3,4,5,5,6])2(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]Ge[4,5,3x6]2C)2	C(Ge[3,4,4,5,5,4x6]Ge[3x3,4,5,5,6]2Ge[4,5,3x6]2)(CHH)(H)	125.9740	0.386	2	125.9740	0.149	2	125.9740	0.149	2	125.9740	0.149	2	116.9620	108.340	4	116.9620	108.340	4
982	634	938	3:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,3x6]	4:3:3:3:4:	5:5:3:3:	5:4:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>}	61.9635	0.490	2	61.9635	0.240	2	61.9635	0.240	2	61.9635	0.240	2	61.9635	0.240	2	61.1538	1.666	14
982	634	938	3:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	Ge[3,4,4,5,5,6,6]	4:4:3:3:4:	5:5:3:3:	5:4:5:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	60.0466	0.481	7	60.0466	0.231	7	60.0466	0.231	7	60.0466	0.231	7	60.0466	0.231	7	61.1538	1.666	14
982	634	938	3:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,6,6]	Ge[3,3,4,4,5,3x6]	Ge[3,4,4,5,3x6]	4:5:3:3:4:	5:4:3:3:	5:4:5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,3,4,4,5,3x6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6]){1|Ge<2>,1|Si<4>,1|C<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>,1|C<4>}	62.4883	0.380	2	62.4883	0.145	2	62.4883	0.145	2	62.4883	0.145	2	62.4883	0.145	2	61.1538	1.666	14
982	634	938	3:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:3:	5:5:3:3:	5:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){2|C<3>}	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]){1|Sb<3>,2|C<3>}	61.4751	0.000	1	61.4751	0.000	1	61.4751	0.000	1	61.4751	0.000	1	62.3075	1.217	3	61.1538	1.666	14
982	634	938	3:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:5:3:3:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	61.8886	0.000	1	61.8886	0.000	1	62.7237	1.395	2	62.7237	1.395	2	62.3075	1.217	3	61.1538	1.666	14
982	634	938	3:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:5:3:3:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	63.5588	0.000	1	63.5588	0.000	1	62.7237	1.395	2	62.7237	1.395	2	62.3075	1.217	3	61.1538	1.666	14
982	634	938	4:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:3:4:	5:5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	90.6356	5.626	2	90.6356	31.655	2	90.6356	31.655	2	90.6356	31.655	2	90.6356	31.655	2	90.6356	31.655	2
982	634	938	5:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	Ge[3,4,4,5,5,6,6]	4:4:3:3:4:	5:5:3:3:	5:4:5:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	116.1972	1.081	4	116.1972	1.169	4	116.1972	1.169	4	116.1972	1.169	4	116.1972	1.169	4	115.1550	4.237	7
982	634	938	5:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,6,6]	Ge[3,3,4,4,5,3x6]	Ge[3,4,4,5,5,6]	4:5:3:3:4:	5:4:3:3:	5:5:5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6]){1|Ge<2>,1|Si<4>,1|C<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	115.1660	0.054	2	115.1660	0.003	2	115.1660	0.003	2	115.1660	0.003	2	115.1660	0.003	2	115.1550	4.237	7
982	634	938	5:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,4,5,5,6]	5:4:3:2:4:	4:5:3:4:	5:5:5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	110.9640	0.000	1	110.9640	0.000	1	110.9640	0.000	1	110.9640	0.000	1	110.9640	0.000	1	115.1550	4.237	7
982	634	938	6:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,3x5,6,6]	4:3:3:3:4:	5:5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3x4,4x5,4x6]-5:Ge[3,4,5,5,3x6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]){1|Si<4>}	118.3410	1.498	2	118.3410	2.243	2	118.3410	2.243	2	118.3410	2.243	2	118.3410	2.243	2	110.0597	115.260	10
982	634	938	6:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,3x6]	Ge[3,3,4,4,5,5,3x6]	Ge[3,4,4,5,5,6,6]	4:4:3:3:4:	5:5:3:3:	5:4:5:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-5:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2Si)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2{1|Si<4>}	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	116.1800	1.005	4	116.1800	1.011	4	116.1800	1.011	4	116.1800	1.011	4	116.1800	1.011	4	110.0597	115.260	10
982	634	938	6:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:3:	5:5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[3,3,4,4,5,5,6,6](Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Sb)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){2|C<3>}	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){2|C<3>}	105.3610	0.000	1	105.3610	0.000	1	105.3610	0.000	1	105.3610	0.000	1	96.0991	79.838	3	110.0597	115.260	10
982	634	938	6:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	95.4052	0.000	1	95.4052	0.000	1	91.4681	31.002	2	91.4681	31.002	2	96.0991	79.838	3	110.0597	115.260	10
982	634	938	6:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	87.5310	0.000	1	87.5310	0.000	1	91.4681	31.002	2	91.4681	31.002	2	96.0991	79.838	3	110.0597	115.260	10
982	634	938	6:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,4,5,5,6]	5:4:3:2:4:	4:5:3:4:	5:5:5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	110.8980	0.000	1	110.8980	0.000	1	110.8980	0.000	1	110.8980	0.000	1	110.8980	0.000	1	110.0597	115.260	10
982	634	982	6:SPD5_SP3_SPD5	Ge[3,3,4,4,5,5,6,6]	Ge[3,3,4,4,5,3x6]	Ge[3,4,4,3x5,4x6]	4:5:3:3:4:	5:4:3:3:	5:4:3:2:4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6]){1|Ge<2>,1|Si<4>,1|C<4>}	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	92.4411	0.986	2	92.4411	0.972	2	92.4411	0.972	2	92.4411	0.972	2	92.4411	0.972	2	91.3525	2.134	4
982	634	982	6:SPD5_SP3_SPD5	Ge[3,4,4,3x5,4x6]	Ge[3,4,5,5,3x6]	Ge[3,3,4,4,5,5,6,6]	5:4:3:2:4:	4:5:3:4:	4:5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	90.2638	0.831	2	90.2638	0.691	2	90.2638	0.691	2	90.2638	0.691	2	90.2638	0.691	2	91.3525	2.134	4
982	643	938	0:SPD5_SP2_SP2	Ge[3,4,4,3x5,4x6]	C[6a]	Ge[3,4,4,5,5,6]	4:3:3:2:3:	5:3:3:	5:4:4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2{1|Ge<4>,1|Ge<5>,2|Ge<3>,1|C<3>,2|H<1>}	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]){1|Sb<3>,2|C<3>}	112.3890	0.000	1	112.3890	0.000	1	112.3890	0.000	1	112.3890	0.000	1	112.3890	0.000	1	119.2110	93.079	2
982	643	938	0:SPD5_SP2_SP2	Ge[3,4,4,3x5,4x6]	C[6a]	Ge[3,4,5,5,3x6]	4:3:3:2:3:	5:3:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	C[6a](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]H)2{1|Ge<4>,1|Ge<5>,2|Ge<3>,1|C<3>,2|H<1>}	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){2|C<3>}	126.0330	0.000	1	126.0330	0.000	1	126.0330	0.000	1	126.0330	0.000	1	126.0330	0.000	1	119.2110	93.079	2
982	654	846	0:SPD5_SP2_SP3	Ge[3,3,4]	B[3,3]	C[4]	5:3:3:3:4:	5:3:3:3:	5:3:3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4]-5:C[4]-3:C[6a]-3:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,2|N<3>,6|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2){1|B<4>,2|H<1>,3|N<3>,6|C<3>}	134.4190	1.468	2	134.4190	2.155	2	134.4190	2.155	2	134.4190	2.155	2	134.4190	2.155	2	134.4190	2.155	2
982	654	909	0:SPD5_SP2_SP3	Ge[3,3]	B[3,3]	S	3:3:4:2:2:	3:3:5:3:	5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3]-5:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC)	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2SS)(NCC){4|C<3>}	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	124.4880	1.660	2	124.4880	2.757	2	124.4880	2.757	2	124.4880	2.757	2	124.4880	2.757	2	124.4880	2.757	2
982	654	939	0:SPD5_SP2_SP3	Ge[3,3,5]	B[3,3]	Ge[5]	3:3:3:4:3:	5:3:3:3:	5:3:2:	N[3]-3:N[3]-3:N[5]-3:B[3,3]-4:Ge[5]-3:	Ge[3,3,5]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,5]-5:N[5]-3:C-2:	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C)	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC)	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN)	Ge[3,3,5](N[3]B[3,3]C[6a])2(N[5]C[6a]B[5])(B[3,3]N[3]2N)(Ge[5]N[5]C){1|N<3>,7|C<3>}	B[3,3](Ge[3,3,5]Ge[5]N[3]2N[5])(N[3]Ge[3,3,5]C[6a])2(NCC){1|B<3>,1|C<2>,1|N<3>,5|C<3>}	Ge[5](Ge[3,3,5]B[3,3]N[3]2N[5])(N[5]C[6a]B[5])(CN){2|N<3>,5|C<3>}	136.3145	0.159	2	136.3145	0.025	2	136.3145	0.025	2	136.3145	0.025	2	136.3145	0.025	2	136.3145	0.025	2
982	654	944	0:SPD5_SP-NON_SP3	Ge[3,3]	B[3,3]	I	3:3:4:1:1:	3:3:5:3:	5:	N[3]-3:N[3]-3:B[3,3]-4:I-1:I-1:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2II)(NCC)	I(Ge[3,3]B[3,3]N[3]2I)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2{4|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2II)(NCC){4|C<3>}	I(Ge[3,3]B[3,3]N[3]2I)	127.0610	2.479	2	127.0610	6.146	2	127.0610	6.146	2	127.0610	6.146	2	125.4837	10.537	3	125.4837	10.537	3
982	654	944	0:SPD5_SP-NON_SP3	Ge[3,3]	B[3,3]	I	3:3:4:4:1:	3:3:5:3:	5:	N[3]-3:N[3]-3:B[3,3]-4:C-4:I-1:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC)	I(Ge[3,3]B[3,3]N[3]2C)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CH3)(I){4|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CI)(NCC){4|C<3>}	I(Ge[3,3]B[3,3]N[3]2C)	122.3290	0.000	1	122.3290	0.000	1	122.3290	0.000	1	122.3290	0.000	1	125.4837	10.537	3	125.4837	10.537	3
982	654	982	0:SPD5_SP3_SPD5	Ge[3,3,4]	B[3,3]	Ge[3,3,4]	5:3:3:3:4:	5:3:3:3:	5:3:3:3:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,2|N<3>,6|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	149.3825	0.592	2	149.3825	0.350	2	149.3825	0.350	2	149.3825	0.350	2	152.0605	70.665	4	156.1333	86.253	6
982	654	982	0:SPD5_SP3_SPD5	Ge[3,3,4]	B[3,3]	Ge[3,3,4]	5:3:3:4:2:	5:3:3:3:	5:3:3:4:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]N[3]2O[4])(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	164.3030	0.000	1	164.3030	0.000	1	164.3030	0.000	1	164.3030	0.000	1	152.0605	70.665	4	156.1333	86.253	6
982	654	982	0:SPD5_SP3_SPD5	Ge[3,3,4]	B[3,3]	Ge[3,3,4]	5:3:3:4:4:	5:3:3:3:	5:3:3:4:2:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-4:B[3,3]-4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:N-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:B[3,3]-4:O[4]-2:	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N)	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4])	Ge[3,3,4](Ge[3,3,4]B[3,3]N[3]2O[4])(N[3]B[3,3]C[6a])2(C[4]C[6a]O[4]C)(B[3,3]N[3]2N){1|N<3>,8|C<3>}	B[3,3](Ge[3,3,4]Ge[3,3,4]C[4]N[3]2)(N[3]Ge[3,3,4]C[6a])2(NCC){1|B<4>,1|C<4>,1|O<2>,2|N<3>,5|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(O[4]C[4]){1|C<4>,1|N<3>,7|C<3>}	145.1740	0.000	1	145.1740	0.000	1	145.1740	0.000	1	145.1740	0.000	1	152.0605	70.665	4	156.1333	86.253	6
982	654	982	0:SPD5_SP3_SPD5	Ge[3x3]	B[3,3]	Ge[3x3]	5:3:3:3:4:	5:3:3:3:	5:3:3:3:4:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3]-5:N[3]-3:N[3]-3:N-3:	Ge[3x3]-5:N[3]-3:N[3]-3:N[3]-3:B[3,3]-4:	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	B[3,3](Ge[3x3]Ge[3x3]N[3]3)(N[3]Ge[3x3]C[6a])2(NCC){1|B<4>,1|C<4>,2|N<3>,4|C<3>}	Ge[3x3](Ge[3x3]B[3,3]N[3]3)(N[3]Ge[3x3]C[3x6])(N[3]B[3,3]C[6a])2(B[3,3]N[3]2N){1|N<3>,3|C<4>,6|C<3>}	164.2790	4.496	2	164.2790	20.212	2	164.2790	20.212	2	164.2790	20.212	2	164.2790	20.212	2	156.1333	86.253	6
982	654	983	0:SPD5_SP1_SP3	Ge[3,3]	B[3,3]	C	3:3:4:4:2:	3:3:5:3:	5:1:	N[3]-3:N[3]-3:B[3,3]-4:C-4:C-2:	N[3]-3:N[3]-3:Ge[3,3]-5:N-3:	Ge[3,3]-5:N-1:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN)	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC)	C(Ge[3,3]B[3,3]N[3]2C)(N)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(CC3)(CN){4|C<3>}	B[3,3](N[3]Ge[3,3]C[6a])2(Ge[3,3]N[3]2CC)(NCC){4|C<3>}	C(Ge[3,3]B[3,3]N[3]2C)(N)	118.0970	0.000	1	118.0970	0.000	1	118.0970	0.000	1	118.0970	0.000	1	118.0970	0.000	1	118.0970	0.000	1
982	846	982	4:SPD5_SP2_SPD5	Ge[3,3,4]	C[4]	Ge[3,3,4]	5:3:3:3:4:	5:3:3:	5:3:3:3:4:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4]-5:C[4]-3:C[6a]-3:	Ge[3,3,4]-5:N[3]-3:N[3]-3:C[4]-3:B[3,3]-4:	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N)	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	C[4](Ge[3,3,4]Ge[3,3,4]B[3,3]N[3]2)(C[4]Ge[3,3,4]C[6a])(C[6a]C[6a]2){1|B<4>,2|H<1>,3|N<3>,6|C<3>}	Ge[3,3,4](Ge[3,3,4]B[3,3]C[4]N[3]2)(N[3]B[3,3]C[6a])2(C[4]C[6a]C[4])(B[3,3]N[3]2N){1|N<3>,9|C<3>}	73.5862	0.183	2	73.5862	0.034	2	73.5862	0.034	2	73.5862	0.034	2	73.5862	0.034	2	73.5862	0.034	2
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,4x6]	Si	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:3:3:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[3,3,4,4,4x6]-5:C[6a]-3:C[6a]-3:C-3:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C)	Si(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]4)(C[6a]C[6a]2)2(CCH)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C){2|Ge<2>,2|Si<4>}	Si(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]4)(C[6a]C[6a]2)2(CCH)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	118.2537	10.400	4	118.2537	108.170	4	118.2537	108.170	4	118.2537	108.170	4	119.2507	49.037	8	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,4x6]	Si	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:4:4:4:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[3,3,4,4,4x6]-5:Si-4:Si-4:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3)	Si(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]4)(SiC3)3	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3){2|Ge<2>,2|Si<4>}	Si(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]4)(SiC3)3	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	120.2477	1.897	4	120.2477	3.600	4	120.2477	3.600	4	120.2477	3.600	4	119.2507	49.037	8	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Si	Ge[3,4,3x5,6,6]	4:3:3:3:4:	5:4:4:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3x4,4x5,4x6]-5:Ge[3,4,5,5,3x6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]){1|Si<4>}	120.1895	0.670	2	120.1895	0.448	2	120.1895	0.448	2	120.1895	0.448	2	120.1895	0.448	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Si	Ge[3,4,4,5,3x6]	4:3:3:3:4:	5:4:4:4:	5:4:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>}	116.9745	0.993	2	116.9745	0.987	2	116.9745	0.987	2	116.9745	0.987	2	116.9745	0.987	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,3x6]	Si	Ge[3,4,5,5,3x6]	4:3:3:3:4:	5:4:4:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Si(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(SiC3)3	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	123.8010	0.772	2	123.8010	0.596	2	123.8010	0.596	2	123.8010	0.596	2	123.8010	0.596	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,3x6]	Si	Ge[3,4,4,5,5,6,6]	4:4:3:3:4:	5:4:4:4:	5:4:5:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Si(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]2)(SiC3)3	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Si(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]2)(SiC3)3	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	107.9374	3.042	8	107.9374	9.254	8	107.9374	9.254	8	107.9374	9.254	8	107.9374	9.254	8	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,6,6]	Si	Ge[3,4,4,5,3x6]	4:5:3:3:4:	5:4:4:4:	5:4:5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,3,4,4,5,3x6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>,1|C<4>}	120.1635	0.357	2	120.1635	0.128	2	120.1635	0.128	2	120.1635	0.128	2	120.1635	0.128	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,3,4,4,5,5,6,6]	Si	Ge[3,4,4,5,5,6]	4:5:3:3:4:	5:4:4:4:	5:5:5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	117.0295	3.480	2	117.0295	12.108	2	117.0295	12.108	2	117.0295	12.108	2	117.0295	12.108	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Si	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:3:3:4:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:C-4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	107.5190	0.000	1	107.5190	0.000	1	107.5190	0.000	1	107.5190	0.000	1	114.3855	94.298	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Si	Ge[3,4,4,5,5,6]	4:3:3:2:4:	5:4:4:4:	4:5:5:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	121.2520	0.000	1	121.2520	0.000	1	121.2520	0.000	1	121.2520	0.000	1	114.3855	94.298	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Si	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:3:3:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:C[6a]-3:C[6a]-3:C-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(C[6a]C[6a]2)2(CCHH)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	131.1430	0.000	1	131.1430	0.000	1	131.1430	0.000	1	131.1430	0.000	1	126.5885	41.487	2	116.5256	54.460	30
982	880	938	0:SPD5_SP2_SP3	Ge[3,4,4,3x5,4x6]	Si	Ge[3,4,5,5,3x6]	4:3:3:2:4:	5:4:4:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,4,4,3x5,4x6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Si(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6])(SiC3)3	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	122.0340	0.000	1	122.0340	0.000	1	122.0340	0.000	1	122.0340	0.000	1	126.5885	41.487	2	116.5256	54.460	30
982	880	982	0:SPD5_SP3_SPD5	Ge[3,3,4,4,5,5,6,6]	Si	Ge[3,4,4,3x5,4x6]	4:5:3:3:4:	5:4:4:4:	5:4:3:2:4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Si-4:Si-4:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Si(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(SiC3)3	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	127.0225	1.203	2	127.0225	1.447	2	127.0225	1.447	2	127.0225	1.447	2	127.0225	1.447	2	127.0225	1.447	2
982	909	909	0:SPD5_SP2_SP2	Ge[3,3]	S	S	3:3:4:2:2:	5:3:	5:3:	N[3]-3:N[3]-3:B[3,3]-4:S-2:S-2:	Ge[3,3]-5:C[6a]-3:	Ge[3,3]-5:C[6a]-3:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(SC[6a])2{4|C<3>}	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	S(Ge[3,3]B[3,3]N[3]2S)(C[6a]C[6a]2)	110.9810	0.000	1	110.9810	0.000	1	110.9810	0.000	1	110.9810	0.000	1	110.9810	0.000	1	110.9810	0.000	1
982	938	938	3:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	61.2437	0.816	2	61.2437	0.667	2	61.5782	0.669	3	61.5782	0.669	3	61.5782	0.669	3	62.1061	0.884	5
982	938	938	3:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	62.2474	0.000	1	62.2474	0.000	1	61.5782	0.669	3	61.5782	0.669	3	61.5782	0.669	3	62.1061	0.884	5
982	938	938	3:SPD5_SP2_SP2	Ge[3,3,4,4,5,3x6]	Ge[3,4,5,5,3x6]	Ge[3,4,3x5,6,6]	4:3:3:3:4:	5:5:3:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,3x6]-5:Ge[3x4,4x5,4x6]-5:Ge[3,4,5,5,3x6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]){1|Si<4>}	62.8979	0.330	2	62.8979	0.109	2	62.8979	0.109	2	62.8979	0.109	2	62.8979	0.109	2	62.1061	0.884	5
982	938	938	4:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	88.3474	10.128	2	88.3474	102.578	2	87.9665	34.440	4	87.9665	34.440	4	87.9665	34.440	4	80.9335	50.969	12
982	938	938	4:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	87.5856	0.401	2	87.5856	0.160	2	87.9665	34.440	4	87.9665	34.440	4	87.9665	34.440	4	80.9335	50.969	12
982	938	938	4:SPD5_SP2_SP2	Ge[3,3,4,4,5,3x6]	Ge[3,4,4,5,3x6]	Ge[3,4,3x5,6,6]	4:3:3:3:4:	5:4:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3x4,4x5,4x6]-5:Ge[3,4,5,5,3x6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,4,3x5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]){1|Si<4>}	83.0918	5.859	2	83.0918	34.330	2	83.0918	34.330	2	83.0918	34.330	2	83.0918	34.330	2	80.9335	50.969	12
982	938	938	4:SPD5_SP2_SP2	Ge[3,3,4,4,5,5,3x6]	Ge[3,4,4,5,5,6,6]	Ge[3,4,4,5,5,6,6]	4:4:3:3:4:	5:4:5:	5:4:5:	Ge[3,3,4,4,5,5,3x6]-4:Ge[3,3,4,4,5,5,3x6]-4:Ge[3,4,4,5,5,6,6]-3:Ge[3,4,4,5,5,6,6]-3:Si-4:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6]-5:Ge[3,3,4,4,5,5,3x6]-4:Ge[4x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3)	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si)	Ge[3,3,4,4,5,5,3x6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]Ge[3,4,4,5,5,6,6]2)2(Ge[3,4,4,5,5,6,6]Ge[3,3,4,4,5,5,3x6]Ge[4x4,4x5,4x6])2(SiSi3){2|Si<4>}	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	Ge[3,4,4,5,5,6,6](Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6]Si)(Ge[3,3,4,4,5,5,3x6]Ge[3,3,4,4,5,5,3x6]2Ge[3,4,4,5,5,6,6])(Ge[4x4,4x5,4x6]Ge[3,4,4,5,5,6,6]3Si){1|Si<4>}	77.0040	2.168	4	77.0040	4.702	4	77.0040	4.702	4	77.0040	4.702	4	77.0040	4.702	4	80.9335	50.969	12
982	938	938	4:SPD5_SP2_SP2	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,3x6]	Ge[3,4,4,5,5,6]	4:5:3:3:4:	5:4:5:	5:5:5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,3,4,4,5,3x6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>,1|C<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	72.5682	0.131	2	72.5682	0.017	2	72.5682	0.017	2	72.5682	0.017	2	72.5682	0.017	2	80.9335	50.969	12
982	938	938	5:SPD5_SP2_SP2	Ge[3,4,4,3x5,4x6]	Ge[3,4,4,5,5,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	4:5:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	116.3010	0.000	1	116.3010	0.000	1	116.3010	0.000	1	116.3010	0.000	1	116.3010	0.000	1	116.3010	0.000	1
982	938	938	6:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiC[6a]2C){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	118.8275	1.080	2	118.8275	1.166	2	119.1573	0.534	4	119.1573	0.534	4	119.1573	0.534	4	118.3314	2.521	8
982	938	938	6:SPD5_SP2_SP2	Ge[3,3,4,4,4x6]	Ge[3,4,5,5,3x6]	Ge[3,4,5,5,3x6]	3:3:3:3:4:	5:3:5:	5:3:5:	Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Si-4:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[4,4,4x5,5x6]-5:Ge[3,4,5,5,3x6]-3:Ge[3,3,4,4,4x6]-5:	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si)	Ge[3,3,4,4,4x6](Ge[3,4,5,5,3x6]Ge[3,4,5,5,3x6]Ge[4,4,4x5,5x6])4(SiSi3){2|Ge<2>,2|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[4,4,4x5,5x6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]2Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,4x6]Ge[4,4,4x5,5x6])(Ge[3,3,4,4,4x6]Ge[3,4,5,5,3x6]3Si){1|Si<4>}	119.4870	0.007	2	119.4870	0.000	2	119.1573	0.534	4	119.1573	0.534	4	119.1573	0.534	4	118.3314	2.521	8
982	938	938	6:SPD5_SP2_SP2	Ge[3,3,4,4,5,3x6]	Ge[3,4,4,5,3x6]	Ge[3,4,5,5,3x6]	4:3:3:3:4:	5:4:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,3x6]-3:Ge[3,4,5,5,3x6]-3:Ge[3,4,3x5,6,6]-3:Si-4:	Ge[3,3,4,4,5,3x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,3x5,6,6])(Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Ge[3x4,4x5,4x6])(SiSi3){1|Ge<2>,2|Si<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6]Si)(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	118.7415	0.457	2	118.7415	0.209	2	118.7415	0.209	2	118.7415	0.209	2	118.7415	0.209	2	118.3314	2.521	8
982	938	938	6:SPD5_SP2_SP2	Ge[3,4,4,3x5,4x6]	Ge[3,4,4,5,5,6]	Ge[3,4,5,5,3x6]	4:3:3:2:3:	5:4:4:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:C[6a]-3:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,5,6,6]-4:Ge[3x4,4x5,4x6]-4:	Ge[3,4,4,3x5,4x6]-5:Ge[3,3,4,4,5,3x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2)	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6])	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(C[6a]C[6a]2){1|Sb<3>,2|C<3>,2|H<1>}	Ge[3,4,4,5,5,6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]){1|Sb<3>,2|C<3>}	Ge[3,4,5,5,3x6](Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]C[6a])(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Sb)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){2|C<3>}	114.8080	0.000	1	114.8080	0.000	1	114.8080	0.000	1	114.8080	0.000	1	116.2695	4.272	2	118.3314	2.521	8
982	938	938	6:SPD5_SP2_SP2	Ge[3,4,4,3x5,4x6]	Ge[3,4,4,5,5,6]	Ge[3,4,5,5,3x6]	4:3:3:2:4:	4:5:5:	5:5:3:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,5,5,6]-3:Ge[3,4,5,5,3x6]-3:Ge[4,5,5,6,6]-2:Si-4:	Ge[3,3,4,4,5,5,6,6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,3x5,6,6]-3:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6])(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(SiC[6a]2C){2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]Si)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,4,5,5,3x6](Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)(Ge[3,4,3x5,6,6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6]){1|Si<4>}	117.7310	0.000	1	117.7310	0.000	1	117.7310	0.000	1	117.7310	0.000	1	116.2695	4.272	2	118.3314	2.521	8
982	938	982	3:SPD5_SP2_SPD5	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,5,6]	Ge[3,4,4,3x5,4x6]	4:5:3:3:4:	5:5:5:	5:4:3:2:4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	60.9741	0.461	2	60.9741	0.213	2	60.9741	0.213	2	60.9741	0.213	2	60.9741	0.213	2	62.2583	2.346	4
982	938	982	3:SPD5_SP2_SPD5	Ge[3,4,4,3x5,4x6]	Ge[3,4,4,5,5,6]	Ge[3,3,4,4,5,5,6,6]	5:4:3:2:4:	5:5:5:	4:5:3:3:4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,4,3x5,4x6]-5:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	Ge[3,4,4,5,5,6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,3x6]Si)(Ge[3,4,4,3x5,4x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[4,5,5,6,6]Si){1|Si<4>}	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	63.5425	0.479	2	63.5425	0.229	2	63.5425	0.229	2	63.5425	0.229	2	63.5425	0.229	2	62.2583	2.346	4
982	938	982	6:SPD5_SP2_SPD5	Ge[3,3,4,4,5,5,6,6]	Ge[3,4,4,5,3x6]	Ge[3,4,4,3x5,4x6]	4:5:3:3:4:	5:4:5:	5:4:3:2:4:	Ge[3,3,4,4,5,3x6]-4:Ge[3,4,4,3x5,4x6]-5:Ge[3,4,4,5,3x6]-3:Ge[3,4,4,5,5,6]-3:Si-4:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,3,4,4,5,3x6]-4:Ge[3x4,4x5,4x6]-5:	Ge[3,3,4,4,5,5,6,6]-5:Ge[3,4,5,5,3x6]-4:Ge[3,4,4,5,5,6]-3:Ge[4,5,5,6,6]-2:C-4:	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3)	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si)	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH)	Ge[3,3,4,4,5,5,6,6](Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,3x6]Ge[3,4,5,5,3x6])(Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Ge[3,4,5,5,3x6]Ge[4,5,5,6,6]C)(Ge[3,4,4,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3x4,4x5,4x6])(Ge[3,4,4,5,5,6]Ge[3,4,4,3x5,4x6]Ge[3x4,4x5,4x6])(SiSi3){2|Si<4>}	Ge[3,4,4,5,3x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,3x5,4x6]Ge[3,4,4,5,5,6]Si)(Ge[3,3,4,4,5,3x6]Ge[3,3,4,4,5,5,6,6]Ge[3,4,3x5,6,6]Ge[3,4,5,5,3x6])(Ge[3x4,4x5,4x6]Ge[3,4,3x5,6,6]Ge[3,4,4,5,5,6]Ge[4,5,5,6,6]Si){1|Si<4>,1|C<4>}	Ge[3,4,4,3x5,4x6](Ge[3,3,4,4,5,5,6,6]Ge[3,3,4,4,5,3x6]Ge[3,4,4,5,3x6]Ge[3,4,4,5,5,6]Si)(Ge[3,4,5,5,3x6]Ge[3,3,4,4,5,3x6]Ge[3,4,3x5,6,6]Si)(Ge[3,4,4,5,5,6]Ge[3,3,4,4,5,5,6,6]Ge[3x4,4x5,4x6])(Ge[4,5,5,6,6]Ge[3x4,4x5,4x6])(CCHH){1|Si<4>}	109.4740	0.038	2	109.4740	0.001	2	109.4740	0.001	2	109.4740	0.001	2	109.4740	0.001	2	109.4740	0.001	2
982	944	944	0:SPD5_SP-NON_SP-NON	Ge[3,3]	I	I	3:3:4:1:1:	5:	5:	N[3]-3:N[3]-3:B[3,3]-4:I-1:I-1:	Ge[3,3]-5:	Ge[3,3]-5:	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2	I(Ge[3,3]B[3,3]N[3]2I)	I(Ge[3,3]B[3,3]N[3]2I)	Ge[3,3](N[3]B[3,3]C[6a])2(B[3,3]N[3]2N)(I)2{4|C<3>}	I(Ge[3,3]B[3,3]N[3]2I)	I(Ge[3,3]B[3,3]N[3]2I)	105.8550	0.000	1	105.8550	0.000	1	105.8550	0.000	1	105.8550	0.000	1	105.8550	0.000	1	105.8550	0.000	1
983	2	983	0:SP1_SP1_SP2	C	B[5]	C	3:2:	2:2:2:	3:2:	B[5]-3:C-2:	O[5]-2:O[5]-2:C-2:	B[5]-3:C-2:	C(B[5]O[5]2)(CB[5])	B[5](O[5]C[5])2(CC)	C(B[5]O[5]2)(CB[5])	C(B[5]O[5]2)(CB[5])	B[5](O[5]C[5])2(CC){4|C<4>}	C(B[5]O[5]2)(CB[5])	179.2572	0.243	4	179.2572	0.059	4	179.2572	0.059	4	179.2572	0.059	4	179.2572	0.059	4	179.2572	0.059	4
983	3	983	0:SP1_SP1_SP2	C	B[5a]	C	3:2:	3:3:2:	3:2:	B[5a]-3:C-2:	N[5a]-3:N[5a]-3:C-2:	C[5a]-3:C-2:	C(B[5a]N[5a]2)(CC[5a])	B[5a](N[5a]C[5a,6a]C)2(CC)	C(C[5a]C[5a]S[5a])(CB[5a])	C(B[5a]N[5a]2)(CC[5a])	B[5a](N[5a]C[5a,6a]C)2(CC){2|C<3>}	C(C[5a]C[5a]S[5a])(CB[5a])	174.1926	3.103	5	174.1926	9.631	5	174.1926	9.631	5	174.5507	8.252	9	174.5507	8.252	9	174.5507	8.252	9
983	3	983	0:SP1_SP1_SP2	C	B[5a]	C	3:2:	3:3:2:	3:2:	B[5a]-3:C-2:	N[5a]-3:N[5a]-3:C-2:	C[6a]-3:C-2:	C(B[5a]N[5a]2)(CC[6a])	B[5a](N[5a]C[5a,6a]C)2(CC)	C(C[6a]C[6a]2)(CB[5a])	C(B[5a]N[5a]2)(CC[6a])	B[5a](N[5a]C[5a,6a]C)2(CC){2|C<3>}	C(C[6a]C[6a]2)(CB[5a])	174.9982	2.947	4	174.9982	8.683	4	174.9982	8.683	4	174.5507	8.252	9	174.5507	8.252	9	174.5507	8.252	9
983	18	901	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	N	6:1:	6:6:6:6:6:2:	2:	B[5x3,5x5,20x6]-6:N-1:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CN)	N(CB[5x3,5x5,20x6])	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CN){1|B<6>,5|H<1>}	N(CB[5x3,5x5,20x6])	179.4570	0.000	1	179.4570	0.000	1	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5
983	18	901	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	N	6:1:	6:6:6:6:6:2:	2:	B[5x3,5x5,20x6]-6:N-1:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)4(CN)	N(CB[5x3,5x5,20x6])	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)4(CN){1|C<6>,5|H<1>}	N(CB[5x3,5x5,20x6])	178.5980	0.000	1	178.5980	0.000	1	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5
983	18	901	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	N	6:1:	6:6:6:6:6:2:	2:	B[5x3,5x5,20x6]-6:N-1:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CN)	N(CB[5x3,5x5,20x6])	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CN){1|C<6>,5|H<1>}	N(CB[5x3,5x5,20x6])	177.9553	0.718	3	177.9553	0.515	3	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5	178.3842	0.695	5
983	18	983	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:1:	B[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:H-1:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CH)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC)	C(CB[5x3,5x5,20x6])(H)	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CH)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC){1|C<6>,5|H<1>}	C(CB[5x3,5x5,20x6])(H)	176.9317	1.265	8	176.9317	1.601	8	176.9317	1.601	8	177.0672	1.566	9	176.4557	4.031	17	176.4557	4.031	17
983	18	983	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:1:	B[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:H-1:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CH)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]2C[5x3,5x5,20x6]2H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)(C[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CC)	C(CB[5x3,5x5,20x6])(H)	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CH)	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]2C[5x3,5x5,20x6]2H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)(C[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CC){1|B<6>,1|C<4>,4|H<1>}	C(CB[5x3,5x5,20x6])(H)	178.1510	0.000	1	178.1510	0.000	1	178.1510	0.000	1	177.0672	1.566	9	176.4557	4.031	17	176.4557	4.031	17
983	18	983	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:3:	B[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:C[6a]-3:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4Cl)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CC)	C(CB[5x3,5x5,20x6])(C[6a]C[6a]2)	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4Cl)(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(CC){1|B<6>,5|H<1>}	C(CB[5x3,5x5,20x6])(C[6a]C[6a]2)	174.3690	0.000	1	174.3690	0.000	1	173.9882	5.757	4	173.9882	5.757	4	176.4557	4.031	17	176.4557	4.031	17
983	18	983	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:3:	B[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:C[6a]-3:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC)	C(CB[5x3,5x5,20x6])(C[6a]C[6a]2)	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC){1|C<6>,5|H<1>}	C(CB[5x3,5x5,20x6])(C[6a]C[6a]2)	173.8613	2.922	3	173.8613	8.539	3	173.9882	5.757	4	173.9882	5.757	4	176.4557	4.031	17	176.4557	4.031	17
983	18	983	0:SP1_SP1_SPD6	C	B[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	3:2:	B[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C[6a]-3:C-2:	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC)	C(C[6a]C[5a,6a]C[6a])(CB[5x3,5x5,20x6])	C(B[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(CC[6a])	B[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CC){1|C<6>,5|H<1>}	C(C[6a]C[5a,6a]C[6a])(CB[5x3,5x5,20x6])	177.5473	0.858	4	177.5473	0.736	4	177.5473	0.736	4	177.5473	0.736	4	176.4557	4.031	17	176.4557	4.031	17
983	70	466	0:SP1_SP-NON_SP3	C	P	C[3x6]	4:1:	2:	3:3:3:2:	C[3x6]-4:P-1:	C-2:	C[6,6,6a]-3:C[6,6,6a]-3:C[6,6,6a]-3:C-2:	C(C[3x6]C[6,6,6a]3)(P)	P(CC[3x6])	C[3x6](C[6,6,6a]C[6,6,6a]C[6a])3(CP)	C(C[3x6]C[6,6,6a]3)(P)	P(CC[3x6])	C[3x6](C[6,6,6a]C[6,6,6a]C[6a])3(CP){1|C<4>,3|H<1>,6|C<3>}	178.4755	1.470	2	178.4755	2.161	2	178.4755	2.161	2	178.4755	2.161	2	178.4755	2.161	2	178.4755	2.161	2
983	70	490	0:SP1_SP-NON_SP3	C	P	C	4:1:	2:	3:3:3:2:	C-4:P-1:	C-2:	C[6a]-3:C[6a]-3:C[6a]-3:C-2:	C(CC[6a]3)(P)	P(CC)	C(C[6a]C[6a]2)3(CP)	C(CC[6a]3)(P)	P(CC)	C(C[6a]C[6a]2)3(CP)	178.5050	0.000	1	178.5050	0.000	1	178.5050	0.000	1	178.5050	0.000	1	178.5050	0.000	1	178.5050	0.000	1
983	70	863	0:SP1_SP-NON_SP2	C	P	O	1:1:	2:	2:	O-1:P-1:	C-2:	C-2:	C(O)(P)	P(CO)	O(CP)	C(O)(P)	P(CO)	O(CP)	178.8566	0.852	5	178.8566	0.725	5	178.8566	0.725	5	178.8566	0.725	5	178.8566	0.725	5	178.8566	0.725	5
983	70	956	0:SP1_SP-NON_SP2	C	P	N	3:1:	2:	4:4:2:	N-3:P-1:	C-2:	C-4:Si-4:C-2:	C(NSiC)(P)	P(CN)	N(CCCH)(SiC3)(CP)	C(NSiC)(P)	P(CN)	N(CCCH)(SiC3)(CP)	178.6810	0.000	1	178.6810	0.000	1	178.6810	0.000	1	178.6810	0.000	1	178.6810	0.000	1	178.6810	0.000	1
983	170	901	0:SP1_SP1_SPD7	C	C	N	7:1:	2:1:1:1:1:1:1:	2:	C-7:N-1:	C-2:H-1:H-1:H-1:H-1:H-1:H-1:	C-2:	C(CH6)(N)	C(CN)(H)6	N(CC)	C(CH6)(N)	C(CN)(H)6	N(CC)	180.0000	0.000	1	180.0000	0.000	1	180.0000	0.000	1	180.0000	0.000	1	180.0000	0.000	1	180.0000	0.000	1
983	234	863	0:SP1_SP2_SP3	C	N[3]	O	4:1:	2:2:2:1:	2:	N[3]-4:O-1:	C[3]-2:O[3]-2:C-2:C-1:	C-2:	C(N[3]C[3]O[3]C)(O)	N[3](C[3]O[3])(O[3]C[3])(CO)(C)	O(CN[3])	C(N[3]C[3]O[3]C)(O)	N[3](C[3]O[3])(O[3]C[3])(CO)(C)	O(CN[3])	124.3810	0.000	1	124.3810	0.000	1	124.3810	0.000	1	124.3810	0.000	1	124.3810	0.000	1	124.3810	0.000	1
983	246	983	0:SP1_SP1_SP3	C	P[5]	C	3:2:	3:3:2:	3:2:	P[5]-3:C-2:	C[5,6a]-3:N[5]-3:C-2:	C[6a]-3:C-2:	C(P[5]C[5,6a]N[5])(CC[6a])	P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC)	C(C[6a]C[6a]2)(CP[5])	C(P[5]C[5,6a]N[5])(CC[6a])	P[5](C[5,6a]C[5,6a]C[6a])(N[5]C[6a]C[5])(CC){3|H<1>,4|C<3>}	C(C[6a]C[6a]2)(CP[5])	168.3780	0.000	1	168.3780	0.000	1	168.3780	0.000	1	168.3780	0.000	1	168.3780	0.000	1	168.3780	0.000	1
983	254	983	0:SP1_SP1_SP3	C	Ge[6]	C	4:2:	3:3:3:2:	2:4:	Ge[6]-4:C-2:	N[6]-3:C[6]-3:N-3:C-2:	C-2:C-4:	C(Ge[6]C[6]N[6]N)(CC)	Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC)	C(CGe[6])(CC3)	C(Ge[6]C[6]N[6]N)(CC)	Ge[6](N[6]C[6a]C[6])(C[6]Ga[6]C)(NCC)(CC){1|N<3>,1|S<2>,2|C<3>,2|C<4>}	C(CGe[6])(CC3)	170.9550	0.000	1	170.9550	0.000	1	170.9550	0.000	1	170.9550	0.000	1	170.9550	0.000	1	170.9550	0.000	1
983	278	983	0:SP1_SP1_SP2	C	Ge[6]	C	3:2:	3:3:2:	3:2:	Ge[6]-3:C-2:	N[6,6a]-3:N[6]-3:C-2:	C[6a]-3:C-2:	C(Ge[6]N[6,6a]N[6])(CC[6a])	Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC)	C(C[6a]C[6a]2)(CGe[6])	C(Ge[6]N[6,6a]N[6])(CC[6a])	Ge[6](N[6,6a]C[6,6a]C[6a])(N[6]C[6]Si)(CC){1|H<1>,4|C<3>}	C(C[6a]C[6a]2)(CGe[6])	165.0090	0.000	1	165.0090	0.000	1	165.0090	0.000	1	167.9940	17.820	2	167.9940	17.820	2	167.9940	17.820	2
983	278	983	0:SP1_SP1_SP2	C	Ge[6]	C	3:2:	3:3:2:	3:2:	Ge[6]-3:C-2:	N[6]-3:N[6]-3:C-2:	C[6a]-3:C-2:	C(Ge[6]N[6]2)(CC[6a])	Ge[6](N[6]C[6a]C[6])2(CC)	C(C[6a]C[6a]2)(CGe[6])	C(Ge[6]N[6]2)(CC[6a])	Ge[6](N[6]C[6a]C[6])2(CC){2|C<4>,5|C<3>}	C(C[6a]C[6a]2)(CGe[6])	170.9790	0.000	1	170.9790	0.000	1	170.9790	0.000	1	167.9940	17.820	2	167.9940	17.820	2	167.9940	17.820	2
983	310	901	0:SP1_SP1_SP3	C	Ge	N	4:1:	3:3:2:1:	2:	Ge-4:N-1:	C[6a]-3:C[6a]-3:C-2:H-1:	C-2:	C(GeC[6a]2H)(N)	Ge(C[6a]C[6a]2)2(CN)(H)	N(CGe)	C(GeC[6a]2H)(N)	Ge(C[6a]C[6a]2)2(CN)(H)	N(CGe)	170.2330	0.000	1	170.2330	0.000	1	170.2330	0.000	1	170.2330	0.000	1	170.2330	0.000	1	170.2330	0.000	1
983	310	983	0:SP1_SP1_SP3	C	Ge	C	2:4:	2:2:2:2:	3:2:	C-2:Ge-4:	C-2:C-2:C-2:C-2:	C[6a]-3:C-2:	C(CC[6a])(GeC3)	Ge(CC)4	C(C[6a]C[6a]2)(CGe)	C(CC[6a])(GeC3)	Ge(CC)4	C(C[6a]C[6a]2)(CGe)	174.6180	0.000	1	174.6180	0.000	1	174.6180	0.000	1	174.6180	0.000	1	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	2:4:	4:4:2:2:	3:2:	C-2:Ge-4:	C-4:C-4:C-2:C-2:	C[6a]-3:C-2:	C(CC[6a])(GeC3)	Ge(CH3)2(CC)2	C(C[6a]C[6a]2)(CGe)	C(CC[6a])(GeC3)	Ge(CH3)2(CC)2	C(C[6a]C[6a]2)(CGe)	176.5317	0.833	3	176.5317	0.694	3	176.5317	0.694	3	176.5317	0.694	3	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:2:2:1:	4:2:	Ge-4:C-2:	C[6a]-3:C-2:C-2:Cl-1:	C-4:C-2:	C(GeC[6a]ClC)(CC)	Ge(C[6a]C[6a]2)(CC)2(Cl)	C(CC3)(CGe)	C(GeC[6a]ClC)(CC)	Ge(C[6a]C[6a]2)(CC)2(Cl)	C(CC3)(CGe)	177.3095	0.975	2	177.3095	0.951	2	177.3095	0.951	2	177.3095	0.951	2	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:2:1:	4:2:	Ge-4:C-2:	C[6a]-3:C-3:C-2:Cl-1:	C-4:C-2:	C(GeC[6a]ClC)(CC)	Ge(C[6a]C[6a]2)(CGaC)(CC)(Cl)	C(CC3)(CGe)	C(GeC[6a]ClC)(CC)	Ge(C[6a]C[6a]2)(CGaC)(CC)(Cl)	C(CC3)(CGe)	174.2410	0.000	1	174.2410	0.000	1	174.2410	0.000	1	174.2375	0.000	2	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:2:1:	4:2:	Ge-4:C-2:	C[6a]-3:C[6a]-3:C-2:Cl-1:	C-4:C-2:	C(GeC[6a]2Cl)(CC)	Ge(C[6a]C[6a]2)2(CC)(Cl)	C(CC3)(CGe)	C(GeC[6a]2Cl)(CC)	Ge(C[6a]C[6a]2)2(CC)(Cl)	C(CC3)(CGe)	174.2340	0.000	1	174.2340	0.000	1	174.2340	0.000	1	174.2375	0.000	2	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:2:2:	3:2:	Ge-4:C-2:	C[6a]-3:C[6a]-3:C-2:C-2:	C[6a]-3:C-2:	C(GeC[6a]2C)(CC[6a])	Ge(C[6a]C[6a]2)2(CC)2	C(C[6a]C[6a]2)(CGe)	C(GeC[6a]2C)(CC[6a])	Ge(C[6a]C[6a]2)2(CC)2	C(C[6a]C[6a]2)(CGe)	176.4590	0.000	1	176.4590	0.000	1	176.4590	0.000	1	176.4590	0.000	1	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:2:2:	4:2:	Ge-4:C-2:	C[6a]-3:C[6a]-3:C-2:C-2:	Ge-4:C-2:	C(GeC[6a]2C)(CGe)	Ge(C[6a]C[6a]2)2(CC)2	C(GeC[6a]2C)(CGe)	C(GeC[6a]2C)(CGe)	Ge(C[6a]C[6a]2)2(CC)2	C(GeC[6a]2C)(CGe)	174.2257	3.446	28	174.2257	11.877	28	174.2257	11.877	28	174.2257	11.877	28	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:3:2:	2:2:	Ge-4:C-2:	C[6a]-3:C[6a]-3:C[6a]-3:C-2:	C-2:Se-2:	C(GeC[6a]3)(CSe)	Ge(C[6a]C[6a]2)3(CC)	C(CGe)(SeC)	C(GeC[6a]3)(CSe)	Ge(C[6a]C[6a]2)3(CC)	C(CGe)(SeC)	175.0170	0.000	1	175.0170	0.000	1	175.0170	0.000	1	175.0170	0.000	1	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	3:3:3:2:	4:2:	Ge-4:C-2:	C-3:N-3:N-3:C-2:	C-4:C-2:	C(GeCNN)(CC)	Ge(CGaC)(NCC)2(CC)	C(CC3)(CGe)	C(GeCNN)(CC)	Ge(CGaC)(NCC)2(CC)	C(CC3)(CGe)	168.1120	0.000	1	168.1120	0.000	1	168.1120	0.000	1	168.1120	0.000	1	173.5459	15.030	69	173.5459	15.030	69
983	310	983	0:SP1_SP1_SP3	C	Ge	C	4:2:	4:4:2:2:	4:2:	Ge-4:C-2:	C-4:C-4:C-2:C-2:	Ge-4:C-2:	C(GeC3)(CGe)	Ge(CCCH)2(CC)2	C(GeC3)(CGe)	C(GeC3)(CGe)	Ge(CCCH)2(CC)2	C(GeC3)(CGe)	172.3152	4.328	30	172.3152	18.733	30	172.3152	18.733	30	172.3152	18.733	30	173.5459	15.030	69	173.5459	15.030	69
983	362	901	0:SP1_SP1_SPD6	C	C[5x3,5x5,20x6]	N	6:1:	6:6:6:6:6:2:	2:	C[5x3,5x5,20x6]-6:N-1:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C-2:	C-2:	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CN)	N(CC[5x3,5x5,20x6])	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]5)(N)	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)5(CN){1|B<6>,5|H<1>}	N(CC[5x3,5x5,20x6])	177.4870	0.000	1	177.4870	0.000	1	177.4870	0.000	1	177.4870	0.000	1	177.4870	0.000	1	177.4870	0.000	1
983	362	983	0:SP1_SP1_SPD6	C	C[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:3:	C[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:C-2:	C-2:C[6a]-3:	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]C)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC)	C(CC[5x3,5x5,20x6])(C[6a]C[6a]2)	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]C)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC){1|B<6>,5|H<1>}	C(CC[5x3,5x5,20x6])(C[6a]C[6a]2)	179.0650	0.000	1	179.0650	0.000	1	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4
983	362	983	0:SP1_SP1_SPD6	C	C[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:3:	C[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:C-2:	C-2:C[6a]-3:	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC)	C(CC[5x3,5x5,20x6])(C[6a]C[6a,6a]2)	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC){1|B<6>,5|H<1>}	C(CC[5x3,5x5,20x6])(C[6a]C[6a,6a]2)	177.2670	0.000	1	177.2670	0.000	1	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4
983	362	983	0:SP1_SP1_SPD6	C	C[5x3,5x5,20x6]	C	6:2:	6:6:6:6:6:2:	2:3:	C[5x3,5x5,20x6]-6:C-2:	B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:B[5x3,5x5,20x6]-6:C[5x3,5x5,20x6]-6:C-2:	C-2:C[6a]-3:	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC)	C(CC[5x3,5x5,20x6])(C[6a]C[6a]2)	C(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(CC[6a])	C[5x3,5x5,20x6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]3C[5x3,5x5,20x6]H)2(B[5x3,5x5,20x6]B[5x3,5x5,20x6]4H)2(C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C)(CC){1|B<6>,5|H<1>}	C(CC[5x3,5x5,20x6])(C[6a]C[6a]2)	175.3955	0.865	2	175.3955	0.748	2	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4	176.7808	3.347	4
983	430	901	0:SP1_SP-NON_SP1	C	Se	N	1:1:	2:	2:	Se-1:N-1:	C-2:	C-2:	C(Se)(N)	Se(CN)	N(CSe)	C(Se)(N)	Se(CN)	N(CSe)	177.8566	1.161	8	177.8566	1.348	8	177.8566	1.348	8	177.8566	1.348	8	177.8566	1.348	8	177.8566	1.348	8
983	430	941	0:SP1_SP-NON_SP2	C	Se	N	2:1:	2:	4:2:	N-2:Se-1:	C-2:	C-4:C-2:	C(NC)(Se)	Se(CN)	N(CCHH)(CSe)	C(NC)(Se)	Se(CN)	N(CCHH)(CSe)	179.4210	0.356	2	179.4210	0.127	2	179.4210	0.127	2	179.4210	0.127	2	179.4210	0.127	2	179.4210	0.127	2
983	466	466	0:SP1_SP3_SP3	C	C[6]	C[6]	4:4:	4:4:2:1:	4:4:2:1:	C[6]-4:C[6]-4:	C[6]-4:C[6]-4:C-2:H-1:	C[6]-4:C[6]-4:C-2:H-1:	C(C[6]C[6]2H)2	C[6](C[6]C[6]HH)2(CC[6])(H)	C[6](C[6]C[6]HH)2(CC[6])(H)	C(C[6]C[6]2H)2	C[6](C[6]C[6]HH)2(CC[6])(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)2(CC[6])(H){1|C<4>,4|H<1>}	117.4890	0.000	1	117.4890	0.000	1	117.4890	0.000	1	117.4890	0.000	1	117.4890	0.000	1	117.4890	0.000	1
983	466	490	0:SP1_SP3_SP3	C	C[6]	C	4:4:	3:3:2:1:	2:4:3:1:	C[6]-4:C-4:	C[6]-3:C[6]-3:C-2:H-1:	C-2:C-4:N-3:H-1:	C(C[6]C[6]2H)(CCHN)	C[6](C[6]C[6]H)2(CC)(H)	C(CC[6])(CHHO)(NNiC)(H)	C(C[6]C[6]2H)(CCHN)	C[6](C[6]C[6]H)2(CC)(H){1|C<3>,2|H<1>}	C(CC[6])(CHHO)(NNiC)(H)	110.4690	0.000	1	110.4690	0.000	1	110.4690	0.000	1	110.4690	0.000	1	110.4690	0.000	1	110.4690	0.000	1
983	466	899	0:SP1_SP-NON_SP3	C	C[6]	C	4:1:	3:3:2:2:	2:	C[6]-4:C-1:	C[6]-3:C[6]-3:C-2:O-2:	C-2:	C(C[6]C[6]2O)(C)	C[6](C[6]C[6]Br)2(CC)(OH)	C(CC[6])	C(C[6]C[6]2O)(C)	C[6](C[6]C[6]Br)2(CC)(OH){2|Br<1>,1|C<4>}	C(CC[6])	176.8840	0.000	1	176.8840	0.000	1	176.8840	0.000	1	176.8840	0.000	1	176.8840	0.000	1	176.8840	0.000	1
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	3:4:4:2:	2:	C[3x6]-4:N-1:	C[6,6]-3:C[6,6]-4:C[6,6]-4:C-2:	C-2:	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]N[6]O[6])(C[6,6]C[6]2H)2(CN)	N(CC[3x6])	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]N[6]O[6])(C[6,6]C[6]2H)2(CN){1|C<2>,1|C<4>,3|C<3>,4|H<1>}	N(CC[3x6])	178.2160	0.000	1	178.2160	0.000	1	178.2160	0.000	1	178.2160	0.000	1	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	4:3:3:2:	2:	C[3x6]-4:N-1:	C[6,6]-4:C[6,6]-3:C[6,6]-3:C-2:	C-2:	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]C[6,6]CC)(C[6,6]C[6,6]N)(C[6,6]N[6,6]O)(CN)	N(CC[3x6])	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]C[6,6]CC)(C[6,6]C[6,6]N)(C[6,6]N[6,6]O)(CN){1|C<2>,1|C<4>,2|H<1>}	N(CC[3x6])	176.6895	0.144	2	176.6895	0.021	2	176.6895	0.021	2	176.6895	0.021	2	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	4:4:3:2:	2:	C[3x6]-4:N-1:	C[3x6]-4:C[3x6]-4:C[6]-3:C-2:	C-2:	C(C[3x6]C[3x6]2C[6])(N)	C[3x6](C[3x6]C[3x6]O[6]H)(C[3x6]C[6,6]2H)(C[6]C[6,6a]O)(CN)	N(CC[3x6])	C(C[3x6]C[3x6]2C[6])(N)	C[3x6](C[3x6]C[3x6]O[6]H)(C[3x6]C[6,6]2H)(C[6]C[6,6a]O)(CN){1|C<4>,3|C<3>,4|H<1>}	N(CC[3x6])	179.4250	0.110	2	179.4250	0.012	2	179.4250	0.012	2	178.1263	1.250	6	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	4:4:3:2:	2:	C[3x6]-4:N-1:	C[3x6]-4:C[6,6]-4:C[6]-3:C-2:	C-2:	C(C[3x6]C[3x6]C[6,6]C[6])(N)	C[3x6](C[3x6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]N[6,6]O)(CN)	N(CC[3x6])	C(C[3x6]C[3x6]C[6,6]C[6])(N)	C[3x6](C[3x6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]N[6,6]O)(CN){1|C<2>,2|C<4>,3|C<3>,4|H<1>}	N(CC[3x6])	177.2805	0.565	2	177.2805	0.319	2	177.6090	0.483	3	178.1263	1.250	6	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	4:4:3:2:	2:	C[3x6]-4:N-1:	C[3x6]-4:C[6,6]-4:C[6]-3:C-2:	C-2:	C(C[3x6]C[3x6]C[6,6]C[6])(N)	C[3x6](C[3x6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]N[6]O)(CN)	N(CC[3x6])	C(C[3x6]C[3x6]C[6,6]C[6])(N)	C[3x6](C[3x6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]N[6]O)(CN){1|C<2>,1|C<4>,3|C<3>,4|H<1>}	N(CC[3x6])	178.2660	0.000	1	178.2660	0.000	1	177.6090	0.483	3	178.1263	1.250	6	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[3x6]	N	4:1:	4:4:3:2:	2:	C[3x6]-4:N-1:	C[6,6]-4:C[6,6]-4:C[6,6]-3:C-2:	C-2:	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]C[6]2H)2(C[6,6]N[6]2)(CN)	N(CC[3x6])	C(C[3x6]C[6,6]3)(N)	C[3x6](C[6,6]C[6]2H)2(C[6,6]N[6]2)(CN){1|C<2>,1|C<4>,4|C<3>,5|H<1>}	N(CC[3x6])	177.0810	0.000	1	177.0810	0.000	1	177.0810	0.000	1	178.1263	1.250	6	177.8170	1.193	9	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	3:4:3:2:	2:	C[6,6]-4:N-1:	C[6,6]-3:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(C[6]C[6]O)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(C[6]C[6]O)(CN){1|C<3>,3|C<4>,5|H<1>}	N(CC[6,6])	177.6410	0.000	2	177.6410	0.000	2	177.6410	0.000	2	177.6410	0.000	2	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	3:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]HH)2(CN){1|O<2>,4|C<4>,4|H<1>}	N(CC[6,6])	176.1500	0.474	2	176.1500	0.224	2	176.3035	2.305	4	176.3035	2.305	4	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	3:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2)(C[6]C[6]CH)(C[6]C[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2)(C[6]C[6]CH)(C[6]C[6]HH)(CN){1|C<3>,3|C<4>,5|H<1>}	N(CC[6,6])	174.6410	0.000	1	174.6410	0.000	1	176.3035	2.305	4	176.3035	2.305	4	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	3:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2)(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2)(C[6]C[6]HH)2(CN){1|O<2>,4|C<4>,4|H<1>}	N(CC[6,6])	178.2730	0.000	1	178.2730	0.000	1	176.3035	2.305	4	176.3035	2.305	4	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:3:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-3:C[6,6]-3:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]2)(N)	C[6,6](C[3x6]C[3x6]C[6]H)(C[6,6]C[6,6]C[6])(C[6,6]N[6,6]N[6])(CN)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]2)(N)	C[6,6](C[3x6]C[3x6]C[6]H)(C[6,6]C[6,6]C[6])(C[6,6]N[6,6]N[6])(CN){1|C<2>,2|C<3>,4|H<1>,5|C<4>}	N(CC[6,6])	177.4600	0.467	2	177.4600	0.218	2	177.4600	0.218	2	177.3472	0.917	5	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:3:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-3:C[6]-3:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C[6])(N)	C[6,6](C[3x6]C[3x6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]N[6]N)(CN)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C[6])(N)	C[6,6](C[3x6]C[3x6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]N[6]N)(CN){1|C<2>,2|C<3>,3|C<4>,4|H<1>}	N(CC[6,6])	177.1320	0.000	1	177.1320	0.000	1	177.1320	0.000	1	177.3472	0.917	5	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:3:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-3:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]N)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]N)(CN){2|C<4>,8|H<1>}	N(CC[6,6])	176.0420	0.000	1	176.0420	0.000	1	176.0420	0.000	1	177.3472	0.917	5	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:3:2:	2:	C[6,6]-4:N-1:	C[6]-4:C[6]-3:C[6,6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6]C[6,6a]CC)(C[6]C[6,6a]O)(C[6,6]C[6]2)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6]C[6,6a]CC)(C[6]C[6,6a]O)(C[6,6]C[6]2)(CN){1|O<1>,1|O<2>,4|C<3>}	N(CC[6,6])	178.6420	0.000	1	178.6420	0.000	1	178.6420	0.000	1	177.3472	0.917	5	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-3:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]N[5,6]O)(C[6]C[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]N[5,6]O)(C[6]C[6]HH)(CN){1|C<3>,4|C<4>,4|H<1>}	N(CC[6,6])	178.4970	0.000	1	178.4970	0.000	1	178.0410	0.416	2	178.0410	0.416	2	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:3:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-3:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]CH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]CH)(CN){2|H<1>,4|C<3>}	N(CC[6,6])	177.5850	0.000	1	177.5850	0.000	1	178.0410	0.416	2	178.0410	0.416	2	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	B[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]B[3x6]C[6,6]H)(N)	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]B[3x6]C[6,6]H)(N)	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]CH)(CN)(H){3|H<1>,4|C<3>}	N(CC[6,6])	174.4600	0.000	1	174.4600	0.000	1	174.4600	0.000	1	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:Cl-1:	C-2:	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]HH)(CN)(Cl)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]HH)(CN)(Cl){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	N(CC[6,6])	176.8480	0.000	1	176.8480	0.000	1	177.8206	0.931	13	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:Cl-1:	C-2:	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]HH)(CN)(Cl)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]HH)(CN)(Cl){1|C<3>,1|O<1>,1|O<2>,2|H<1>}	N(CC[6,6])	177.8936	1.007	11	177.8936	1.014	11	177.8206	0.931	13	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:Cl-1:	C-2:	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]HH)(CN)(Cl)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]Cl)(N)	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]HH)(CN)(Cl){1|C<4>,2|C<3>,2|H<1>}	N(CC[6,6])	177.9900	0.000	1	177.9900	0.000	1	177.8206	0.931	13	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]CH)(CN)(H){1|P<2>,4|C<3>}	N(CC[6,6])	177.0850	0.412	2	177.0850	0.169	2	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6,6a]2P)(C[6,6]C[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6,6a]2P)(C[6,6]C[3x6]CH)(CN)(H){1|H<1>,4|C<3>}	N(CC[6,6])	176.6035	1.986	2	176.6035	3.945	2	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]CH)(CN)(H){1|N<3>,2|C<3>,2|H<1>}	N(CC[6,6])	177.6400	0.000	1	177.6400	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CH)(CN)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	N(CC[6,6])	179.1500	0.000	1	179.1500	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]HH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]HH)(CN)(H){1|C<3>,1|C<4>,1|W<7>,3|H<1>}	N(CC[6,6])	176.5650	0.000	1	176.5650	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]CH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]CH)(CN)(H){1|C<3>,2|C<4>,2|H<1>}	N(CC[6,6])	177.3370	0.000	1	177.3370	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]HH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]HH)(CN)(H){1|C<3>,2|C<4>,3|H<1>}	N(CC[6,6])	176.9080	0.000	1	176.9080	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]HH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]HH)(CN)(H){1|C<3>,2|H<1>,3|C<4>}	N(CC[6,6])	178.3930	0.296	2	178.3930	0.087	2	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]O)(C[6,6]C[3x6]HH)(CN)(H)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]H)(N)	C[6,6](C[3x6]C[6,6]N[6,6]O)(C[6,6]C[3x6]HH)(CN)(H){1|C<3>,1|C<4>,1|W<7>,2|H<1>}	N(CC[6,6])	177.0580	0.000	1	177.0580	0.000	1	177.4017	1.075	12	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:1:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6,6]-4:C-2:H-1:	C-2:	C(C[6,6]C[6,6]2H)(N)	C[6,6](C[6,6]C[6]2H)2(CN)(H)	N(CC[6,6])	C(C[6,6]C[6,6]2H)(N)	C[6,6](C[6,6]C[6]2H)2(CN)(H){1|N<3>,1|S<2>,8|H<1>}	N(CC[6,6])	179.3070	0.000	1	179.3070	0.000	1	179.3070	0.000	1	177.5650	1.417	27	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[3x6]-4:O-2:C-2:	C-2:	C(C[6,6]C[3x6]2O)(N)	C[6,6](C[3x6]C[6,6]2H)2(OSi)(CN)	N(CC[6,6])	C(C[6,6]C[3x6]2O)(N)	C[6,6](C[3x6]C[6,6]2H)2(OSi)(CN){2|C<4>,8|H<1>}	N(CC[6,6])	178.6420	0.000	1	178.6420	0.000	1	178.6420	0.000	1	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]CC)(CN)2{1|C<3>,1|H<1>,4|C<4>}	N(CC[6,6])	177.2660	1.412	10	177.5107	1.583	22	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]CC)(CN)2{1|H<1>,2|C<3>,3|C<4>}	N(CC[6,6])	177.7147	1.136	12	177.5107	1.583	22	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]CC)(CN)2{1|C<3>,1|H<1>,4|C<4>}	N(CC[6,6])	177.1008	0.200	4	176.6113	3.671	6	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]CC)(CN)2{1|H<1>,2|C<3>,3|C<4>}	N(CC[6,6])	175.6325	3.919	2	176.6113	3.671	6	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]CC)(CN)2{1|H<1>,2|C<3>,3|C<4>}	N(CC[6,6])	177.0450	2.036	2	177.0450	4.147	2	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]CC)(CN)2{1|H<1>,4|C<3>}	N(CC[6,6])	177.7034	1.072	8	177.7034	1.150	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]CC)(CN)2{1|C<4>,2|C<3>,3|H<1>}	N(CC[6,6])	175.6740	2.094	2	175.6740	4.387	2	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]CH)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]CH)(CN)2{1|C<3>,1|C<4>,5|H<1>}	N(CC[6,6])	178.1428	2.141	8	178.1428	4.582	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2{1|C<2>,1|C<4>,1|O<2>,3|H<1>}	N(CC[6,6])	175.6485	0.145	2	176.9865	1.392	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2{1|C<3>,2|C<4>,3|H<1>}	N(CC[6,6])	177.9955	0.592	2	176.9865	1.392	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2{1|C<4>,1|O<2>,2|C<3>,2|H<1>}	N(CC[6,6])	176.5480	1.257	2	176.9865	1.392	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]CC)(CN)2{1|C<4>,2|C<3>,3|H<1>}	N(CC[6,6])	177.7540	0.782	2	176.9865	1.392	8	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]CC)(CN)2{1|C<3>,1|C<4>,3|H<1>}	N(CC[6,6])	178.1885	0.469	2	178.1885	0.220	2	177.4031	2.249	58	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[4x6]-4:C[6,6]-4:C-2:C-2:	C-2:	C(C[6,6]C[4x6]C[6,6]C)(N)	C[6,6](C[4x6]C[5,3x6]C[6,6]C[6])(C[6,6]C[3x6]CC)(CN)2	N(CC[6,6])	C(C[6,6]C[4x6]C[6,6]C)(N)	C[6,6](C[4x6]C[5,3x6]C[6,6]C[6])(C[6,6]C[3x6]CC)(CN)2{1|C<3>,3|H<1>,5|C<4>}	N(CC[6,6])	176.7685	4.219	2	176.7685	17.803	2	176.7685	17.803	2	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[5,6,6]-4:C[3x6]-4:C-2:C-2:	C-2:	C(C[6,6]C[5,6,6]C[3x6]C)(N)	C[6,6](C[5,6,6]C[5,6a]C[3x6]C[5])(C[3x6]C[6,6]2H)(CN)2	N(CC[6,6])	C(C[6,6]C[5,6,6]C[3x6]C)(N)	C[6,6](C[5,6,6]C[5,6a]C[3x6]C[5])(C[3x6]C[6,6]2H)(CN)2{1|C<4>,1|N<3>,1|O<1>,3|H<1>,4|C<3>}	N(CC[6,6])	174.9165	0.424	2	174.9165	0.179	2	174.9165	0.179	2	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:2:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[3x6]-4:C-2:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[6,6]C[3x6]C[6a]H)(C[3x6]C[6,6]2O)(CN)2	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]C)(N)	C[6,6](C[6,6]C[3x6]C[6a]H)(C[3x6]C[6,6]2O)(CN)2{1|C<4>,3|C<3>,4|H<1>}	N(CC[6,6])	178.5655	0.213	2	178.5655	0.045	2	178.5655	0.045	2	177.3619	2.555	65	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:N-3:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]N)(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(NCC)(CN)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]N)(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(NCC)(CN){1|H<1>,4|C<3>}	N(CC[6,6])	177.1560	0.000	1	177.1560	0.000	1	177.1560	0.000	1	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:N[5]-3:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]N[5])(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(N[5]C[5]2)(CN)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]N[5])(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(N[5]C[5]2)(CN){2|C<4>,4|C<3>,5|H<1>}	N(CC[6,6])	174.1850	0.000	1	174.1850	0.000	1	174.1850	0.000	1	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[3x6]-4:C[6,6]-4:N[6]-3:C-2:	C-2:	C(C[6,6]C[3x6]C[6,6]N[6])(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(N[6]C[6]2)(CN)	N(CC[6,6])	C(C[6,6]C[3x6]C[6,6]N[6])(N)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]HH)(N[6]C[6]2)(CN){2|C<4>,4|C<3>,5|H<1>}	N(CC[6,6])	176.0490	0.000	1	176.0490	0.000	1	176.0490	0.000	1	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[5,6]-4:C[6,6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[5,6]C[6,6]C[6])(N)	C[6,6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6]2H)(C[6]N[6]O)(CN)	N(CC[6,6])	C(C[6,6]C[5,6]C[6,6]C[6])(N)	C[6,6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6]2H)(C[6]N[6]O)(CN){1|N<3>,1|O<1>,2|C<3>,3|C<4>,6|H<1>}	N(CC[6,6])	179.0040	0.000	1	179.0040	0.000	1	179.0040	0.000	1	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]N[6]H)(C[6]C[6]CH)(C[6]O[6]O)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]N[6]H)(C[6]C[6]CH)(C[6]O[6]O)(CN){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	N(CC[6,6])	178.1150	0.000	1	178.1150	0.000	1	177.4850	0.343	3	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CH)(C[6]C[6]O)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CH)(C[6]C[6]O)(CN){3|C<4>,7|H<1>}	N(CC[6,6])	177.3840	0.000	1	177.3840	0.000	1	177.4850	0.343	3	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HO)(C[6]N[6]N)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HO)(C[6]N[6]N)(CN){1|C<4>,2|C<3>,6|H<1>}	N(CC[6,6])	176.9560	0.000	1	176.9560	0.000	1	177.4850	0.343	3	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:3:2:	2:	C[6,6]-4:N-1:	C[6]-4:C[6,6]-4:C[6]-3:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6]C[6a]C[6]H)(C[6,6]C[6]2H)(C[6]N[6]O)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6]C[6a]C[6]H)(C[6,6]C[6]2H)(C[6]N[6]O)(CN){2|C<4>,3|C<3>,5|H<1>}	N(CC[6,6])	175.5660	0.000	1	175.5660	0.000	1	175.5660	0.000	1	176.8019	2.286	8	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[5,6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[5,6,6]C[6]2)(N)	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[5,6,6]C[6]2)(N)	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]HH)2(CN){2|O<2>,4|H<1>,5|C<4>}	N(CC[6,6])	174.2430	0.000	1	174.2430	0.000	1	174.2430	0.000	1	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5a,6]C[6,6a]H)(C[6]C[6a]O[6]H)(C[6]N[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5a,6]C[6,6a]H)(C[6]C[6a]O[6]H)(C[6]N[6]HH)(CN){1|S<4>,6|C<3>}	N(CC[6,6])	178.5240	0.000	1	178.5240	0.000	1	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5a,6]C[6,6a]H)(C[6]C[6a]O[6]H)(C[6]O[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[5a,6]C[6,6a]H)(C[6]C[6a]O[6]H)(C[6]O[6]HH)(CN){6|C<3>}	N(CC[6,6])	178.7585	1.173	2	178.7585	1.376	2	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)2(CN){1|C<3>,2|C<4>,2|O<2>,5|H<1>}	N(CC[6,6])	174.3960	0.000	1	174.3960	0.000	1	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]2H)(C[6]C[6a]O[6]H)(C[6]N[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]2H)(C[6]C[6a]O[6]H)(C[6]N[6]HH)(CN){1|S<4>,6|C<3>}	N(CC[6,6])	177.7110	0.000	1	177.7110	0.000	1	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]2H)(C[6]C[6a]O[6]H)(C[6]O[6]HH)(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6,6a]2H)(C[6]C[6a]O[6]H)(C[6]O[6]HH)(CN){6|C<3>}	N(CC[6,6])	176.7305	0.173	2	176.7305	0.030	2	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)2(CN){1|C<3>,1|O<2>,3|C<4>,4|H<1>}	N(CC[6,6])	175.9900	1.556	2	175.9900	2.420	2	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6,6]	N	4:1:	4:4:4:2:	2:	C[6,6]-4:N-1:	C[6,6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]HH)2(CN)	N(CC[6,6])	C(C[6,6]C[6,6]C[6]2)(N)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]HH)2(CN){2|C<3>,6|H<1>}	N(CC[6,6])	178.5450	0.000	1	178.5450	0.000	1	177.2134	2.637	10	176.9434	3.176	11	177.3136	2.195	124	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	2:3:2:1:	2:	C[6]-4:N-1:	O[6]-2:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[5,6])(C[6]N[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[5,6])(C[6]N[6]C)(CN)(H){1|Ni<4>,1|H<1>,2|C<3>}	N(CC[6])	177.2580	0.946	2	177.2580	0.895	2	178.0170	2.176	3	178.0170	2.176	3	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	2:3:2:1:	2:	C[6]-4:N-1:	O[6]-2:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[6,6])(C[6]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[6,6])(C[6]C[6]H)(CN)(H){1|C<3>,1|C<4>,2|H<1>}	N(CC[6])	179.5350	0.000	1	179.5350	0.000	1	178.0170	2.176	3	178.0170	2.176	3	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	2:4:2:1:	2:	C[6]-4:N-1:	O[6]-2:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[6,6a])(C[6]N[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6]O[6]H)(N)	C[6](O[6]C[6,6a])(C[6]N[6]HH)(CN)(H){3|C<3>}	N(CC[6])	176.6050	0.000	1	176.6050	0.000	1	176.6050	0.000	1	176.6050	0.000	1	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	2:4:2:2:	2:	C[6]-4:N-1:	O[6]-2:C-4:O[6]-2:C-2:	C-2:	C(C[6]O[6]2C)(N)	C[6](O[6]C[6,6])(CC[6a]HH)(O[6]C[6])(CN)	N(CC[6])	C(C[6]O[6]2C)(N)	C[6](O[6]C[6,6])(CC[6a]HH)(O[6]C[6])(CN){2|C<4>,3|H<1>}	N(CC[6])	176.9207	0.819	3	176.9207	0.671	3	176.9207	0.671	3	176.9207	0.671	3	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:2:4:2:	2:	C[6]-4:N-1:	N[3,6]-3:O[6]-2:C-4:C-2:	C-2:	C(C[6]N[3,6]O[6]C)(N)	C[6](N[3,6]C[3,6]C[3])(O[6]C[6])(CCl3)(CN)	N(CC[6])	C(C[6]N[3,6]O[6]C)(N)	C[6](N[3,6]C[3,6]C[3])(O[6]C[6])(CCl3)(CN){1|C<3>,1|C<4>,4|H<1>}	N(CC[6])	176.6745	1.276	2	176.6745	1.629	2	176.6745	1.629	2	176.6745	1.629	2	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6,6a]C)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6,6a]C)(CN)(H){1|H<1>,4|C<3>}	N(CC[6])	177.1900	0.000	1	177.1900	0.000	1	177.7899	0.680	13	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CN)(H){1|C<4>,1|H<1>,3|C<3>}	N(CC[6])	177.7850	0.000	1	178.2048	0.528	6	177.7899	0.680	13	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CN)(H){1|C<4>,2|C<3>,3|H<1>}	N(CC[6])	178.2888	0.779	5	178.2048	0.528	6	177.7899	0.680	13	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]C[6])(CN)(H)	N(CC[6])	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]C[6])(CN)(H){1|C<4>,3|H<1>,4|C<3>}	N(CC[6])	177.5048	0.936	5	177.5048	0.875	5	177.7899	0.680	13	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]Si[6])(CN)(H)	N(CC[6])	C(C[6]C[6,6a]N[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6a]Si[6])(CN)(H){1|H<1>,2|O<2>,5|C<3>}	N(CC[6])	177.3260	0.000	1	177.3260	0.000	1	177.7899	0.680	13	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	C[6]-3:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](C[6]N[6]O)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](C[6]N[6]O)(N[6]C[6]C)(CN)(H){1|O<1>,2|C<4>}	N(CC[6])	178.8580	0.000	1	178.8580	0.000	1	178.8580	0.000	1	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:1:	2:	C[6]-4:N-1:	N[6]-3:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CN)(H){1|H<1>,2|C<3>}	N(CC[6])	178.5535	1.535	2	178.5535	2.357	2	178.5535	2.357	2	177.9521	0.827	16	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:2:	2:	C[6]-4:N-1:	C[5a,6]-3:N[6]-3:C-2:S-2:	C-2:	C(C[6]C[5a,6]N[6]S)(N)	C[6](C[5a,6]C[5a,6]C[5a])(N[6]C[5a]C[6])(CN)(SS)	N(CC[6])	C(C[6]C[5a,6]N[6]S)(N)	C[6](C[5a,6]C[5a,6]C[5a])(N[6]C[5a]C[6])(CN)(SS){1|C<2>,1|C<3>,1|C<4>,2|N<2>,2|N<3>}	N(CC[6])	176.6630	0.000	1	176.6630	0.000	1	176.6630	0.000	1	175.9240	10.073	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CN)2	N(CC[6])	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(CN)2{1|C<4>,1|H<1>,3|C<3>}	N(CC[6])	174.0810	3.767	2	174.0810	14.194	2	174.0810	14.194	2	175.9240	10.073	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:2:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-3:O-2:C-2:	C-2:	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]H)2(OSi)(CN)	N(CC[6])	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]H)2(OSi)(CN){1|C<4>,2|H<1>}	N(CC[6])	178.8710	0.000	1	178.8710	0.000	1	178.8710	0.000	1	175.9240	10.073	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:3:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6,6a]-3:C-3:C-2:	C-2:	C(C[6]C[6,6a]2C)(N)	C[6](C[6,6a]C[6,6a]C[6a])2(CCC)(CN)	N(CC[6])	C(C[6]C[6,6a]2C)(N)	C[6](C[6,6a]C[6,6a]C[6a])2(CCC)(CN){1|C<4>,2|H<1>,4|C<3>}	N(CC[6])	177.9277	1.213	3	177.9874	1.177	5	177.9874	1.177	5	177.7823	1.194	6	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:3:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6,6a]-3:C-3:C-2:	C-2:	C(C[6]C[6,6a]2C)(N)	C[6](C[6,6a]C[6,6a]C[6a])2(CCC)(CN)	N(CC[6])	C(C[6]C[6,6a]2C)(N)	C[6](C[6,6a]C[6,6a]C[6a])2(CCC)(CN){2|H<1>,5|C<3>}	N(CC[6])	178.0770	1.319	2	177.9874	1.177	5	177.9874	1.177	5	177.7823	1.194	6	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:3:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6,6a]-3:C[6a]-3:C-2:	C-2:	C(C[6]C[6,6a]2C[6a])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)(CN)	N(CC[6])	C(C[6]C[6,6a]2C[6a])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6a]C[6a]2)(CN){1|O<2>,3|H<1>,7|C<3>}	N(CC[6])	176.7570	0.000	1	176.7570	0.000	1	176.7570	0.000	1	177.7823	1.194	6	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[5a,6]-3:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[5a,6]N[6]C)(N)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6]C)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[5a,6]N[6]C)(N)	C[6](C[5a,6]C[5a,6]N[5a])(N[6]C[6]C)(CC[6a]HH)(CN){2|C<3>,2|C<4>,2|H<1>}	N(CC[6])	176.2850	3.425	2	176.2850	11.732	2	176.2850	11.732	2	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6,6a]-3:C[6]-4:C-2:	C-2:	C(C[6]C[6,6a]2C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]C[6]H)(CN)	N(CC[6])	C(C[6]C[6,6a]2C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6,6a]C[6]H)(CN){1|C<4>,3|H<1>,7|C<3>}	N(CC[6])	176.7640	0.000	1	176.7640	0.000	1	175.9440	1.345	2	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6,6a]-3:C[6]-4:C-2:	C-2:	C(C[6]C[6,6a]2C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6]2H)(CN)	N(CC[6])	C(C[6]C[6,6a]2C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])2(C[6]C[6]2H)(CN){1|Br<1>,2|C<4>,4|H<1>,5|C<3>}	N(CC[6])	175.1240	0.000	1	175.1240	0.000	1	175.9440	1.345	2	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CCCH)(CN)	N(CC[6])	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CCCH)(CN){1|C<4>,2|C<3>,3|H<1>}	N(CC[6])	175.9850	0.619	2	175.9850	0.384	2	173.8832	5.156	5	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CC[6a]CH)(CN)	N(CC[6])	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CC[6a]CH)(CN){2|H<1>,3|C<3>}	N(CC[6])	170.6700	0.000	1	170.6700	0.000	1	173.8832	5.156	5	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:3:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CH3)(CN)	N(CC[6])	C(C[6]C[6,6a]N[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(N[6]C[6]C)(CH3)(CN){1|C<4>,2|C<3>,3|H<1>}	N(CC[6])	173.3880	0.768	2	173.3880	0.590	2	173.8832	5.156	5	174.8749	5.610	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[5a,6]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5a,6]C[6]H)(N)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]CH)(CN)(H)	N(CC[6])	C(C[6]C[5a,6]C[6]H)(N)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]CH)(CN)(H){2|C<3>,2|N<2>}	N(CC[6])	175.2790	0.000	1	175.2790	0.000	1	175.2790	0.000	1	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:C[5,6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6a]C[5,6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6]C[5]H)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]C[5,6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[5,6]C[5,6]C[5]H)(CN)(H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	N(CC[6])	177.1360	0.000	1	177.1360	0.000	1	177.1360	0.000	1	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]HH)(CN)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	N(CC[6])	177.4900	0.000	1	177.4900	0.000	1	177.5460	0.772	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HN)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HN)(CN)(H){1|C<4>,2|C<3>,3|H<1>}	N(CC[6])	178.6230	0.000	1	178.6230	0.000	1	177.5460	0.772	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)(H){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N(CC[6])	177.5970	0.000	1	177.0355	0.631	2	177.5460	0.772	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[6,6a]C[6]H)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)(H){1|N<3>,3|H<1>,4|C<3>}	N(CC[6])	176.4740	0.000	1	177.0355	0.631	2	177.5460	0.772	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	N[5,6]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]N[5,6]C[6]H)(N)	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6,6]CH)(CN)(H)	N(CC[6])	C(C[6]N[5,6]C[6]H)(N)	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6,6]CH)(CN)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N(CC[6])	176.5890	0.000	1	176.5890	0.000	1	176.5890	0.000	1	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	N[6,6]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]N[6,6]C[6]H)(N)	C[6](N[6,6]C[6,6]N[6])(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]N[6,6]C[6]H)(N)	C[6](N[6,6]C[6,6]N[6])(C[6]C[6]HH)(CN)(H){1|O<2>,3|C<4>,3|H<1>}	N(CC[6])	174.6540	1.089	3	174.6540	1.187	3	175.5453	3.968	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	N[6,6]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]N[6,6]C[6]H)(N)	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]N[6,6]C[6]H)(N)	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]HH)(CN)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	N(CC[6])	178.2190	0.000	1	178.2190	0.000	1	175.5453	3.968	4	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:1:	2:	C[6]-4:N-1:	N[6]-3:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](N[6]C[6,6a]H)(C[6]S[6]CC)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](N[6]C[6,6a]H)(C[6]S[6]CC)(CN)(H){2|C<3>}	N(CC[6])	177.8200	0.000	1	177.8200	0.000	1	177.8200	0.000	1	176.5991	2.343	12	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[5a,6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5a,6]C[6]C)(N)	C[6](C[5a,6]C[5a,5a]C[5a,6])(C[6]C[6,6a]CC)(CN)2	N(CC[6])	C(C[6]C[5a,6]C[6]C)(N)	C[6](C[5a,6]C[5a,5a]C[5a,6])(C[6]C[6,6a]CC)(CN)2{2|N<3>,3|C<3>}	N(CC[6])	177.1660	1.191	2	177.1660	1.418	2	176.8367	2.805	4	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[5a,6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5a,6]C[6]C)(N)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[5a,6]C[6]C)(N)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]CH)(CN)2{1|C<4>,1|H<1>,1|N<3>,3|C<3>}	N(CC[6])	176.5075	2.562	2	176.5075	6.563	2	176.8367	2.805	4	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]CC)(CN)2	N(CC[6])	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]CC)(CN)2{1|H<1>,4|C<3>}	N(CC[6])	177.2460	1.977	2	177.2460	3.909	2	176.9257	2.614	6	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)2	N(CC[6])	C(C[6]C[6,6a]C[6]C)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6]H)(CN)2{1|N<3>,3|H<1>,4|C<3>}	N(CC[6])	176.7655	1.718	4	176.7655	2.951	4	176.9257	2.614	6	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(CN)2{1|S<2>,2|H<1>,3|C<3>}	N(CC[6])	177.9580	0.000	1	177.9580	0.000	1	178.2157	0.080	3	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(CN)2{1|C<4>,2|H<1>,3|C<3>}	N(CC[6])	178.3445	0.244	2	178.3445	0.060	2	178.2157	0.080	3	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	N[6,6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]HH)(CN)2{1|O<2>,2|H<1>,3|C<3>}	N(CC[6])	177.4885	2.289	4	177.4885	5.239	4	177.6737	3.794	6	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:2:2:	2:	C[6]-4:N-1:	N[6,6]-3:C[6]-4:C-2:C-2:	C-2:	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]N[6])(C[6]C[6a]C[6]H)(CN)2	N(CC[6])	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]N[6])(C[6]C[6a]C[6]H)(CN)2{1|C<4>,3|H<1>,4|C<3>}	N(CC[6])	178.0440	1.686	2	178.0440	2.842	2	177.6737	3.794	6	177.3468	2.535	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:3:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6]C[6,6a]C[6]2)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HH)(C[6]C[6]2)(CN)	N(CC[6])	C(C[6]C[6,6a]C[6]2)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]HH)(C[6]C[6]2)(CN){1|N<3>,2|C<4>,3|C<3>,5|H<1>}	N(CC[6])	174.6750	0.000	1	174.6750	0.000	1	174.6750	0.000	1	177.3333	3.633	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:3:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[5a,6a]C[6a])(C[6]C[6]CH)(C[6]C[6]O)(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[5a,6a]C[6a])(C[6]C[6]CH)(C[6]C[6]O)(CN){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	N(CC[6])	178.7040	0.260	2	178.7040	0.068	2	178.2193	0.739	3	177.3333	3.633	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:3:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-3:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]C)(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]C)(CN){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	N(CC[6])	177.2500	0.000	1	177.2500	0.000	1	178.2193	0.739	3	177.3333	3.633	4	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[5a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[5a]C[6]2)(N)	C[6](C[5a]C[5a,6a]C[5a])(C[6]C[6]HH)2(CN)	N(CC[6])	C(C[6]C[5a]C[6]2)(N)	C[6](C[5a]C[5a,6a]C[5a])(C[6]C[6]HH)2(CN){1|N<3>,1|S<2>,2|C<3>,5|H<1>}	N(CC[6])	179.1480	0.000	1	179.1480	0.000	1	178.6970	0.407	2	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[5a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[5a]C[6]2)(N)	C[6](C[5a]N[5a]S[5a])(C[6]C[6a]O[6]H)(C[6]C[6]HH)(CN)	N(CC[6])	C(C[6]C[5a]C[6]2)(N)	C[6](C[5a]N[5a]S[5a])(C[6]C[6a]O[6]H)(C[6]C[6]HH)(CN){1|C<4>,5|C<3>}	N(CC[6])	178.2460	0.000	1	178.2460	0.000	1	178.6970	0.407	2	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6,6a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6,6a]C[6]2)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[3,6]O)(C[6]C[6]HH)(CN)	N(CC[6])	C(C[6]C[6,6a]C[6]2)(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[3,6]O)(C[6]C[6]HH)(CN){1|O<2>,2|C<4>,4|C<3>,4|H<1>}	N(CC[6])	177.2295	0.064	2	177.2295	0.004	2	177.2295	0.004	2	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]CH)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]CH)(CC[6a]HH)(CN){2|C<3>}	N(CC[6])	179.3075	0.562	2	179.3075	0.316	2	177.8632	1.188	8	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HH)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HH)(CC[6a]HH)(CN){2|C<3>}	N(CC[6])	177.0050	0.863	2	177.0050	0.744	2	177.8632	1.188	8	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HN)(CCHH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HN)(CCHH)(CN){2|C<3>}	N(CC[6])	178.4050	0.000	1	178.4050	0.000	1	177.8632	1.188	8	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HO)(CCHH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HO)(CCHH)(CN){2|C<3>}	N(CC[6])	176.9680	0.000	1	176.9680	0.000	1	177.8632	1.188	8	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HO)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]O)(C[6]O[6]HO)(CC[6a]HH)(CN){2|C<3>}	N(CC[6])	177.4540	0.429	2	177.4540	0.184	2	177.8632	1.188	8	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[5a,6a]N[6a])(C[6]C[6,6a]HH)(C[6]C[6]HH)(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[5a,6a]N[6a])(C[6]C[6,6a]HH)(C[6]C[6]HH)(CN){2|H<1>,5|C<3>}	N(CC[6])	175.7690	0.000	1	175.7690	0.000	1	176.7063	3.155	4	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN){1|Br<1>,1|C<4>,2|C<3>,5|H<1>}	N(CC[6])	175.5180	0.000	1	177.0187	4.148	3	176.7063	3.155	4	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	N(CC[6])	179.3370	0.000	1	177.0187	4.148	3	176.7063	3.155	4	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	C[6a]-3:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN)	N(CC[6])	C(C[6]C[6a]C[6]2)(N)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)2(CN){1|Cl<1>,1|C<4>,2|C<3>,5|H<1>}	N(CC[6])	176.2010	0.000	1	177.0187	4.148	3	176.7063	3.155	4	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	3:4:4:2:	2:	C[6]-4:N-1:	N[6,6]-3:C[6]-4:C-4:C-2:	C-2:	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]HH)(CH3)(CN)	N(CC[6])	C(C[6]N[6,6]C[6]C)(N)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]HH)(CH3)(CN){3|C<4>,5|H<1>}	N(CC[6])	178.9060	0.000	1	178.9060	0.000	1	178.9060	0.000	1	177.6759	1.640	17	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:2:2:1:	2:	C[6]-4:N-1:	C[6]-4:O[6]-2:C-2:H-1:	C-2:	C(C[6]C[6]O[6]H)(N)	C[6](C[6]C[6]HH)(O[6]C[6,6])(CN)(H)	N(CC[6])	C(C[6]C[6]O[6]H)(N)	C[6](C[6]C[6]HH)(O[6]C[6,6])(CN)(H){2|C<4>,3|H<1>}	N(CC[6])	179.4540	0.000	1	179.4540	0.000	1	179.4540	0.000	1	179.4540	0.000	1	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:2:4:2:	2:	C[6]-4:N-1:	C[5,6]-4:O[6]-2:C-4:C-2:	C-2:	C(C[6]C[5,6]O[6]C)(N)	C[6](C[5,6]C[5,6]O[5]H)(O[6]C[6])(CHHO)(CN)	N(CC[6])	C(C[6]C[5,6]O[6]C)(N)	C[6](C[5,6]C[5,6]O[5]H)(O[6]C[6])(CHHO)(CN){1|C<2>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	N(CC[6])	172.5030	0.000	1	172.5030	0.000	1	172.5030	0.000	1	172.5030	0.000	1	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[3,6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[3,6]C[6]H)(N)	C[6](C[3,6]C[3,5,6]C[3,6]H)(C[6]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[3,6]C[6]H)(N)	C[6](C[3,6]C[3,5,6]C[3,6]H)(C[6]C[6]H)(CN)(H){1|H<1>,2|C<4>,2|O<2>}	N(CC[6])	179.0900	0.615	2	179.0900	0.378	2	179.0900	0.378	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[3,6]-4:N[6,6]-3:C-2:H-1:	C-2:	C(C[6]C[3,6]N[6,6]H)(N)	C[6](C[3,6]C[3,6]C[6]O[3])(N[6,6]C[3x6]C[6])(CN)(H)	N(CC[6])	C(C[6]C[3,6]N[6,6]H)(N)	C[6](C[3,6]C[3,6]C[6]O[3])(N[6,6]C[3x6]C[6])(CN)(H){1|N<3>,4|C<4>,5|H<1>}	N(CC[6])	176.9395	1.520	2	176.9395	2.309	2	176.9395	2.309	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[3,6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[3,6]N[6]H)(N)	C[6](C[3,6]C[3,6]N[3]H)(N[6]C[6,6a]C)(CN)(H)	N(CC[6])	C(C[6]C[3,6]N[6]H)(N)	C[6](C[3,6]C[3,6]N[3]H)(N[6]C[6,6a]C)(CN)(H){1|H<1>,1|S<4>,2|C<3>}	N(CC[6])	176.3670	0.000	1	176.3670	0.000	1	176.3670	0.000	1	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[5,6]N[6]H)(N)	C[6](C[5,6]C[5,6]O[5]C)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[5,6]N[6]H)(N)	C[6](C[5,6]C[5,6]O[5]C)(N[6]C[6]C)(CN)(H){1|O<2>,2|C<4>,3|H<1>}	N(CC[6])	177.7450	0.000	1	177.7450	0.000	1	177.6215	0.031	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[5,6]N[6]H)(N)	C[6](C[5,6]C[5,6]O[5]H)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[5,6]N[6]H)(N)	C[6](C[5,6]C[5,6]O[5]H)(N[6]C[6]C)(CN)(H){1|O<2>,2|C<4>,3|H<1>}	N(CC[6])	177.4980	0.000	1	177.4980	0.000	1	177.6215	0.031	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CN)(H){1|C<3>,2|C<4>,3|H<1>}	N(CC[6])	177.6160	0.000	1	177.6160	0.000	1	177.0150	0.722	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6a]N[6,6]H)(C[6]N[6,6]O)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6a]N[6,6]H)(C[6]N[6,6]O)(CN)(H){2|C<3>,3|C<4>}	N(CC[6])	176.4140	0.000	1	176.4140	0.000	1	177.0150	0.722	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:Cl-1:	C-2:	C(C[6]C[6]2Cl)(N)	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]N)(CN)(Cl)	N(CC[6])	C(C[6]C[6]2Cl)(N)	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]N)(CN)(Cl){4|C<3>}	N(CC[6])	175.9600	1.294	2	175.9600	1.674	2	175.9600	1.674	2	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(CN)(H){1|H<1>,3|C<4>}	N(CC[6])	178.2530	0.000	1	178.2530	0.000	1	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[5a,6]C[6a]H)(C[6]N[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[5a,6]C[6a]H)(C[6]N[6]O)(CN)(H){1|H<1>,4|C<3>}	N(CC[6])	177.5455	0.803	2	177.5455	0.644	2	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CN)(H){1|C<4>,1|O<2>,2|H<1>}	N(CC[6])	179.3200	0.000	1	179.3200	0.000	1	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]CH)(C[6]O[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]CH)(C[6]O[6]O)(CN)(H){2|C<3>}	N(CC[6])	178.2280	0.000	1	178.2280	0.000	1	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CC)(C[6]N[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CC)(C[6]N[6]O)(CN)(H){1|C<3>,2|H<1>}	N(CC[6])	177.3850	0.000	1	177.7150	0.218	2	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CC)(C[6]N[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CC)(C[6]N[6]O)(CN)(H){2|C<3>,2|H<1>}	N(CC[6])	178.0450	0.000	1	177.7150	0.218	2	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]C[6]C)(CN)(H){1|C<4>,1|O<1>,2|H<1>}	N(CC[6])	179.2160	0.000	1	179.2160	0.000	1	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]C)(CN)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	N(CC[6])	177.6400	0.000	1	177.6400	0.000	1	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]O)(CN)(H){1|H<1>,2|C<3>,3|C<4>}	N(CC[6])	179.4560	0.000	1	178.1395	3.466	2	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]O)(CN)(H){2|H<1>,3|C<3>}	N(CC[6])	176.8230	0.000	1	178.1395	3.466	2	178.1325	0.822	11	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[5,6]HH)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[5,6]HH)(N[6]C[6]C)(CN)(H){1|C<4>,2|H<1>,2|O<2>}	N(CC[6])	175.4220	0.000	1	175.4220	0.000	1	176.4590	3.135	4	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[5a,6]HH)(N[6]C[6]O)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[5a,6]HH)(N[6]C[6]O)(CN)(H){1|C<4>,3|C<3>}	N(CC[6])	174.5350	0.000	1	174.5350	0.000	1	176.4590	3.135	4	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(CN)(H){1|C<4>,1|W<7>,2|H<1>}	N(CC[6])	178.2890	0.000	1	177.9395	0.244	2	176.4590	3.135	4	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:1:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-2:H-1:	C-2:	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(CN)(H)	N(CC[6])	C(C[6]C[6]N[6]H)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(CN)(H){1|C<4>,1|W<7>,3|H<1>}	N(CC[6])	177.5900	0.000	1	177.9395	0.244	2	176.4590	3.135	4	177.4966	1.747	26	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]2)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]2)(C[6]C[6]N)(CN)2{1|C<2>,1|C<3>,3|C<4>,5|H<1>}	N(CC[6])	178.5530	0.000	1	178.5530	0.000	1	175.5739	4.005	11	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5,6]C[5])(C[6]C[6]C)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5,6]C[5])(C[6]C[6]C)(CN)2{1|H<1>,1|O<1>,3|C<3>,3|N<3>}	N(CC[6])	175.6540	0.307	2	175.6540	0.094	2	175.5739	4.005	11	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]C[6])(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]C[6])(CN)2{1|N<3>,1|O<1>,3|H<1>,5|C<3>}	N(CC[6])	173.4210	1.047	2	173.4210	1.095	2	175.5739	4.005	11	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6]N)(CN)2{1|C<2>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,3|C<3>}	N(CC[6])	174.4620	3.093	2	175.7683	4.096	6	175.5739	4.005	11	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6]N)(CN)2{1|C<2>,1|C<4>,1|N<3>,1|O<1>,3|C<3>}	N(CC[6])	176.4215	1.390	4	175.7683	4.096	6	175.5739	4.005	11	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]N)(CN)2{1|C<2>,1|C<4>,1|S<2>,3|C<3>}	N(CC[6])	177.9273	0.874	4	177.9273	0.764	4	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]N)(CN)2{1|C<2>,1|C<4>,1|H<1>,3|C<3>}	N(CC[6])	178.2223	1.013	4	178.2223	1.027	4	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]N)(CN)2{1|C<2>,1|H<1>,3|C<3>}	N(CC[6])	178.3975	0.267	2	178.3975	0.071	2	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2{1|C<2>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	N(CC[6])	176.1785	1.609	4	177.0121	2.064	8	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2{1|C<2>,1|H<1>,4|C<3>}	N(CC[6])	177.6655	0.453	2	177.0121	2.064	8	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(CN)2{1|C<2>,4|C<3>}	N(CC[6])	178.0260	0.890	2	177.0121	2.064	8	177.6383	1.523	18	176.8553	3.394	29	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[5]-3:C[6]-3:C-2:	C-2:	C(C[6]C[5]C[6]2)(N)	C[6](C[6]C[5]C[6]C)(C[5]C[5]N[5])(C[6]C[6]O)(CN)	N(CC[6])	C(C[6]C[5]C[6]2)(N)	C[6](C[6]C[5]C[6]C)(C[5]C[5]N[5])(C[6]C[6]O)(CN){1|Cl<1>,1|H<1>,1|N<2>,1|O<1>,4|C<3>}	N(CC[6])	176.3985	0.359	2	176.3985	0.129	2	176.3985	0.129	2	175.3170	1.164	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C[6]-3:C-2:	C-2:	C(C[6]C[6]3)(N)	C[6](C[6]C[6]2H)(C[6]C[6]C)(C[6]C[6]O)(CN)	N(CC[6])	C(C[6]C[6]3)(N)	C[6](C[6]C[6]2H)(C[6]C[6]C)(C[6]C[6]O)(CN){1|Cl<1>,1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	175.4000	0.000	1	175.4000	0.000	1	175.4000	0.000	1	175.3170	1.164	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:3:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-3:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(COO)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]CH)(N[6]C[6]C)(COO)(CN){1|N<3>,2|C<4>,2|H<1>}	N(CC[6])	174.7020	0.000	1	174.7020	0.000	1	174.9427	1.199	6	175.3170	1.164	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:3:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-3:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]HH)(N[6]C[6]C)(CC[6a]O)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]HH)(N[6]C[6]C)(CC[6a]O)(CN){1|C<4>,4|H<1>}	N(CC[6])	173.9780	0.257	2	174.9908	1.481	5	174.9427	1.199	6	175.3170	1.164	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:3:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-3:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]HH)(N[6]C[6]C)(CC[6a]O)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6]HH)(N[6]C[6]C)(CC[6a]O)(CN){2|C<4>,3|H<1>}	N(CC[6])	175.6660	1.104	3	174.9908	1.481	5	174.9427	1.199	6	175.3170	1.164	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-3:C-4:C-2:	C-2:	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CCHH)(CN)	N(CC[6])	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CCHH)(CN){1|C<3>,2|C<4>,3|H<1>}	N(CC[6])	175.5930	0.000	1	176.2810	1.263	4	176.2810	1.263	4	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-3:C-4:C-2:	C-2:	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CCHH)(CN)	N(CC[6])	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]O)(CCHH)(CN){3|C<4>,3|H<1>}	N(CC[6])	176.5103	1.257	3	176.2810	1.263	4	176.2810	1.263	4	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]HH)(C[6]N[6]O)(CC[6a]HN)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]HH)(C[6]N[6]O)(CC[6a]HN)(CN){2|C<3>}	N(CC[6])	178.2310	0.000	1	178.2310	0.000	1	177.9410	0.168	2	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-3:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]O)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]O)(CC[6a]HH)(CN){2|C<3>,2|H<1>}	N(CC[6])	177.6510	0.000	1	177.6510	0.000	1	177.9410	0.168	2	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[5,6]HH)(N[6]C[6]C)(CH3)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[5,6]HH)(N[6]C[6]C)(CH3)(CN){1|C<4>,2|H<1>,2|O<2>}	N(CC[6])	175.7020	0.000	1	175.7020	0.000	1	175.6623	0.466	3	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6a]C[6]H)(N[6]C[6]C)(CCHH)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6a]C[6]H)(N[6]C[6]C)(CCHH)(CN){1|C<4>,2|C<3>,2|H<1>}	N(CC[6])	176.3240	0.000	1	175.6425	0.929	2	175.6623	0.466	3	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:3:4:2:	2:	C[6]-4:N-1:	C[6]-4:N[6]-3:C-4:C-2:	C-2:	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6a]C[6]H)(N[6]C[6]C)(CCHH)(CN)	N(CC[6])	C(C[6]C[6]N[6]C)(N)	C[6](C[6]C[6a]C[6]H)(N[6]C[6]C)(CCHH)(CN){1|C<4>,2|C<3>,4|H<1>}	N(CC[6])	174.9610	0.000	1	175.6425	0.929	2	175.6623	0.466	3	176.4437	1.414	9	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[4x6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[4x6]C[6]H)(N)	C[6](C[4x6]C[3x6]C[6,6]2)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[4x6]C[6]H)(N)	C[6](C[4x6]C[3x6]C[6,6]2)(C[6]C[6]HH)(CN)(H){2|O<2>,4|C<4>,5|H<1>}	N(CC[6])	173.1480	0.000	1	173.1480	0.000	1	173.1480	0.000	1	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]CH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]CH)(CN)(H){2|O<2>,3|C<4>,3|H<1>}	N(CC[6])	177.7850	0.000	1	177.7850	0.000	1	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	N(CC[6])	179.1320	0.000	1	178.2423	2.623	3	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)(H){1|N<3>,3|H<1>,4|C<4>}	N(CC[6])	177.7975	2.015	2	178.2423	2.623	3	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[6]HH)(CN)(H){2|H<1>,2|S<2>,3|C<4>}	N(CC[6])	175.2160	0.000	1	175.2160	0.000	1	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]HH)(CN)(H){2|C<3>,2|H<1>,3|C<4>}	N(CC[6])	178.9040	0.000	1	178.9040	0.000	1	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]HH)(CN)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	N(CC[6])	178.2460	0.000	1	178.2460	0.000	1	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[5,6]C[6]H)(N)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]HH)(CN)(H){4|C<4>,6|H<1>}	N(CC[6])	177.4740	0.000	1	177.4740	0.000	1	177.7940	2.005	8	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]CH)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]CH)(CN)(H){1|C<3>,2|H<1>,4|C<4>}	N(CC[6])	177.9130	0.000	1	177.9130	0.000	1	176.8282	7.486	6	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]CH)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]CH)(CN)(H){1|C<3>,3|C<4>,3|H<1>}	N(CC[6])	177.4250	0.000	1	177.4250	0.000	1	176.8282	7.486	6	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]N[6,6]H)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]C[6,6]N[6,6]H)(C[6]C[6]HH)(CN)(H){2|H<1>,2|S<2>,3|C<4>}	N(CC[6])	171.2740	0.000	1	171.2740	0.000	1	176.8282	7.486	6	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]CH)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]CH)(CN)(H){1|C<3>,2|C<4>,4|H<1>}	N(CC[6])	178.2120	0.000	2	178.2120	0.000	2	176.8282	7.486	6	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]N[5,6]CH)(CN)(H)	N(CC[6])	C(C[6]C[6,6]C[6]H)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]N[5,6]CH)(CN)(H){1|C<4>,2|C<3>,2|H<1>}	N(CC[6])	177.9330	0.000	1	177.9330	0.000	1	176.8282	7.486	6	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:Br-1:	C-2:	C(C[6]C[6]2Br)(N)	C[6](C[6]C[6]HH)2(CN)(Br)	N(CC[6])	C(C[6]C[6]2Br)(N)	C[6](C[6]C[6]HH)2(CN)(Br){1|C<4>,4|H<1>}	N(CC[6])	178.0960	0.000	1	178.0960	0.000	1	178.0960	0.000	1	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:Cl-1:	C-2:	C(C[6]C[6]2Cl)(N)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]NO)(CN)(Cl)	N(CC[6])	C(C[6]C[6]2Cl)(N)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]NO)(CN)(Cl){4|C<3>}	N(CC[6])	178.1680	0.000	1	178.1680	0.000	1	178.1680	0.000	1	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[3,6]HH)(C[6]C[6]CH)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[3,6]HH)(C[6]C[6]CH)(CN)(H){1|H<1>,1|O<1>,2|C<4>}	N(CC[6])	177.5970	0.000	1	177.5970	0.000	1	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]HH)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]HH)(C[6]C[6]HH)(CN)(H){1|H<1>,1|N<2>,2|C<3>}	N(CC[6])	177.1490	0.000	1	177.1490	0.000	1	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]HN)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6,6a]HN)(C[6]C[6]HH)(CN)(H){2|C<3>,2|H<1>}	N(CC[6])	178.0920	0.000	1	178.0920	0.000	1	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CN)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	N(CC[6])	177.9700	0.000	1	177.9700	0.000	1	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]N[6]HH)(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]CH)(C[6]N[6]HH)(CN)(H){2|C<4>,2|H<1>}	N(CC[6])	177.5670	0.000	1	177.5670	0.000	1	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:1:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:H-1:	C-2:	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]HH)2(CN)(H)	N(CC[6])	C(C[6]C[6]2H)(N)	C[6](C[6]C[6]HH)2(CN)(H){1|C<4>,4|H<1>}	N(CC[6])	178.7600	0.123	2	178.7600	0.015	2	177.9850	0.375	7	177.4428	3.410	24	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[5,6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]2C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[5,6]N[5,6]N[5]H)(CN)2	N(CC[6])	C(C[6]C[5,6]2C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[5,6]N[5,6]N[5]H)(CN)2{1|C<4>,1|N<3>,1|O<1>,6|C<3>}	N(CC[6])	177.0875	1.696	2	177.0875	2.878	2	177.0875	2.878	2	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]C)(C[6]O[6]CH)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]C)(C[6]O[6]CH)(CN)2{1|H<1>,1|N<2>,1|O<2>,2|C<4>}	N(CC[6])	178.9180	1.284	2	178.9180	1.649	2	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]HH)(CN)2{1|C<3>,1|C<4>,2|O<2>,4|H<1>}	N(CC[6])	179.0185	0.639	2	179.0185	0.408	2	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[5a,6]C[6a]H)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[5a,6]C[6a]H)(CN)2{1|H<1>,1|N<3>,1|O<1>,7|C<3>}	N(CC[6])	178.3162	0.950	4	178.3162	0.903	4	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]CH)(CN)2{1|N<3>,1|O<1>,2|H<1>,4|C<3>}	N(CC[6])	178.6635	0.992	2	178.6635	0.984	2	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]CH)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]CH)(CN)2{1|N<3>,1|O<1>,5|C<3>}	N(CC[6])	178.2957	1.507	3	178.2957	2.270	3	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6a]C[6]H)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]C[5,6a]C[6,6]C[5])(C[6]C[6a]C[6]H)(CN)2{1|N<3>,1|O<1>,2|H<1>,6|C<3>}	N(CC[6])	177.4090	0.112	2	177.4090	0.012	2	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]N[5,6]C[5]C)(C[6]C[6,6a]CH)(CN)2	N(CC[6])	C(C[6]C[5,6]C[6]C)(N)	C[6](C[5,6]N[5,6]C[5]C)(C[6]C[6,6a]CH)(CN)2{2|C<3>,2|C<4>,2|H<1>}	N(CC[6])	177.1053	0.987	8	177.1053	0.974	8	177.9570	1.340	23	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[5,6]-4:C[6]-4:O-2:C-2:	C-2:	C(C[6]C[5,6]C[6]O)(N)	C[6](C[5,6]C[5,5a]C[5,6]H)(C[6]C[6]CC)(OSi)(CN)	N(CC[6])	C(C[6]C[5,6]C[6]O)(N)	C[6](C[5,6]C[5,5a]C[5,6]H)(C[6]C[6]CC)(OSi)(CN){1|C<4>,2|H<1>,3|C<3>}	N(CC[6])	179.8660	0.000	1	179.8660	0.000	1	179.8660	0.000	1	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]HH)(CN)2{1|N<3>,2|C<3>,3|H<1>}	N(CC[6])	177.3705	0.151	2	177.3705	0.023	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]HH)(CN)2{2|H<1>,6|C<3>}	N(CC[6])	176.3790	0.560	2	176.3790	0.314	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]CH)(CN)2{1|C<3>,1|C<4>,2|H<1>}	N(CC[6])	177.6867	1.177	4	177.3780	3.133	6	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]CH)(CN)2{1|O<2>,3|C<3>}	N(CC[6])	176.7605	3.219	2	177.3780	3.133	6	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)2{1|C<3>,1|C<4>,2|H<1>}	N(CC[6])	178.9700	0.433	2	178.3158	0.897	4	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)2{1|C<3>,1|H<1>,2|C<4>}	N(CC[6])	177.6615	0.890	2	178.3158	0.897	4	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CN)2{1|C<4>,2|C<3>,2|H<1>}	N(CC[6])	177.3930	1.000	2	177.3930	1.000	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CN)2{1|C<4>,4|H<1>}	N(CC[6])	178.5575	0.381	2	178.5575	0.145	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]N[6]H)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]N[6]H)(CN)2{1|C<4>,1|S<4>,2|H<1>,4|C<3>}	N(CC[6])	178.1800	1.151	2	178.1800	1.325	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]CH)(CN)2{1|C<4>,3|C<3>,3|H<1>}	N(CC[6])	177.2070	0.714	2	177.2070	0.510	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CC)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CC)(CN)2{1|C<4>,1|H<1>,4|C<3>}	N(CC[6])	174.5298	2.521	4	174.5298	6.358	4	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(CN)2{2|H<1>,4|C<3>}	N(CC[6])	178.2185	0.718	2	178.3730	0.243	6	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(CN)2{3|C<3>,3|H<1>}	N(CC[6])	178.4502	0.457	4	178.3730	0.243	6	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CO)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CO)(CN)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	N(CC[6])	177.7417	1.013	4	177.7417	1.026	4	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CN)2{2|H<1>,4|C<3>}	N(CC[6])	177.4000	0.984	2	177.4000	0.969	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2{1|C<4>,3|H<1>,5|C<3>}	N(CC[6])	176.2213	1.905	6	176.7902	2.892	10	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2{1|H<1>,7|C<3>}	N(CC[6])	177.6785	1.719	2	176.7902	2.892	10	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(CN)2{2|H<1>,6|C<3>}	N(CC[6])	177.6085	0.243	2	176.7902	2.892	10	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]CC)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]CC)(CN)2{1|C<4>,2|H<1>,3|C<3>}	N(CC[6])	177.9255	0.790	2	177.9255	0.624	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]CH)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]CH)(CN)2{1|S<4>,4|C<3>}	N(CC[6])	177.6675	1.155	2	177.6675	1.333	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6a]C[6]H)(CN)2	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6a]C[6]H)(CN)2{1|C<2>,1|C<4>,5|C<3>}	N(CC[6])	178.1840	0.072	2	178.1840	0.005	2	177.3571	2.416	54	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:N-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(CN)(NC)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(CN)(NC){1|C<4>,4|H<1>}	N(CC[6])	177.0940	0.000	1	177.0940	0.000	1	177.0697	0.252	3	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:N-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(CN)(NN)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(CN)(NN){1|C<4>,4|H<1>}	N(CC[6])	177.0575	0.709	2	177.0575	0.503	2	177.0697	0.252	3	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:O-2:	C-2:	C(C[6]C[6]2O)(N)	C[6](C[6]C[5,6]HH)(C[6]C[6]HH)(CN)(OC)	N(CC[6])	C(C[6]C[6]2O)(N)	C[6](C[6]C[5,6]HH)(C[6]C[6]HH)(CN)(OC){1|C<3>,1|C<4>,3|H<1>}	N(CC[6])	177.1780	0.000	1	177.1780	0.000	1	174.4370	8.981	4	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:O-2:	C-2:	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)(OH)	N(CC[6])	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]CC)(C[6]C[6]HH)(CN)(OH){2|C<4>,3|H<1>}	N(CC[6])	171.8485	0.310	2	171.8485	0.096	2	174.4370	8.981	4	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-2:O-2:	C-2:	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HS)(CN)(OC)	N(CC[6])	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HS)(CN)(OC){1|C<4>,4|H<1>}	N(CC[6])	176.8730	0.000	1	176.8730	0.000	1	174.4370	8.981	4	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:2:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:O-2:C-2:	C-2:	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]HH)2(OSi)(CN)	N(CC[6])	C(C[6]C[6]2O)(N)	C[6](C[6]C[6]HH)2(OSi)(CN){1|C<3>,1|C<4>,3|H<1>}	N(CC[6])	178.9580	0.000	1	178.9580	0.000	1	178.9580	0.000	1	177.4120	2.750	88	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[5a,6]C[6,6]H)(C[6]C[6]CC)(CCH)(CN)	N(CC[6])	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[5a,6]C[6,6]H)(C[6]C[6]CC)(CCH)(CN){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	N(CC[6])	176.9670	0.000	1	176.9670	0.000	1	177.6590	0.958	2	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]HH)(COO)(CN)	N(CC[6])	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]HH)(COO)(CN){2|C<3>,2|C<4>,2|H<1>}	N(CC[6])	178.3510	0.000	1	178.3510	0.000	1	177.6590	0.958	2	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[6a]O)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[6a]O)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	175.7830	0.000	1	175.7830	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(COO)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	175.5960	0.000	1	175.5960	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(COO)(CN){1|C<3>,1|C<4>,2|H<1>}	N(CC[6])	178.0530	0.000	1	178.0530	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[5a,6]HO)(CC[6a]O)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[5a,6]HO)(CC[6a]O)(CN){1|H<1>,5|C<3>}	N(CC[6])	177.9920	0.000	1	177.9920	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]CH)(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]CH)(COO)(CN){1|C<4>,3|C<3>,3|H<1>}	N(CC[6])	177.1100	0.000	1	177.1100	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]CH)(COO)(CN){1|C<2>,1|C<4>,2|H<1>,3|C<3>}	N(CC[6])	175.6570	0.000	1	175.6570	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(COO)(CN){1|C<2>,1|C<4>,1|H<1>,4|C<3>}	N(CC[6])	178.9490	0.000	1	177.0315	7.354	2	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(COO)(CN){5|C<3>}	N(CC[6])	175.1140	0.000	1	177.0315	7.354	2	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN){1|C<2>,1|C<4>,1|H<1>,6|C<3>}	N(CC[6])	176.2490	0.000	1	176.1600	0.077	3	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN){1|C<2>,1|C<4>,2|H<1>,5|C<3>}	N(CC[6])	175.8480	0.000	1	176.1600	0.077	3	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)2(COO)(CN){1|C<4>,4|C<3>,4|H<1>}	N(CC[6])	176.3830	0.000	1	176.1600	0.077	3	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-3:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]N[6]H)2(CC[6a]O)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]N[6]H)2(CC[6a]O)(CN){1|H<1>,5|C<3>}	N(CC[6])	174.9860	0.000	1	174.9860	0.000	1	176.4767	1.614	12	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:N-3:C-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]OO)(NHH)(CN)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]OO)(NHH)(CN){4|C<3>}	N(CC[6])	177.2110	0.000	1	177.2110	0.000	1	175.4070	4.509	5	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:N-3:C-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NCH)(CN)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NCH)(CN){1|C<4>,4|H<1>}	N(CC[6])	175.6060	0.000	1	175.6060	0.000	1	175.4070	4.509	5	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:N-3:C-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NCO)(CN)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NCO)(CN){1|C<4>,4|H<1>}	N(CC[6])	173.2490	0.281	2	173.2490	0.079	2	175.4070	4.509	5	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:3:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:N-3:C-2:	C-2:	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NC[6a]H)(CN)	N(CC[6])	C(C[6]C[6]2N)(N)	C[6](C[6]C[6]HH)2(NC[6a]H)(CN){1|N<3>,4|H<1>}	N(CC[6])	177.7200	0.000	1	177.7200	0.000	1	175.4070	4.509	5	176.3196	2.489	19	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[3x6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[3x6]C[6]C)(N)	C[6](C[3x6]C[6,6]2O[6])(C[6]C[6]HH)(CCHH)(CN)	N(CC[6])	C(C[6]C[3x6]C[6]C)(N)	C[6](C[3x6]C[6,6]2O[6])(C[6]C[6]HH)(CCHH)(CN){1|C<3>,2|C<4>,2|O<2>,3|H<1>}	N(CC[6])	179.7030	0.000	2	179.7030	0.000	2	179.7030	0.000	2	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6,6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(CH3)(CN)	N(CC[6])	C(C[6]C[6,6]C[6]C)(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(CH3)(CN){1|C<3>,3|C<4>,4|H<1>}	N(CC[6])	174.7080	0.000	1	174.7080	0.000	1	174.7080	0.000	1	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CCCO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CCCO)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	177.7460	0.000	1	177.7460	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CCHH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CCHH)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	178.6547	0.279	3	178.6547	0.078	3	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[3]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[3]HH)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	178.5200	0.000	1	178.5200	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[3]HO)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[3]HO)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	174.8910	0.000	1	174.8910	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CC[6a]HH)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	177.7200	0.000	1	177.7200	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CH3)(CN){1|C<4>,2|C<3>,2|H<1>}	N(CC[6])	178.0520	0.000	1	178.6620	0.744	2	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]CH)(C[6]C[6]HH)(CH3)(CN){1|O<2>,2|C<4>,2|H<1>}	N(CC[6])	179.2720	0.000	1	178.6620	0.744	2	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HN)(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HN)(CH3)(CN){1|C<4>,4|H<1>}	N(CC[6])	176.8360	0.000	1	176.8360	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HO)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)(C[6]C[6]HO)(CC[6a]HH)(CN){2|C<3>,2|H<1>}	N(CC[6])	176.9780	0.000	1	176.9780	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CH3)(CN){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	N(CC[6])	178.8080	0.000	1	178.6830	0.248	5	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6]HH)2(CH3)(CN){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	N(CC[6])	178.6517	0.569	4	178.6830	0.248	5	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CC[6a]HH)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CC[6a]HH)(CN){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	N(CC[6])	178.0320	0.000	1	178.0320	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C-4:C-2:	C-2:	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CH3)(CN)	N(CC[6])	C(C[6]C[6]2C)(N)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]HH)(CH3)(CN){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	N(CC[6])	178.7190	0.000	1	178.7190	0.000	1	178.1192	1.125	18	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457
983	466	901	0:SP1_SP1_SP3	C	C[6]	N	4:1:	4:4:4:2:	2:	C[6]-4:N-1:	C[6]-4:C[6]-4:C[6]-4:C-2:	C-2:	C(C[6]C[6]3)(N)	C[6](C[6]C[6]2O)(C[6]C[6]CH)(C[6]C[6]HH)(CN)	N(CC[6])	C(C[6]C[6]3)(N)	C[6](C[6]C[6]2O)(C[6]C[6]CH)(C[6]C[6]HH)(CN){1|O<2>,4|C<4>,6|H<1>}	N(CC[6])	176.3340	0.000	1	176.3340	0.000	1	176.3340	0.000	1	178.0270	1.847	22	177.1726	2.950	324	177.2236	2.713	457