992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:2:1:	3:3:4:	3:2:4:	C[5a]-3:C[6a]-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[5a]CO)	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]CO)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[5a]CO){1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]CO){1|C<4>}	108.6610	0.000	1	108.6610	0.000	1	108.6610	0.000	1	108.6610	0.000	1	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	3:3:4:	3:3:4:	C[5a]-3:C[5a]-3:C[6a]-3:S-1:	C[6a]-3:C[6a]-3:P-4:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)2(C[6a]C[6a]2)(S)	C[6a](C[6a]C[6a]H)2(PC[5a]2S)	C[5a](C[5a]C[5a,5a]H)(C[5a]N[5a,5a]C)(PC[5a]C[6a]S)	P(C[5a]C[5a]2)2(C[6a]C[6a]2)(S)	C[6a](C[6a]C[6a]H)2(PC[5a]2S){1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,5a]H)(C[5a]N[5a,5a]C)(PC[5a]C[6a]S){2|C<3>}	110.3180	0.000	1	110.3180	0.000	1	110.3180	0.000	1	110.3180	0.000	1	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	3:3:4:	4:3:2:	C[5a]-3:C[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[5a]-3:O[5a]-2:	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5a]2O)	C[5a](PC[5a]C[6a]O)(C[5a]C[5a]H)(O[5a]C[5a])	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5a]2O){1|C<3>,2|H<1>}	C[5a](PC[5a]C[6a]O)(C[5a]C[5a]H)(O[5a]C[5a]){1|H<1>,1|P<4>}	107.1468	1.096	6	107.1468	1.201	6	107.1468	1.201	6	107.1468	1.201	6	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	3:3:4:	4:3:3:	C[5a]-3:C[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N[5a]-3:C[5a]-3:	P(C[5a]C[5a]N[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]C)2(PC[5a]2O)	C[5a](PC[5a]C[6a]O)(N[5a]C[5a]Ni)(C[5a]C[5a]H)	P(C[5a]C[5a]N[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]C)2(PC[5a]2O){1|C<3>,2|H<1>}	C[5a](PC[5a]C[6a]O)(N[5a]C[5a]Ni)(C[5a]C[5a]H){1|C<3>,1|H<1>}	106.8865	1.159	4	106.8865	1.344	4	106.8865	1.344	4	106.8865	1.344	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	2:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-2:S[5a]-2:P-4:	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(PC[6a]2O)	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a,6a])(S[5a]C[5a,6a])(PC[6a]2O){2|C<3>}	106.3690	2.201	2	106.3690	4.842	2	106.3113	1.822	4	106.3113	1.822	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	2:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-2:S[5a]-2:P-4:	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a])(S[5a]C[5a])(PC[6a]2O)	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a])(S[5a]C[5a])(PC[6a]2O){2|H<1>}	106.2535	0.781	2	106.2535	0.611	2	106.3113	1.822	4	106.3113	1.822	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:H-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:N[5a]-2:P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(H)	C[6a](PC[5a]C[6a]H)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a,6a]C)(N[5a]C[5a,6a])(PC[6a]2H)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(H)	C[6a](PC[5a]C[6a]H)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a,6a]C)(N[5a]C[5a,6a])(PC[6a]2H){2|C<3>}	100.1388	0.997	2	100.1388	0.994	2	100.1388	0.994	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]N[5a])(N[5a]N[5a])(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]N[5a])(N[5a]N[5a])(PC[6a]2O){1|C<3>,1|C<4>,1|N<3>}	105.9297	1.054	4	105.9297	1.111	4	106.0279	2.141	8	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]C)(N[5a]C[5a])(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]C)(N[5a]C[5a])(PC[6a]2O){1|C<3>,1|C<4>}	106.1295	3.371	2	106.1295	11.362	2	106.0279	2.141	8	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]2O){1|C<4>}	106.1225	0.466	2	106.1225	0.217	2	106.0279	2.141	8	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:O[5a]-2:P-4:	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(PC[6a]2O)	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(PC[6a]2O){4|C<3>}	104.6310	0.762	2	104.6310	0.581	2	104.6310	0.581	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:S[5a]-2:P-4:	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2O)	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2O){1|C<3>,1|H<1>}	106.8402	1.595	4	106.8402	2.545	4	106.8402	2.545	4	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:N[5a]-2:P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2O)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2O){2|H<1>}	103.1645	2.341	2	103.1645	5.481	2	103.1645	5.481	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]P)(N[5a]N[5a])(PC[6a]2S)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]P)(N[5a]N[5a])(PC[6a]2S){1|Ir<6>}	104.5965	3.733	2	104.5965	13.934	2	104.5965	13.934	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:O[5a]-2:P-4:	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(PC[6a]2S)	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,6a]C[6a])(O[5a]C[5a,6a])(PC[6a]2S){4|C<3>}	104.9718	1.490	10	104.9718	2.220	10	104.9718	2.220	10	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:S[5a]-2:P-4:	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2S)	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2S){1|B<3>,1|H<1>}	105.0230	1.710	2	105.0230	2.923	2	105.0230	2.923	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:N[5a]-2:P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2S)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2S){2|H<1>}	104.1685	1.348	2	104.1685	1.818	2	104.1685	1.818	2	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:Se-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:S[5a]-2:P-4:	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2Se)	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]H)(S[5a]C[5a])(PC[6a]2Se){1|C<3>,1|H<1>}	106.2327	0.650	4	106.2327	0.422	4	106.2327	0.422	4	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:Se-1:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:N[5a]-2:P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2Se)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a]C)(N[5a]C[5a])(PC[6a]2Se){2|H<1>}	104.5048	2.115	6	104.5048	4.471	6	104.5048	4.471	6	105.0161	4.128	44	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a]-3:P-4:	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]C)(PC[6a]2O)	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]C)(PC[6a]2O){2|C<3>,2|H<1>}	108.0825	2.193	2	108.0825	4.808	2	107.0742	1.217	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a]-3:P-4:	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]O[5a]C)(PC[6a]2O)	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]O[5a]C)(PC[6a]2O){1|H<1>,2|C<3>}	106.7375	0.211	2	106.7375	0.045	2	107.0742	1.217	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a]-3:P-4:	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]O[5a]C[6])(PC[6a]2O)	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]O[5a]C[6])(PC[6a]2O){2|C<3>,2|C<4>,2|H<1>}	106.7385	0.564	4	106.7385	0.319	4	107.0742	1.217	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]C)2	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O){1|C<3>,1|C<4>,1|S<2>}	107.0800	6.795	2	107.0800	46.176	2	107.9098	13.947	6	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]C)(C[5a]N[5a]C)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]C)(C[5a]N[5a]C)(PC[6a]2O){1|H<1>,1|O<2>}	109.8620	3.366	2	109.8620	11.329	2	107.9098	13.947	6	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]C)(C[5a]O[5a]C)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]C)(C[5a]O[5a]C)(PC[6a]2O)	106.7875	0.844	2	106.7875	0.712	2	107.9098	13.947	6	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a,6a]C)(N[5a]C[5a,6a]H)(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,6a]C)(N[5a]C[5a,6a]H)(PC[6a]2O){2|C<3>}	106.9155	1.149	2	106.9155	1.320	2	107.1466	3.082	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]C)(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,6a]C[6a])(N[5a]C[5a,6a]C)(PC[6a]2O){4|C<3>}	106.9925	3.594	2	106.9925	12.918	2	107.1466	3.082	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]C)(N[5a]C[5a]H)(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]C)(N[5a]C[5a]H)(PC[6a]2O){1|C<4>,1|H<1>}	108.5770	0.243	2	108.5770	0.059	2	107.1466	3.082	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]C)(N[5a]C[5a]C)(PC[6a]2O)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]C)(N[5a]C[5a]C)(PC[6a]2O){1|C<3>}	106.1015	0.919	2	106.1015	0.844	2	107.1466	3.082	8	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5a,6a]-3:C[5a]-3:P-4:	P(C[5a]N[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](N[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]Cl)(PC[6a]2O)	P(C[5a]N[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a,6a]C[5a,6a]C[6a])(C[5a]N[5a]Cl)(PC[6a]2O){1|H<1>,2|C<3>}	106.2780	0.682	2	106.2780	0.465	2	106.2780	0.465	2	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a]-3:P-4:	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[6a]N[5a])(PC[6a]2S)	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[6a]N[5a])(PC[6a]2S){1|H<1>,5|C<3>}	107.9360	4.182	2	107.9360	17.488	2	107.9360	17.488	2	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]H)(C[5a]N[5a]C)(PC[6a]2S)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]H)(C[5a]N[5a]C)(PC[6a]2S){1|C<4>,1|H<1>}	107.7280	1.599	2	107.7280	2.558	2	107.7280	2.558	2	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:1:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:Se-1:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]H)(N[5a]N[5a]C)(PC[6a]2Se)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(Se)	C[6a](PC[5a]C[6a]Se)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]H)(N[5a]N[5a]C)(PC[6a]2Se){1|H<1>}	103.8118	1.176	4	103.8118	1.382	4	103.8118	1.382	4	106.8862	5.605	32	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:2:	4:3:3:	2:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	N[5a]-2:S[5a]-2:P-4:	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(NP)	C[6a](PC[5a]C[6a]N)(C[6a]C[6a]H)2	C[5a](N[5a]N[5a])(S[5a]C[5a])(PC[6a]2N)	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(NP)	C[6a](PC[5a]C[6a]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]N[5a])(S[5a]C[5a])(PC[6a]2N){1|N<3>}	106.9985	2.029	2	106.9985	4.116	2	106.9985	4.116	2	106.9985	4.116	2	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:2:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O){1|C<2>,1|C<3>,1|S<2>}	107.1352	0.611	4	106.9309	1.496	10	106.9309	1.496	10	107.4336	2.771	12	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:2:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O){1|C<3>,1|C<4>,1|S<2>}	106.6415	2.819	2	106.9309	1.496	10	106.9309	1.496	10	107.4336	2.771	12	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:2:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a]S[5a])(C[5a]C[5a]H)(PC[6a]2O){1|S<2>,2|C<3>}	106.8713	1.161	4	106.9309	1.496	10	106.9309	1.496	10	107.4336	2.771	12	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:2:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(SIr)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2	C[5a](N[5a]N[5a]Ir)(C[5a]N[5a]P)(PC[6a]2S)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(SIr)	C[6a](PC[5a]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]N[5a]Ir)(C[5a]N[5a]P)(PC[6a]2S)	109.9470	1.363	2	109.9470	1.859	2	109.9470	1.859	2	107.4336	2.771	12	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:3:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)3	C[6a](PC[5a]C[6a]2)(C[6a]C[6a]H)2	C[5a](C[5a]C[5a,6a]H)(C[5a]N[5a,6a]C)(PC[6a]3)	P(C[5a]C[5a]2)(C[6a]C[6a]2)3	C[6a](PC[5a]C[6a]2)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]C[5a,6a]H)(C[5a]N[5a,6a]C)(PC[6a]3){2|C<3>}	109.3212	1.536	6	109.3212	2.358	6	109.9318	4.771	9	109.9318	4.771	9	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:3:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)3	C[6a](PC[5a]C[6a]2)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]C)(C[5a]N[5a]O)(PC[6a]3)	P(C[5a]C[5a]2)(C[6a]C[6a]2)3	C[6a](PC[5a]C[6a]2)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]C)(C[5a]N[5a]O)(PC[6a]3){1|Pd<4>,1|C<3>}	111.1530	3.136	3	111.1530	9.831	3	109.9318	4.771	9	109.9318	4.771	9	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:4:	3:3:4:	4:3:2:	C[5a]-3:C[5a]-3:C[6a]-3:C-4:	C[6a]-3:C[6a]-3:P-4:	P-4:C[5a]-3:O[5a]-2:	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[5a]2C)	C[5a](PC[5a]C[6a]C)(C[5a]C[5a]H)(O[5a]C[5a])	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[5a]2C){1|C<3>,2|H<1>}	C[5a](PC[5a]C[6a]C)(C[5a]C[5a]H)(O[5a]C[5a]){2|H<1>}	108.3055	3.104	4	108.3055	9.635	4	108.3055	9.635	4	108.3055	9.635	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:4:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:B-4:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:N[5a]-2:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(BH3)	C[6a](PC[5a]C[6a]B)(C[6a]C[6a]H)2	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]2B)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(BH3)	C[6a](PC[5a]C[6a]B)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](C[5a]N[5a]H)(N[5a]N[5a])(PC[6a]2B){1|C<3>}	104.3975	0.298	2	104.3975	0.089	2	104.3975	0.089	2	106.7387	7.370	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:4:	4:3:3:	3:2:4:	C[5a]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:N[5a]-2:P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(CH3)	C[6a](PC[5a]C[6a]C)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a]C[6a])(N[5a]C[5a])(PC[6a]2C)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(CH3)	C[6a](PC[5a]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a]C[6a])(N[5a]C[5a])(PC[6a]2C){2|C<3>,2|H<1>}	109.0800	0.307	2	109.0800	0.094	2	109.0800	0.094	2	106.7387	7.370	4	106.6351	6.256	125	106.6351	6.256	125
992	643	727	0:SP3_SP2_SP2	P	C[6a]	C[5a]	3:3:3:4:	4:3:3:	3:3:4:	C[5a]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	N[5a]-3:C[5a]-3:P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(CH3)	C[6a](PC[5a]C[6a]C)(C[6a]C[6a]H)2	C[5a](N[5a]C[5a]C[6a])(C[5a]N[5a]Cl)(PC[6a]2C)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(CH3)	C[6a](PC[5a]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5a](N[5a]C[5a]C[6a])(C[5a]N[5a]Cl)(PC[6a]2C){4|C<3>}	110.4555	1.368	2	110.4555	1.872	2	110.4555	1.872	2	110.4555	1.872	2	106.6351	6.256	125	106.6351	6.256	125
992	643	730	0:SP3_SP2_SP2	P	C[6a]	As	3:3:3:3:	3:3:4:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:As-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:C[6a]-3:P-4:	P(C[6a]C[6a]2)3(AsC[6a]2)	C[6a](C[6a]C[6a]H)2(PC[6a]2As)	As(C[6a]C[6a]2)2(PC[6a]3)	P(C[6a]C[6a]2)3(AsC[6a]2)	C[6a](C[6a]C[6a]H)2(PC[6a]2As){1|C<3>,2|H<1>}	As(C[6a]C[6a]2)2(PC[6a]3)	110.2367	5.291	3	110.2367	27.995	3	110.2367	27.995	3	110.2367	27.995	3	111.1305	15.612	11	111.1305	15.612	11
992	643	730	0:SP3_SP2_SP2	P	C[6a]	As	3:3:3:3:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:As-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-4:	P(C[6a]C[6a]2)3(AsC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2As)	As(C[6a]C[6a]2)(PC[6a]3)(CH3)	P(C[6a]C[6a]2)3(AsC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2As){1|C<3>,2|H<1>}	As(C[6a]C[6a]2)(PC[6a]3)(CH3)	115.5470	0.000	1	115.5470	0.000	1	110.5122	9.109	6	110.5122	9.109	6	111.1305	15.612	11	111.1305	15.612	11
992	643	730	0:SP3_SP2_SP2	P	C[6a]	As	3:3:3:3:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:As-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-4:	P(C[6a]C[6a]2)3(AsC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2As)	As(C[6a]C[6a]2)(PC[6a]3)(CH3)	P(C[6a]C[6a]2)3(AsC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2As){1|C<3>,2|H<1>}	As(C[6a]C[6a]2)(PC[6a]3)(CH3)	109.5052	1.944	5	109.5052	3.781	5	110.5122	9.109	6	110.5122	9.109	6	111.1305	15.612	11	111.1305	15.612	11
992	643	730	0:SP3_SP2_SP2	P	C[6a]	As	3:3:4:4:	3:3:4:	3:4:4:	C[6a]-3:As-3:C-4:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-4:	P(C[6a]C[6a]2)(AsC[6a]C)(CH3)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PAsCC)	As(C[6a]C[6a]2)(PC[6a]CC)(CH3)	P(C[6a]C[6a]2)(AsC[6a]C)(CH3)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PAsCC){1|C<3>,2|H<1>}	As(C[6a]C[6a]2)(PC[6a]CC)(CH3)	118.1650	0.000	1	118.1650	0.000	1	114.3265	29.468	2	114.3265	29.468	2	111.1305	15.612	11	111.1305	15.612	11
992	643	730	0:SP3_SP2_SP2	P	C[6a]	As	3:3:4:4:	3:3:4:	3:4:4:	C[6a]-3:As-3:C-4:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-4:	P(C[6a]C[6a]2)(AsC[6a]C)(CH3)2	C[6a](C[6a]C[6a]H)2(PAsCC)	As(C[6a]C[6a]2)(PC[6a]CC)(CH3)	P(C[6a]C[6a]2)(AsC[6a]C)(CH3)2	C[6a](C[6a]C[6a]H)2(PAsCC){1|C<3>,2|H<1>}	As(C[6a]C[6a]2)(PC[6a]CC)(CH3)	110.4880	0.000	1	110.4880	0.000	1	114.3265	29.468	2	114.3265	29.468	2	111.1305	15.612	11	111.1305	15.612	11
992	643	730	0:SP3_SP2_SP3	P	C[6a]	As	3:3:3:4:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:As-3:C-4:	C[6a]-3:C[6a]-3:P-4:	C-4:C-4:P-4:	P(C[6a]C[6a]2)2(AsCC)(CH3)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(PC[6a]AsC)	As(CC[6a]HH)2(PC[6a]2C)	P(C[6a]C[6a]2)2(AsCC)(CH3)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(PC[6a]AsC){1|H<1>,2|C<3>}	As(CC[6a]HH)2(PC[6a]2C)	110.2550	0.000	1	110.2550	0.000	1	112.7405	12.355	2	112.7405	12.355	2	113.8447	9.835	3	113.8447	9.835	3
992	643	730	0:SP3_SP2_SP3	P	C[6a]	As	3:3:3:4:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:As-3:C-4:	C[6a]-3:C[6a]-3:P-4:	C-4:C-4:P-4:	P(C[6a]C[6a]2)2(AsCC)(CH3)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]AsC)	As(CC[6a]HH)2(PC[6a]2C)	P(C[6a]C[6a]2)2(AsCC)(CH3)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]AsC){1|C<3>,2|H<1>}	As(CC[6a]HH)2(PC[6a]2C)	115.2260	0.000	1	115.2260	0.000	1	112.7405	12.355	2	112.7405	12.355	2	113.8447	9.835	3	113.8447	9.835	3
992	643	730	0:SP3_SP2_SP3	P	C[6a]	As	3:3:4:4:	3:3:4:	4:4:4:	C[6a]-3:As-3:C-4:C-4:	C[6a]-3:C[6a]-3:P-4:	C-4:C-4:P-4:	P(C[6a]C[6a]2)(AsCC)(CH3)2	C[6a](C[6a]C[6a]H)2(PAsCC)	As(CC[6a]HH)2(PC[6a]CC)	P(C[6a]C[6a]2)(AsCC)(CH3)2	C[6a](C[6a]C[6a]H)2(PAsCC){1|C<3>,2|H<1>}	As(CC[6a]HH)2(PC[6a]CC)	116.0530	0.000	1	116.0530	0.000	1	116.0530	0.000	1	116.0530	0.000	1	113.8447	9.835	3	113.8447	9.835	3
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6,6]	3:3:3:1:	4:3:3:	4:3:4:	C[6,6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[3x6]-4:C[6,6]-3:P-4:	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(PC[6a]2O)	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(PC[6a]2O){1|H<1>,4|C<3>}	105.9680	2.256	2	105.9680	5.088	2	107.2031	5.518	14	107.2031	5.518	14	107.7109	7.037	16	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6,6]	3:3:3:1:	4:3:3:	4:3:4:	C[6,6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[3x6]-4:C[6,6]-3:P-4:	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]P)(PC[6a]2O)	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]P)(PC[6a]2O){1|H<1>,4|C<3>}	107.4089	2.395	12	107.4089	5.736	12	107.2031	5.518	14	107.2031	5.518	14	107.7109	7.037	16	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6,6]	3:3:3:2:	4:3:3:	4:3:4:	C[6,6]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	P[3x6]-4:C[6,6]-3:P-4:	P(C[6,6]C[6,6]P[3x6])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6,6]C[6a]S)(C[6a]C[6a]H)2	C[6,6](P[3x6]C[6,6]2Pd)(C[6,6]C[3x6]C)(PC[6a]2S)	P(C[6,6]C[6,6]P[3x6])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6,6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6,6](P[3x6]C[6,6]2Pd)(C[6,6]C[3x6]C)(PC[6a]2S){1|H<1>,4|C<3>}	111.2655	2.222	2	111.2655	4.939	2	111.2655	4.939	2	111.2655	4.939	2	107.7109	7.037	16	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:2:1:	3:3:4:	3:3:4:	C[6a]-3:C[6]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6]NO)	C[6](C[6]C[6]H)2(PC[6a]NO)	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6]NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]NO){1|C<2>,2|H<1>}	110.1995	0.100	2	110.1995	0.010	2	110.1995	0.010	2	110.1995	0.010	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:2:2:	3:3:4:	3:3:4:	C[6a]-3:C[6]-3:N-2:N-2:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)2	C[6a](C[6a]C[6a]H)2(PC[6]NN)	C[6](C[6]C[6]H)2(PC[6a]NN)	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)2	C[6a](C[6a]C[6a]H)2(PC[6]NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]NN){1|C<3>,1|H<1>}	105.4000	0.000	1	105.4000	0.000	1	105.4000	0.000	1	105.4000	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:2:2:	3:3:4:	4:3:2:	C[6a]-3:C[6]-3:Se-2:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-3:C[6]-2:	P(C[6a]C[6a]2)(C[6]C[6]2)(SeNi)(NP)	C[6a](C[6a]C[6a]H)2(PC[6]SeN)	C[6](PC[6a]SeN)(C[6]C[6]H)(C[6]C[6])	P(C[6a]C[6a]2)(C[6]C[6]2)(SeNi)(NP)	C[6a](C[6a]C[6a]H)2(PC[6]SeN){1|C<3>,2|H<1>}	C[6](PC[6a]SeN)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	102.1610	0.000	1	102.1610	0.000	1	102.1610	0.000	1	102.1610	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	3:2:4:	4:3:3:	C[6a]-3:C[6]-3:C[6]-3:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:N[6]-3:C[6]-3:	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2O)	C[6](PC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H)	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2O){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	106.5497	1.006	6	106.5497	1.012	6	106.5497	1.012	6	106.5497	1.012	6	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	3:4:3:	3:4:2:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	C[6a]-3:P-4:C[6a]-3:	C[6]-3:P-4:C[6]-2:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](C[6a]C[6a,6a]C)(PC[6a]C[6]O)(C[6a]C[6a]H)	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](C[6a]C[6a,6a]C)(PC[6a]C[6]O)(C[6a]C[6a]H){3|C<3>}	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6]){1|C<3>,2|H<1>}	107.2430	0.000	1	107.2430	0.000	1	107.2430	0.000	1	107.2430	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:3:4:	C[6]-3:C[6a]-3:C[6a]-3:F-1:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:N[6]-3:P-4:	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[6]F)(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(N[6]C[6]C)(PC[6a]2F)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[6]F)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(PC[6a]2F){1|C<3>,2|H<1>}	109.4765	1.102	2	109.4765	1.215	2	109.4765	1.215	2	110.6965	23.950	6	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:3:4:	C[6]-3:C[6a]-3:C[6a]-3:H-1:	P-4:C[6a]-3:C[6a]-3:	C[6,6]-3:C[6]-3:P-4:	P(C[6]C[6,6]C[6])(C[6a]C[6a]2)2(H)	C[6a](PC[6a]C[6]H)(C[6a]C[6a]C)2	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]B)(PC[6a]2H)	P(C[6]C[6,6]C[6])(C[6a]C[6a]2)2(H)	C[6a](PC[6a]C[6]H)(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]B)(PC[6a]2H){3|C<4>,4|H<1>}	116.6215	0.961	2	116.6215	0.923	2	116.6215	0.923	2	110.6965	23.950	6	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:3:4:	C[6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[6,6a]-3:C[6]-3:P-4:	P(C[6]C[6,6a]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(PC[6a]2O)	P(C[6]C[6,6a]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(PC[6a]2O){1|C<4>,1|H<1>,2|C<3>}	105.9915	0.384	2	105.9915	0.147	2	105.9915	0.147	2	110.6965	23.950	6	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:4:2:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P-4:C[6]-2:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6]){1|C<3>,2|H<1>}	105.8620	0.000	1	105.8620	0.000	1	105.8620	0.000	1	105.8620	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:4:4:	C[6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5,6]-3:C[6]-4:P-4:	P(C[6]C[5,6]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(PC[6a]2O)	P(C[6]C[5,6]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]HH)(PC[6a]2O){1|H<1>,2|C<4>,4|C<3>}	108.0975	1.150	2	108.0975	1.324	2	108.0975	1.324	2	106.2086	5.860	8	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:4:4:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-4:P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]HH)(PC[6a]2O)	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]HH)(PC[6a]2O){2|H<1>,4|C<3>}	105.2295	3.620	2	105.2295	13.102	2	105.5790	6.037	6	106.2086	5.860	8	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	3:4:4:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-4:P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]HH)(PC[6a]2O)	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]HH)(PC[6a]2O){4|C<3>}	105.7537	2.360	4	105.7537	5.571	4	105.5790	6.037	6	106.2086	5.860	8	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:1:	4:3:3:	4:4:2:	C[6]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	P[6]-4:P-4:S[6]-2:	P(C[6]P[6]S[6])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2	C[6](P[6]C[6a]2S[6])(PC[6a]2S)(S[6]C[6])	P(C[6]P[6]S[6])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](P[6]C[6a]2S[6])(PC[6a]2S)(S[6]C[6]){2|P<4>,4|C<3>}	106.1585	1.801	4	106.1585	3.244	4	106.1585	3.244	4	106.1585	3.244	4	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	3:3:4:	3:3:4:	C[6a]-3:C[6]-3:C-3:O-2:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(C[6]C[6]2)(CCH)(OZn)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	C[6](C[6]C[6]H)2(PC[6a]CO)	P(C[6a]C[6a]2)(C[6]C[6]2)(CCH)(OZn)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]CO){1|C<3>,1|H<1>}	107.7330	0.000	1	107.7330	0.000	1	107.7330	0.000	1	107.7330	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	3:3:4:	4:3:3:	C[6a]-3:C[6]-3:C[6]-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-3:C[6]-3:	P(C[6a]C[6a]2)(C[6]C[6]2)2(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6]2S)	C[6](PC[6a]C[6]S)(C[6]C[6]H)2	P(C[6a]C[6a]2)(C[6]C[6]2)2(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6]2S){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]S)(C[6]C[6]H)2{1|C<3>,1|H<1>}	109.9425	0.661	2	109.9425	0.437	2	109.9425	0.437	2	109.9425	0.437	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2)(NP)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2	C[6](C[6]C[6]H)2(PC[6a]2N)	P(C[6a]C[6a]2)2(C[6]C[6]2)(NP)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]2N){1|C<3>,1|H<1>}	107.6755	0.147	4	107.6755	0.022	4	107.6755	0.022	4	107.6755	0.022	4	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:4:2:	C[6a]-3:C[6a]-3:C[6]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P-4:C[6]-2:	P(C[6a]C[6a]2)2(C[6]C[6]2)(NP)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(PC[6a]2N)(C[6]C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)(NP)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(PC[6a]2N)(C[6]C[6]){1|C<3>,2|H<1>}	107.9150	2.032	4	107.9150	4.129	4	107.9150	4.129	4	107.9150	4.129	4	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:4:4:	C[6]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P[6]-4:P-4:	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SMn)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2	C[6](C[6]C[6a]C[6])(P[6]C[6]MnC)(PC[6a]2S)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SMn)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6])(P[6]C[6]MnC)(PC[6a]2S){1|H<1>,1|P<4>,3|C<3>}	111.9255	2.286	4	111.9255	5.224	4	112.0627	5.505	40	112.0627	5.505	40	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:4:4:	C[6]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P[6]-4:P-4:	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2	C[6](C[6]C[6a]C[6])(P[6]C[6]PdC)(PC[6a]2S)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6])(P[6]C[6]PdC)(PC[6a]2S){1|H<1>,1|P<4>,3|C<3>}	112.6466	2.443	8	112.6466	5.967	8	112.0627	5.505	40	112.0627	5.505	40	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:4:4:	C[6]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P[6]-4:P-4:	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SRh)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2	C[6](C[6]C[6a]C[6])(P[6]C[6]RhC)(PC[6a]2S)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SRh)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6])(P[6]C[6]RhC)(PC[6a]2S){1|H<1>,1|P<4>,3|C<3>}	112.2701	2.858	12	112.2701	8.166	12	112.0627	5.505	40	112.0627	5.505	40	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	3:4:4:	C[6]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P[6]-4:P-4:	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SU)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2	C[6](C[6]C[6a]C[6])(P[6]C[6]CU)(PC[6a]2S)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(SU)	C[6a](PC[6a]C[6]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6])(P[6]C[6]CU)(PC[6a]2S){1|H<1>,1|P<4>,3|C<3>}	111.6494	2.023	16	111.6494	4.092	16	112.0627	5.505	40	112.0627	5.505	40	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:2:	4:3:3:	4:2:4:	C[6]-3:C[6a]-3:C[6a]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	P[6]-4:Ge[6]-2:P-4:	P(C[6]Ge[6]P[6])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2	C[6](P[6]Ge[5,5,6]C[6a]2)(Ge[6]P[6])(PC[6a]2N)	P(C[6]Ge[6]P[6])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](P[6]Ge[5,5,6]C[6a]2)(Ge[6]P[6])(PC[6a]2N){1|Ge<3>,8|C<3>}	110.5000	1.621	2	110.5000	2.627	2	110.5000	2.627	2	110.5000	2.627	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:2:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-2:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(C[6]C[6])(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(PC[6a]3){1|C<3>,2|H<1>}	109.2707	0.928	3	109.2707	0.860	3	109.2707	0.860	3	109.2707	0.860	3	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6]-3:C[6a]-3:C[6a]-3:N-3:	P-4:C[6a]-3:C[6a]-3:	N[6]-3:C[6]-3:P-4:	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(NFeSi)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2N)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(NFeSi)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2N){1|C<3>,1|H<1>,1|P<4>}	104.2808	1.192	6	104.2808	1.420	6	104.6524	2.665	8	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6]-3:C[6a]-3:C[6a]-3:N-3:	P-4:C[6a]-3:C[6a]-3:	N[6]-3:C[6]-3:P-4:	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(NSiZn)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2N)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(NSiZn)	C[6a](PC[6a]C[6]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2N){1|H<1>,2|C<3>}	105.7670	2.871	2	105.7670	8.242	2	104.6524	2.665	8	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(C[6]C[6]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(PC[6a]3){1|C<3>,1|C<4>,1|H<1>}	110.9707	1.637	3	110.9707	2.678	3	109.5461	4.907	18	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(C[6]C[6]S)(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]S)(PC[6a]3){1|C<3>,1|H<1>,1|O<1>}	108.8733	1.646	3	108.8733	2.710	3	109.5461	4.907	18	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)(C[6]O[6]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]O[6]O)(PC[6a]3){1|C<3>,1|P<4>}	109.6952	2.127	6	109.6952	4.523	6	109.5461	4.907	18	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)2(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]3){1|C<3>,1|H<1>}	109.5667	3.827	3	109.0212	8.160	6	109.5461	4.907	18	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2	C[6](C[6]C[6]H)2(PC[6a]3)	P(C[6a]C[6a]2)3(C[6]C[6]2)	C[6a](PC[6a]2C[6])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]3){1|N<3>,2|H<1>}	108.4757	2.204	3	109.0212	8.160	6	109.5461	4.907	18	108.0403	9.389	26	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	4:3:2:	C[6a]-3:C[6a]-3:C[6]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	P-4:C[6]-3:C[6]-2:	P(C[6a]C[6a]2)2(C[6]C[6]2)2	C[6a](PC[6a]C[6]2)(C[6a]C[6a]H)2	C[6](PC[6a]2C[6])(C[6]C[6]H)(C[6]C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)2	C[6a](PC[6a]C[6]2)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](PC[6a]2C[6])(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	108.4370	0.744	2	108.4370	0.553	2	108.4370	0.553	2	108.4370	0.553	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:3:	4:3:3:	4:3:3:	C[6a]-3:C[6a]-3:C[6]-3:C[6]-3:	P-4:C[6a]-3:C[6a]-3:	P-4:C[6]-3:C[6]-3:	P(C[6a]C[6a]2)2(C[6]C[6]2)2	C[6a](PC[6a]C[6]2)(C[6a]C[6a]H)2	C[6](PC[6a]2C[6])(C[6]C[6]H)2	P(C[6a]C[6a]2)2(C[6]C[6]2)2	C[6a](PC[6a]C[6]2)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](PC[6a]2C[6])(C[6]C[6]H)2{1|C<2>,1|H<1>}	109.0700	1.280	2	109.0700	1.638	2	109.0700	1.638	2	109.0700	1.638	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:4:	3:2:4:	4:3:3:	C[6a]-3:C[6]-3:C[6]-3:C-4:	C[6a]-3:N[6a]-2:P-4:	P-4:N[6]-3:C[6]-3:	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(CCHH)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2C)	C[6](PC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H)	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(CCHH)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2C){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	108.5305	2.453	2	108.5305	6.017	2	108.5305	6.017	2	108.5305	6.017	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:3:4:	4:3:3:	3:4:2:	C[6]-3:C[6a]-3:C[6a]-3:B-4:	P-4:C[6a]-3:C[6a]-3:	C[6]-3:P-4:P[6]-2:	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(BH3)	C[6a](PC[6a]C[6]B)(C[6a]C[6a]H)2	C[6](C[6]C[6]C)(PC[6a]2B)(P[6]C[6])	P(C[6]C[6]P[6])(C[6a]C[6a]2)2(BH3)	C[6a](PC[6a]C[6]B)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[6](C[6]C[6]C)(PC[6a]2B)(P[6]C[6]){1|Si<4>,1|C<3>,1|H<1>}	108.1100	1.072	2	108.1100	1.149	2	108.1100	1.149	2	108.1100	1.149	2	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:3:4:1:	3:3:4:	3:4:2:	C[6a]-3:C[6]-3:C-4:I-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:C[6]-2:	P(C[6a]C[6a]2)(C[6]C[6]2)(CCHH)(I)	C[6a](C[6a]C[6a]H)2(PC[6]CI)	C[6](C[6]C[6]H)(PC[6a]CI)(C[6]C[6])	P(C[6a]C[6a]2)(C[6]C[6]2)(CCHH)(I)	C[6a](C[6a]C[6a]H)2(PC[6]CI){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(PC[6a]CI)(C[6]C[6]){1|C<3>,2|H<1>}	109.7390	0.000	1	109.7390	0.000	1	109.7390	0.000	1	109.7390	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:4:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6]-4:C[6]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-3:C[6]-3:	P(C[6a]C[6a]2)(C[6]O[6]2H)(C[6]C[6]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6]2O)	C[6](PC[6a]C[6]O)(C[6]C[6]H)2	P(C[6a]C[6a]2)(C[6]O[6]2H)(C[6]C[6]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6]2O){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]O)(C[6]C[6]H)2{1|C<3>,1|H<1>}	106.8090	0.000	1	106.8090	0.000	1	106.8090	0.000	1	106.8090	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	762	0:SP3_SP2_SP2	P	C[6a]	C[6]	3:4:3:4:	3:3:4:	4:3:3:	C[6a]-3:C[6]-4:C[6]-3:C-4:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-3:C[6]-3:	P(C[6a]C[6a]2)(C[6]C[6]2H)(C[6]C[6]2)(CC[5]HH)	C[6a](C[6a]C[6a]H)2(PC[6]2C)	C[6](PC[6a]C[6]C)(C[6]C[6]H)2	P(C[6a]C[6a]2)(C[6]C[6]2H)(C[6]C[6]2)(CC[5]HH)	C[6a](C[6a]C[6a]H)2(PC[6]2C){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]C)(C[6]C[6]H)2{1|C<2>,2|H<1>}	111.9780	0.000	1	111.9780	0.000	1	111.9780	0.000	1	111.9780	0.000	1	109.3172	10.644	123	109.1323	10.439	139
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,3x5,12x6]	5:3:3:2:	4:3:3:	6:6:5:5:4:	C[3x3,3x5,12x6]-5:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	B[5x3,3x5,11x6]-6:B[5x3,3x5,11x6]-6:B[3x3,3x5,12x6]-5:C[3x3,3x5,12x6]-5:P-4:	P(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,3x5,12x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,3x5,12x6](B[5x3,3x5,11x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[5x3,3x5,11x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2H)(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2S)(PC[6a]2S)	P(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,3x5,12x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,3x5,12x6](B[5x3,3x5,11x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[5x3,3x5,11x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6]B[5x3,5x5,5x6]H)(B[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2H)(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2S)(PC[6a]2S){1|B<6>,6|H<1>}	108.4745	0.853	2	108.4745	0.728	2	108.4745	0.728	2	108.4745	0.728	2	109.7935	3.727	4	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,3x5,12x6]	5:3:3:4:	4:3:3:	6:6:6:5:4:	C[3x3,3x5,12x6]-5:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	B[5x3,3x5,11x6]-6:B[5x3,3x5,11x6]-6:B[4x3,3x5,12x6]-6:B[3x3,3x5,12x6]-5:P-4:	P(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2)(C[6a]C[6a]2)2(CH3)	C[6a](PC[3x3,3x5,12x6]C[6a]C)(C[6a]C[6a]H)2	C[3x3,3x5,12x6](B[5x3,3x5,11x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[5x3,3x5,11x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[4x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2H[3]H)(B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6]H)(PC[6a]2C)	P(C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2)(C[6a]C[6a]2)2(CH3)	C[6a](PC[3x3,3x5,12x6]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,3x5,12x6](B[5x3,3x5,11x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[5x3,3x5,11x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2B[5x3,5x5,5x6]H)(B[4x3,3x5,12x6]B[4x3,3x5,12x6]B[5x3,3x5,11x6]2H[3]H)(B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6]H)(PC[6a]2C){1|B<6>,5|H<1>}	111.1125	1.869	2	111.1125	3.493	2	111.1125	3.493	2	111.1125	3.493	2	109.7935	3.727	4	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:1:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(S)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(S)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S){1|B<6>,1|S<2>,5|H<1>}	105.6010	2.565	2	105.6010	6.581	2	105.6010	6.581	2	105.6010	6.581	2	108.4560	7.109	18	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:2:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SIr)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SIr)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S){1|Ir<7>,1|B<6>,5|H<1>}	109.5775	0.985	2	109.9070	2.620	4	108.7682	6.296	12	108.7682	6.296	12	108.4560	7.109	18	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:2:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SIr)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SIr)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S){1|Ir<8>,1|B<6>,5|H<1>}	110.2365	2.541	2	109.9070	2.620	4	108.7682	6.296	12	108.7682	6.296	12	108.4560	7.109	18	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:2:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S){1|B<6>,1|S<2>,5|H<1>}	107.8602	3.162	6	108.1988	7.660	8	108.7682	6.296	12	108.7682	6.296	12	108.4560	7.109	18	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:2:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(SRh)	C[6a](PC[3x3,4,3x5,14x6]C[6a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2S){1|Rh<7>,1|B<6>,5|H<1>}	109.2145	0.941	2	108.1988	7.660	8	108.7682	6.296	12	108.7682	6.296	12	108.4560	7.109	18	108.6992	6.566	22
992	643	778	0:SP3_SP2_SPD5	P	C[6a]	C[3x3,4,3x5,14x6]	5:3:3:3:	4:3:3:	6:6:6:6:4:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	B[5x3,4x5,17x6]-6:B[5x3,4x5,17x6]-6:B[4x3,4,5x5,21x6]-6:B[4x3,4,5x5,21x6]-6:P-4:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(CC[6a]C)	C[6a](PC[3x3,4,3x5,14x6]C[6a]C)(C[6a]C[6a]H)2	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2C)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(CC[6a]C)	C[6a](PC[3x3,4,3x5,14x6]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[3x3,4,3x5,14x6](B[5x3,4x5,17x6]B[4x3,4,5x5,21x6]B[5x3,4x5,17x6]B[5x3,4x5,19x6]B[5x3,5x5,14x6]H)2(B[4x3,4,5x5,21x6]C[3x3,4,3x5,14x6]B[5x3,4x5,17x6]2B[5x3,4x5,19x6]H)2(PC[6a]2C){1|B<4>,1|B<6>,5|H<1>}	108.9470	2.976	4	108.9470	8.858	4	108.9470	8.858	4	108.9470	8.858	4	108.4560	7.109	18	108.6992	6.566	22
992	643	786	0:SP3_SP2_SP3	P	C[6a]	B[5]	4:3:1:1:	3:3:4:	3:3:3:4:	B[5]-4:C[6a]-3:H-1:H-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-3:C[5]-3:C[6a]-3:P-4:	P(B[5]C[6a]C[5]2)(C[6a]C[6a]2)(H)2	C[6a](C[6a]C[6a]H)2(PB[5]HH)	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2)(PC[6a]HH)	P(B[5]C[6a]C[5]2)(C[6a]C[6a]2)(H)2	C[6a](C[6a]C[6a]H)2(PB[5]HH){1|C<3>,2|H<1>}	B[5](C[5]C[6a]C[5])2(C[6a]C[6a]2)(PC[6a]HH){2|H<1>,8|C<3>}	115.6550	0.000	1	115.6550	0.000	1	115.6550	0.000	1	115.6550	0.000	1	115.6550	0.000	1	115.6550	0.000	1
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:1:1:1:	3:3:4:	4:	C[6a]-3:Cl-1:Cl-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(Cl)2(O)	C[6a](C[6a]C[6a]C)2(PCl2O)	Cl(PC[6a]ClO)	P(C[6a]C[6a]2)(Cl)2(O)	C[6a](C[6a]C[6a]C)2(PCl2O){1|C<3>,2|H<1>}	Cl(PC[6a]ClO)	106.5950	0.157	2	106.5950	0.025	2	106.5950	0.025	2	106.5950	0.025	2	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-2:Cl-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC)(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]ClN)	Cl(PC[6a]2N)	P(C[6a]C[6a]2)2(NC)(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]ClN){1|C<3>,2|H<1>}	Cl(PC[6a]2N)	103.1617	2.783	6	103.1617	7.746	6	103.1617	7.746	6	103.1617	7.746	6	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:Cl-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]2Cl)	Cl(PC[6a]3)	P(C[6a]C[6a]2)3(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]2Cl){1|C<3>,2|H<1>}	Cl(PC[6a]3)	99.1598	8.552	6	99.1598	73.139	6	99.1598	73.139	6	99.1598	73.139	6	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:Cl-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]ClC)	Cl(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(Cl)	C[6a](C[6a]C[6a]H)2(PC[6a]ClC){1|C<3>,2|H<1>}	Cl(PC[6a]2C)	108.4863	1.554	6	108.4863	2.415	6	108.4863	2.415	6	108.4863	2.415	6	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:Cl-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(Cl)(O)	C[6a](C[6a]C[6a]H)2(PClCO)	Cl(PC[6a]CO)	P(C[6a]C[6a]2)(CC3)(Cl)(O)	C[6a](C[6a]C[6a]H)2(PClCO){1|C<3>,2|H<1>}	Cl(PC[6a]CO)	104.2110	0.000	1	104.2110	0.000	1	104.2110	0.000	1	102.9647	1.305	3	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:Cl-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(Cl)(S)	C[6a](C[6a]C[6a]H)2(PClCS)	Cl(PC[6a]CS)	P(C[6a]C[6a]2)(CC3)(Cl)(S)	C[6a](C[6a]C[6a]H)2(PClCS){1|C<3>,2|H<1>}	Cl(PC[6a]CS)	102.7160	0.000	1	102.7160	0.000	1	102.7160	0.000	1	102.9647	1.305	3	103.7796	31.830	23	103.7796	31.830	23
992	643	790	0:SP3_SP-NON_SP2	P	C[6a]	Cl	3:4:1:1:	3:3:4:	4:	C[6a]-3:C[6]-4:Cl-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(Cl)(Se)	C[6a](C[6a]C[6a]H)2(PC[6]ClSe)	Cl(PC[6a]C[6]Se)	P(C[6a]C[6a]2)(C[6]C[6]2H)(Cl)(Se)	C[6a](C[6a]C[6a]H)2(PC[6]ClSe){1|C<3>,2|H<1>}	Cl(PC[6a]C[6]Se)	101.9670	0.000	1	101.9670	0.000	1	101.9670	0.000	1	102.9647	1.305	3	103.7796	31.830	23	103.7796	31.830	23
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	3:3:4:	3:3:4:	N[5a]-3:N[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O)	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]O)	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O){1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]O){2|H<1>,4|C<3>}	107.8658	1.324	4	107.8658	1.753	4	107.8658	1.753	4	106.8768	2.245	11	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	3:3:4:	3:3:4:	N[5a]-3:N[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5a,6a]-3:C[5a]-3:P-4:	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O)	N[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[5a]C[5])(PC[6a]N[5a]O)	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O){1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[5a]C[5])(PC[6a]N[5a]O){2|H<1>,4|C<3>}	106.5757	0.429	3	106.5757	0.184	3	106.5757	0.184	3	106.8768	2.245	11	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	3:3:4:	3:3:4:	N[5a]-3:N[5a]-3:C[6a]-3:S-1:	C[6a]-3:C[6a]-3:P-4:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(S)	C[6a](C[6a]C[6a]H)2(PN[5a]2S)	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]S)	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(S)	C[6a](C[6a]C[6a]H)2(PN[5a]2S){1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]S){2|H<1>,4|C<3>}	106.1260	2.137	2	106.1260	4.566	2	106.1260	4.566	2	106.8768	2.245	11	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	3:3:4:	3:3:4:	N[5a]-3:N[5a]-3:C[6a]-3:Se-1:	C[6a]-3:C[6a]-3:P-4:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(Se)	C[6a](C[6a]C[6a]H)2(PN[5a]2Se)	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]Se)	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(Se)	C[6a](C[6a]C[6a]H)2(PN[5a]2Se){1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]N[5a]Se){2|H<1>,4|C<3>}	106.1015	2.396	2	106.1015	5.743	2	106.1015	5.743	2	106.8768	2.245	11	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	4:3:3:	3:3:4:	N[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[5a]O)(C[6a]C[6a]H)2	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2O)	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[5a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2O){2|H<1>,4|C<3>}	106.0700	0.133	2	106.0700	0.018	2	106.0700	0.018	2	104.7993	2.588	6	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	4:3:3:	3:3:4:	N[5a]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[6a]N[5a]S)(C[6a]C[6a]H)2	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2S)	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(S)	C[6a](PC[6a]N[5a]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2S){2|H<1>,4|C<3>}	104.0655	1.679	2	104.0655	2.820	2	104.0655	2.820	2	104.7993	2.588	6	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:1:	4:3:3:	3:3:4:	N[5a]-3:C[6a]-3:C[6a]-3:Se-1:	P-4:C[6a]-3:C[6a]-3:	C[5a,6a]-3:C[5a,6a]-3:P-4:	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(Se)	C[6a](PC[6a]N[5a]Se)(C[6a]C[6a]H)2	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2Se)	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(Se)	C[6a](PC[6a]N[5a]Se)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])2(PC[6a]2Se){2|H<1>,4|C<3>}	104.2625	2.285	2	104.2625	5.220	2	104.2625	5.220	2	104.7993	2.588	6	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP2	P	C[6a]	N[5a]	3:3:3:4:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:N[5a]-3:B-4:	P-4:C[6a]-3:C[6a]-3:	C[5a]-3:C[5a]-3:P-4:	P(C[6a]C[6a]2)2(N[5a]C[5a]2)(BH3)	C[6a](PC[6a]N[5a]B)(C[6a]C[6a]H)2	N[5a](C[5a]C[5a]H)2(PC[6a]2B)	P(C[6a]C[6a]2)2(N[5a]C[5a]2)(BH3)	C[6a](PC[6a]N[5a]B)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[5a](C[5a]C[5a]H)2(PC[6a]2B){2|H<1>}	104.8287	0.847	4	104.8287	0.718	4	104.8287	0.718	4	104.8287	0.718	4	105.8931	2.995	21	105.8931	2.995	21
992	643	813	0:SP3_SP2_SP3	P	C[6a]	N[5a]	3:3:3:1:	3:3:4:	3:3:4:	N[5a]-3:N[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5a,6a]-3:C[5a]-3:P-4:	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O)	N[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[5a]C[5])(PC[6a]N[5a]O)	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O){1|C<3>,2|H<1>}	N[5a](C[5a,6a]C[5a,6a]C[6a])(C[5a]C[5a]C[5])(PC[6a]N[5a]O){2|H<1>,4|C<3>}	104.2380	0.000	1	104.2380	0.000	1	104.2380	0.000	1	104.2380	0.000	1	104.2380	0.000	1	104.2380	0.000	1
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5,6]	3:3:3:4:	4:3:3:	4:3:4:	C[5,6]-3:C[6a]-3:C[6a]-3:B-4:	P-4:C[6a]-3:C[6a]-3:	C[5,5,6]-4:C[5,6]-3:P-4:	P(C[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]2)2(BH3)	C[6a](PC[5,6]C[6a]B)(C[6a]C[6a]H)2	C[5,6](C[5,5,6]C[5,5]C[5,6]C)(C[5,6]C[5,5,6]H)(PC[6a]2B)	P(C[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]2)2(BH3)	C[6a](PC[5,6]C[6a]B)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5,6](C[5,5,6]C[5,5]C[5,6]C)(C[5,6]C[5,5,6]H)(PC[6a]2B){3|C<4>,3|H<1>}	106.5510	0.690	2	106.5510	0.476	2	106.5510	0.476	2	108.8360	39.072	4	108.8360	39.072	4	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5,6]	3:3:3:4:	4:3:3:	4:3:4:	C[5,6]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5,5,6]-4:C[5,6]-3:P-4:	P(C[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]2)2(CCHH)	C[6a](PC[5,6]C[6a]C)(C[6a]C[6a]C)2	C[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]H)(PC[6a]2C)	P(C[5,6]C[5,5,6]C[5,6])(C[6a]C[6a]2)2(CCHH)	C[6a](PC[5,6]C[6a]C)(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	C[5,6](C[5,5,6]C[5,5]C[5,6]H)(C[5,6]C[5,5,6]H)(PC[6a]2C){1|C<4>,5|H<1>}	111.1210	9.791	2	111.1210	95.856	2	111.1210	95.856	2	108.8360	39.072	4	108.8360	39.072	4	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	N[5]-3:N[5]-3:P-4:	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO)	C[5](N[5]C[5]C)(N[5]C[5]H)(PC[6a]OO)	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO){1|C<3>,2|H<1>}	C[5](N[5]C[5]C)(N[5]C[5]H)(PC[6a]OO){2|H<1>}	102.2570	0.000	1	102.2570	0.000	1	103.4675	2.931	2	104.4048	3.928	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	N[5]-3:N[5]-3:P-4:	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO)	C[5](N[5]C[5]H)2(PC[6a]OO)	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO){1|C<3>,2|H<1>}	C[5](N[5]C[5]H)2(PC[6a]OO){2|H<1>}	104.6780	0.000	1	104.6780	0.000	1	103.4675	2.931	2	104.4048	3.928	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	N[5]-3:N[5]-3:P-4:	P(C[6a]C[6a]2)(C[5]N[5]2)(S)2	C[6a](C[6a]C[6a]H)2(PC[5]SS)	C[5](N[5]C[6a]C[5])2(PC[6a]SS)	P(C[6a]C[6a]2)(C[5]N[5]2)(S)2	C[6a](C[6a]C[6a]H)2(PC[5]SS){1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])2(PC[6a]SS){2|H<1>,4|C<3>}	103.7080	0.000	1	105.3420	5.340	2	105.3420	5.340	2	104.4048	3.928	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	N[5]-3:N[5]-3:P-4:	P(C[6a]C[6a]2)(C[5]N[5]2)(S)2	C[6a](C[6a]C[6a]H)2(PC[5]SS)	C[5](N[5]C[6a]C[5])2(PC[6a]SS)	P(C[6a]C[6a]2)(C[5]N[5]2)(S)2	C[6a](C[6a]C[6a]H)2(PC[5]SS){1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])2(PC[6a]SS){4|C<3>,4|H<1>}	106.9760	0.000	1	105.3420	5.340	2	105.3420	5.340	2	104.4048	3.928	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	3:3:4:	4:3:3:	C[5]-3:C[5]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[5]-3:N[5]-3:	P(C[5]C[5]N[5])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5]2O)	C[5](PC[6a]C[5]O)(C[5]N[5]H)(N[5]C[5]C)	P(C[5]C[5]N[5])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5]2O){1|C<3>,2|H<1>}	C[5](PC[6a]C[5]O)(C[5]N[5]H)(N[5]C[5]C){1|C<4>,1|S<1>}	106.4270	0.764	2	106.4270	0.583	2	106.4270	0.583	2	106.4270	0.583	2	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:2:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-2:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5,5a]H)(N[5]N[5,5a])(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5,5a]H)(N[5]N[5,5a])(PC[6a]2O){2|B<4>}	107.9115	0.838	2	107.9115	0.702	2	107.9115	0.702	2	107.9115	0.702	2	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:F-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[5]F)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2F)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[5]F)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2F){1|Cl<1>,3|C<3>}	114.4450	3.499	2	114.4450	12.241	2	114.4450	12.241	2	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O){1|C<4>,1|H<1>}	105.8495	1.193	2	104.8252	7.109	6	106.0825	3.973	20	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O){1|C<4>,1|S<1>}	104.8950	2.927	2	104.8252	7.109	6	106.0825	3.973	20	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(N[5]C[5]C)(PC[6a]2O){1|Mo<6>,1|C<4>}	103.7310	4.588	2	104.8252	7.109	6	106.0825	3.973	20	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2O){1|C<4>,1|S<1>}	106.0120	1.348	6	106.6214	2.030	14	106.0825	3.973	20	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2O){1|C<4>,1|W<6>}	107.0785	1.384	8	106.6214	2.030	14	106.0825	3.973	20	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]H)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]H)(PC[6a]2O){1|S<1>,3|C<3>}	104.4765	2.296	2	104.4765	5.272	2	105.5577	6.840	4	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]P)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]P)(PC[6a]2O){1|S<1>,3|C<3>}	106.6390	3.251	2	106.6390	10.571	2	105.5577	6.840	4	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2S)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2S){1|C<4>,1|H<1>,1|P<4>,2|C<3>}	106.1630	1.785	2	106.1630	3.185	2	106.1630	3.185	2	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:N[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2S)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]P)(N[5]C[5]C)(PC[6a]2S){1|C<4>,1|S<1>}	105.0700	4.849	2	105.0700	23.516	2	105.0700	23.516	2	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]H)(PC[6a]2S)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]H)(PC[6a]2S){1|S<1>,3|C<3>}	104.8842	1.724	4	104.8842	2.971	4	105.2193	2.770	6	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]P)(PC[6a]2S)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]P)(PC[6a]2S){1|S<1>,3|C<3>}	105.8895	1.894	2	105.8895	3.589	2	105.2193	2.770	6	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]C[5]Br)(C[5]C[5]H)(PC[6a]2O)	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]Br)(C[5]C[5]H)(PC[6a]2O){2|C<3>}	104.0375	1.818	2	104.0375	3.305	2	105.8805	11.940	4	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]C[5]Br)2(PC[6a]2O)	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]Br)2(PC[6a]2O){2|C<3>}	107.7235	4.351	2	107.7235	18.930	2	105.8805	11.940	4	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5]C[5,5]H)2(PC[6a]2S)	P(C[6a]C[6a]2)2(C[5]C[5]2)(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5,5]H)2(PC[6a]2S){2|P<4>}	106.3750	0.542	2	106.3750	0.293	2	106.3750	0.293	2	106.2578	8.084	42	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:S[5]-2:	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(PC[6a]2O)(S[5]C[5])	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(PC[6a]2O)(S[5]C[5]){1|C<4>,1|H<1>}	106.0735	2.312	2	105.3105	2.845	4	105.5023	2.124	6	105.0688	2.689	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:S[5]-2:	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(PC[6a]2O)(S[5]C[5])	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(PC[6a]2O)(S[5]C[5]){1|C<4>,1|S<1>}	104.5475	0.930	2	105.3105	2.845	4	105.5023	2.124	6	105.0688	2.689	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:S[5]-2:	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]S[5]H)(PC[6a]2O)(S[5]C[5])	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]S[5]H)(PC[6a]2O)(S[5]C[5]){1|S<1>}	105.8860	1.281	2	105.8860	1.642	2	105.5023	2.124	6	105.0688	2.689	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:N[5]-2:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5]N[5]P)(PC[6a]2S)(N[5]N[5])	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]P)(PC[6a]2S)(N[5]N[5]){2|Al<4>}	103.4885	2.109	2	103.4885	4.449	2	103.4885	4.449	2	105.0688	2.689	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:S-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:S[5]-2:	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5]N[5]H)(PC[6a]2S)(S[5]C[5])	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(S)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]H)(PC[6a]2S)(S[5]C[5]){1|C<4>,1|S<1>}	105.3485	1.689	2	105.3485	2.854	2	105.3485	2.854	2	105.0688	2.689	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-4:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(PC[6a]2O)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]C[5]CC)(PC[6a]2O){2|C<3>,2|C<4>,2|H<1>}	105.0455	2.858	6	105.0455	8.168	6	105.0455	8.168	6	105.4711	6.730	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	3:4:4:	C[6a]-3:C[6a]-3:C[5]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-4:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]C[6a]O[5])(C[5]C[5]HH)(PC[6a]2O)	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[6a]O[5])(C[5]C[5]HH)(PC[6a]2O){1|C<4>,1|H<1>,2|C<3>}	106.1095	2.382	4	106.1095	5.672	4	106.1095	5.672	4	105.4711	6.730	10	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	4:3:3:	C[5]-3:C[6a]-3:C[6a]-3:Se-1:	P-4:C[6a]-3:C[6a]-3:	P-4:C[5]-3:N[5]-3:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(Se)	C[6a](PC[6a]C[5]Se)(C[6a]C[6a]H)2	C[5](PC[6a]2Se)(C[5]N[5]H)(N[5]C[5]C)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(Se)	C[6a](PC[6a]C[5]Se)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](PC[6a]2Se)(C[5]N[5]H)(N[5]C[5]C){1|C<4>,1|S<1>}	104.0631	1.077	8	104.0631	1.161	8	104.0631	1.161	8	104.0631	1.161	8	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	4:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P[5]-4:C[5]-3:P-4:	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](P[5]C[5,6a]C[6a]O)(C[5]C[5,6a]C[6a])(PC[6a]2O)	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](P[5]C[5,6a]C[6a]O)(C[5]C[5,6a]C[6a])(PC[6a]2O){6|C<3>}	106.4755	0.380	2	106.4755	0.144	2	107.8692	3.055	4	107.8692	3.055	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:1:	4:3:3:	4:3:4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P[5]-4:C[5]-3:P-4:	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](P[5]C[6a]2N[5])(C[5]C[5]N)(PC[6a]2O)	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](P[5]C[6a]2N[5])(C[5]C[5]N)(PC[6a]2O){1|C<4>,2|H<1>,4|C<3>}	109.2630	1.119	2	109.2630	1.251	2	107.8692	3.055	4	107.8692	3.055	4	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Pd)(PC[6a]2S)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Pd)(PC[6a]2S){1|C<4>,1|H<1>,1|P<4>,2|C<3>}	109.8040	1.135	4	110.2458	1.241	6	110.2458	1.241	6	109.5308	2.751	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Pd)(PC[6a]2S)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(SPd)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]Pd)(PC[6a]2S){1|P<4>,2|C<3>,2|H<1>}	111.1295	0.053	2	110.2458	1.241	6	110.2458	1.241	6	109.5308	2.751	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:S-2:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(SAl)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2	C[5](N[5]N[5]Al)(C[5]N[5]P)(PC[6a]2S)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(SAl)	C[6a](PC[6a]C[5]S)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]N[5]Al)(C[5]N[5]P)(PC[6a]2S){1|Al<4>}	109.4565	1.344	2	109.4565	1.807	2	109.4565	1.807	2	109.5308	2.751	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:P-2:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(PP)	C[6a](PC[6a]C[5]P)(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]2P)	P(C[6a]C[6a]2)2(C[5]C[5]2)(PP)	C[6a](PC[6a]C[5]P)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]2P){1|H<1>,1|P<4>}	108.4955	2.227	4	108.4955	4.961	4	108.4955	4.961	4	109.5308	2.751	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	3:4:2:	C[5]-3:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:N[5]-2:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(OAl)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	C[5](C[5]N[5]P)(PC[6a]2O)(N[5]N[5])	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(OAl)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]N[5]P)(PC[6a]2O)(N[5]N[5])	108.9310	1.153	8	108.9310	1.329	8	108.9310	1.329	8	108.9310	1.329	8	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:2:	4:3:3:	4:3:4:	C[6a]-3:C[6a]-3:C[5]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	C[5]-4:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[6a])	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2	C[5](C[5]C[5]CH)(C[5]C[5]C)(PC[6a]2N)	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[6a])	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]CH)(C[5]C[5]C)(PC[6a]2N){2|C<4>}	104.7180	0.455	2	104.7180	0.207	2	104.7180	0.207	2	104.7180	0.207	2	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5,6a]-3:P-4:	P(C[5]C[5,6a]2)(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])2(PC[6a]3)	P(C[5]C[5,6a]2)(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])2(PC[6a]3){2|H<1>,4|C<3>}	111.9355	2.335	6	111.9355	5.453	6	111.9355	5.453	6	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]3)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]3){1|H<1>,3|C<3>}	111.1433	3.852	6	111.0266	13.784	9	111.0266	13.784	9	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]3)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]3){2|C<3>,2|H<1>}	110.7930	4.233	3	111.0266	13.784	9	111.0266	13.784	9	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:P[5]-3:P-4:	P(C[5]C[5,6a]P[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[5]Cr)(PC[6a]3)	P(C[5]C[5,6a]P[5])(C[6a]C[6a]2)3	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(P[5]C[5]Cr)(PC[6a]3){2|C<3>,2|H<1>}	112.5000	2.119	3	112.5000	4.490	3	112.5000	4.490	3	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:N-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[3x6]H)	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]2N)	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[3x6]H)	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]2N){2|H<1>}	111.3205	0.182	2	111.3205	0.033	2	110.7715	3.638	4	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:N-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[6a]H)	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]2N)	P(C[6a]C[6a]2)2(C[5]C[5]2)(NC[6a]H)	C[6a](PC[6a]C[5]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]2N){2|H<1>}	110.2225	3.111	2	110.2225	9.676	2	110.7715	3.638	4	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]C)(C[5]C[5]H)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]C)(C[5]C[5]H)(PC[6a]3){2|H<1>}	111.3645	1.726	6	111.3645	2.977	6	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]C)(C[5]C[5]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]C)(C[5]C[5]O)(PC[6a]3){1|O<2>,2|C<3>}	110.9200	1.072	3	110.9200	1.149	3	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]C)(C[5]N[5]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]C)(C[5]N[5]O)(PC[6a]3){1|C<3>,1|S<4>}	110.8340	1.389	3	110.8340	1.929	3	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]C)(C[5]O[5]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]C)(C[5]O[5]O)(PC[6a]3){1|C<3>}	111.0823	1.761	12	111.0823	3.100	12	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]3){1|C<3>,1|H<1>}	110.8647	2.736	3	110.6715	2.172	18	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]3){1|H<1>,1|P<4>}	110.4845	1.011	12	110.6715	2.172	18	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]3){2|C<3>}	111.2263	2.150	3	110.6715	2.172	18	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5]O)(C[5]N[5]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]O)(C[5]N[5]O)(PC[6a]3){1|C<3>,1|O<1>}	110.8940	2.236	6	110.8940	4.998	6	110.9143	2.547	48	111.0761	4.193	70	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	4:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-4:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5,5]CO)(C[5]C[5]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5,5]CO)(C[5]C[5]O)(PC[6a]3){2|C<2>,2|C<3>}	112.1050	2.689	3	112.1050	7.232	3	111.4732	4.449	12	111.4732	4.449	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:3:	4:3:3:	4:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C[5]-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-4:C[5]-3:P-4:	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2	C[5](C[5]C[5,6a]C[6a]2)(C[5]C[5,6a]O)(PC[6a]3)	P(C[6a]C[6a]2)3(C[5]C[5]2)	C[6a](PC[6a]2C[5])(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5,6a]C[6a]2)(C[5]C[5,6a]O)(PC[6a]3){6|C<3>}	111.2626	2.027	9	111.2626	4.109	9	111.4732	4.449	12	111.4732	4.449	12	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2C)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2C){1|C<4>,1|H<1>,2|C<3>}	110.1435	2.600	2	110.1435	6.760	2	111.2788	7.187	4	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CHHP)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2C)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)2(CHHP)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]2C){2|C<3>,2|H<1>}	112.4140	3.106	2	112.4140	9.645	2	111.2788	7.187	4	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2C)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2C){1|Cl<1>,3|C<3>}	110.6510	4.285	2	108.6280	12.576	4	108.6280	12.576	4	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[5]-3:C[6a]-3:C[6a]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	N[5]-3:C[5]-3:P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2C)	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](N[5]C[6a]C[5])(C[5]N[5]Cl)(PC[6a]2C){1|Rh<6>,3|C<3>}	106.6050	1.731	2	108.6280	12.576	4	108.6280	12.576	4	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(CC[5]HH)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]2C)	P(C[6a]C[6a]2)2(C[5]C[5]2)(CC[5]HH)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]2C){2|H<1>}	112.0050	1.681	2	112.0050	2.827	2	111.5926	2.723	10	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](C[5]C[5]C)2(PC[6a]2C)	P(C[6a]C[6a]2)2(C[5]C[5]2)(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]C)2(PC[6a]2C){2|C<4>}	111.9428	1.422	4	111.9428	2.022	4	111.5926	2.723	10	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:3:4:	4:3:3:	3:3:4:	C[6a]-3:C[6a]-3:C[5]-3:C-4:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2	C[5](C[5]C[5]H)2(PC[6a]2C)	P(C[6a]C[6a]2)2(C[5]C[5]2)(CH3)	C[6a](PC[6a]C[5]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[5](C[5]C[5]H)2(PC[6a]2C){2|H<1>}	111.0362	2.125	4	111.0362	4.516	4	111.5926	2.723	10	110.8641	6.459	18	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:4:4:	3:3:4:	3:3:4:	C[5]-3:C[6a]-3:C-4:C-4:	C[6a]-3:C[6a]-3:P-4:	C[5,6a]-3:C[5]-3:P-4:	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)(CH3)2	C[6a](C[6a]C[6a]H)2(PC[5]CC)	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]CC)	P(C[5]C[5,6a]C[5])(C[6a]C[6a]2)(CH3)2	C[6a](C[6a]C[6a]H)2(PC[5]CC){1|C<3>,2|H<1>}	C[5](C[5,6a]C[5,6a]C[6a])(C[5]C[5]H)(PC[6a]CC){2|C<3>,2|H<1>}	112.2940	0.000	1	112.2940	0.000	1	112.2940	0.000	1	113.5015	2.916	2	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	3:3:4:4:	3:3:4:	3:3:4:	C[6a]-3:C[5]-3:C-4:C-4:	C[6a]-3:C[6a]-3:P-4:	C[5]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)(C[5]C[5]2)(CH3)2	C[6a](C[6a]C[6a]H)2(PC[5]CC)	C[5](C[5]C[6a]C[5])2(PC[6a]CC)	P(C[6a]C[6a]2)(C[5]C[5]2)(CH3)2	C[6a](C[6a]C[6a]H)2(PC[5]CC){1|C<3>,2|H<1>}	C[5](C[5]C[6a]C[5])2(PC[6a]CC){1|H<1>,5|C<3>}	114.7090	0.000	1	114.7090	0.000	1	114.7090	0.000	1	113.5015	2.916	2	108.7919	11.321	208	108.7927	11.662	212
992	643	818	0:SP3_SP2_SP2	P	C[6a]	C[5]	4:3:3:1:	3:3:4:	4:3:3:	C[5]-4:C[6a]-3:C[5]-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[5]-3:C[5]-3:	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(C[5]C[5]2)(S)	C[6a](C[6a]C[6a]H)2(PC[5]2S)	C[5](PC[6a]C[5]S)(C[5]C[5]Fe)(C[5]C[5]H)	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(C[5]C[5]2)(S)	C[6a](C[6a]C[6a]H)2(PC[5]2S){1|C<3>,2|H<1>}	C[5](PC[6a]C[5]S)(C[5]C[5]Fe)(C[5]C[5]H){3|H<1>}	109.6980	0.964	2	109.6980	0.930	2	109.6980	0.930	2	109.6980	0.930	2	108.7919	11.321	208	108.7927	11.662	212
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:1:1:1:	3:3:4:	4:	C[6a]-3:Se-1:Se-1:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(Se)2(F)	C[6a](C[6a]C[6a]H)2(PSe2F)	F(PC[6a]Se2)	P(C[6a]C[6a]2)(Se)2(F)	C[6a](C[6a]C[6a]H)2(PSe2F){1|C<3>,2|H<1>}	F(PC[6a]Se2)	98.9303	0.507	2	98.9303	0.257	2	98.9303	0.257	2	98.9303	0.257	2	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2F){1|H<1>,1|P<3>,3|C<3>}	F(PC[6a]3)	94.1893	0.000	2	99.7956	41.908	4	99.7956	41.908	4	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2F){1|H<1>,1|P<5>,3|C<3>}	F(PC[6a]3)	105.4020	0.000	2	99.7956	41.908	4	99.7956	41.908	4	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a]C[6a]H)2(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(F)	C[6a](C[6a]C[6a]H)2(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	99.2930	7.563	8	99.2930	57.206	8	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]B)(C[6a]C[6a]F)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]B)(C[6a]C[6a]F)(PC[6a]2F){1|C<3>,2|F<1>}	F(PC[6a]3)	98.3312	3.523	2	98.3312	12.409	2	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]B)(C[6a]C[6a]H)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]B)(C[6a]C[6a]H)(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	100.1065	6.162	2	100.1065	37.975	2	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	106.3097	0.428	3	106.3097	0.183	3	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]C)2(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]C)2(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	103.4230	1.393	3	103.4230	1.940	3	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]Cl)2(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]Cl)2(PC[6a]2F){2|Cl<1>,1|C<3>}	F(PC[6a]3)	104.7935	6.498	2	104.7935	42.219	2	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]F)2(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]F)2(PC[6a]2F){1|C<3>,2|F<1>}	F(PC[6a]3)	104.8349	0.960	7	104.8349	0.922	7	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]H)2(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]H)2(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	104.3804	4.947	25	104.3804	24.470	25	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]2F)	F(PC[6a]3)	P(C[6a]C[6a]2)3(F)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]2F){1|C<3>,2|H<1>}	F(PC[6a]3)	108.8160	0.000	1	108.8160	0.000	1	103.4373	26.829	53	103.1817	28.039	57	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	4:3:3:	4:	C[5]-3:C[6a]-3:C[6a]-3:F-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[5]F)(C[6a]C[6a]H)2	F(PC[6a]2C[5])	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[5]F)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	F(PC[6a]2C[5])	103.9715	1.158	2	103.9715	1.340	2	103.9715	1.340	2	106.0178	6.200	4	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:3:1:	4:3:3:	4:	C[6]-3:C[6a]-3:C[6a]-3:F-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[6]F)(C[6a]C[6a]H)2	F(PC[6a]2C[6])	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)	C[6a](PC[6a]C[6]F)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	F(PC[6a]2C[6])	108.0640	0.716	2	108.0640	0.512	2	108.0640	0.512	2	106.0178	6.200	4	103.3497	25.441	67	103.3497	25.441	67
992	643	830	0:SP3_SP-NON_SP2	P	C[6a]	F	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:F-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HH)(F)	C[6a](C[6a]C[6a]H)2(PC[6a]CF)	F(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HH)(F)	C[6a](C[6a]C[6a]H)2(PC[6a]CF){1|C<3>,2|H<1>}	F(PC[6a]2C)	105.2855	1.410	4	105.2855	1.987	4	105.2855	1.987	4	105.2855	1.987	4	103.3497	25.441	67	103.3497	25.441	67
992	643	846	0:SP3_SP2_SP2	P	C[6a]	C[4]	3:3:3:1:	4:3:3:	4:3:4:	C[4]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[4,5]-4:C[4]-3:P-4:	P(C[4]C[4,5]C[4])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2	C[4](C[4,5]C[5,6a]2C[4])(C[4]C[4]Cl)(PC[6a]2O)	P(C[4]C[4,5]C[4])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[4](C[4,5]C[5,6a]2C[4])(C[4]C[4]Cl)(PC[6a]2O){1|C<2>,4|C<3>}	105.5305	3.118	2	105.5305	9.720	2	105.5305	9.720	2	105.5305	9.720	2	107.1542	17.550	6	107.1542	17.550	6
992	643	846	0:SP3_SP2_SP2	P	C[6a]	C[4]	3:3:3:2:	4:3:3:	4:2:4:	C[4]-3:C[6a]-3:C[6a]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	P[4]-4:As[4]-2:P-4:	P(C[4]As[4]P[4])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[4]N)(C[6a]C[6a]H)2	C[4](P[4]C[6a]2N[4])(As[4]N[4])(PC[6a]2N)	P(C[4]As[4]P[4])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[4]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[4](P[4]C[6a]2N[4])(As[4]N[4])(PC[6a]2N){1|Si<4>,4|C<3>}	111.2775	5.042	2	111.2775	25.426	2	111.2775	25.426	2	111.2775	25.426	2	107.1542	17.550	6	107.1542	17.550	6
992	643	846	0:SP3_SP2_SP2	P	C[6a]	C[4]	3:3:3:2:	4:3:3:	4:3:4:	C[4]-3:C[6a]-3:C[6a]-3:N-2:	P-4:C[6a]-3:C[6a]-3:	P[4]-4:Ge[4]-3:P-4:	P(C[4]Ge[4]P[4])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[4]N)(C[6a]C[6a]H)2	C[4](P[4]C[6a]2N[4])(Ge[4]N[4]Mn)(PC[6a]2N)	P(C[4]Ge[4]P[4])(C[6a]C[6a]2)2(NSi)	C[6a](PC[6a]C[4]N)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C[4](P[4]C[6a]2N[4])(Ge[4]N[4]Mn)(PC[6a]2N){1|Si<4>,4|C<3>}	104.6545	0.911	2	104.6545	0.831	2	104.6545	0.831	2	104.6545	0.831	2	107.1542	17.550	6	107.1542	17.550	6
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:N[6]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]C)2(PN[6]OO)	N[6](C[6]C[6]H)2(PC[6a]OO)	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]C)2(PN[6]OO){1|C<3>,2|H<1>}	N[6](C[6]C[6]H)2(PC[6a]OO){1|C<3>,2|H<1>}	99.4180	0.000	1	99.4180	0.000	1	100.2560	1.404	2	100.2560	1.404	2	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:1:1:	3:3:4:	3:3:4:	C[6a]-3:N[6]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]H)2(PN[6]OO)	N[6](C[6]C[6]H)2(PC[6a]OO)	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]H)2(PN[6]OO){1|C<3>,2|H<1>}	N[6](C[6]C[6]H)2(PC[6a]OO){1|C<3>,2|H<1>}	101.0940	0.000	1	101.0940	0.000	1	100.2560	1.404	2	100.2560	1.404	2	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:1:1:	3:3:4:	4:3:3:	C[6a]-3:N[6]-3:Se-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-3:C[6]-3:	P(C[6a]C[6a]2)(N[6]C[6]2)(Se)2	C[6a](C[6a]C[6a]H)2(PN[6]Se2)	N[6](PC[6a]Se2)(C[6]C[6]H)2	P(C[6a]C[6a]2)(N[6]C[6]2)(Se)2	C[6a](C[6a]C[6a]H)2(PN[6]Se2){1|C<3>,2|H<1>}	N[6](PC[6a]Se2)(C[6]C[6]H)2{1|C<3>,2|H<1>}	96.6811	0.000	1	96.6811	0.000	1	96.6811	0.000	1	96.6811	0.000	1	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:2:1:	3:3:4:	3:3:4:	C[6a]-3:N[6]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:C[6]-3:P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO)	N[6](C[6]C[6]H)2(PC[6a]OO)	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO){1|C<3>,2|H<1>}	N[6](C[6]C[6]H)2(PC[6a]OO){1|C<3>,2|H<1>}	104.1960	0.000	1	104.1960	0.000	1	104.1960	0.000	1	104.1960	0.000	1	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:N[6]-3:N[6]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-4:C[6]-4:	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C)	N[6](PC[6a]N[6]C)(C[6]C[6]HH)2	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C){1|C<3>,2|H<1>}	N[6](PC[6a]N[6]C)(C[6]C[6]HH)2{1|C<4>,4|H<1>}	104.6060	0.000	1	104.6060	0.000	1	104.6060	0.000	1	104.6060	0.000	1	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP2	P	C[6a]	N[6]	3:3:3:3:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2	N[6](C[6]C[6]HH)2(PC[6a]2C)	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]2C){1|C<4>,4|H<1>}	106.2905	8.391	2	106.2905	70.413	2	106.2905	70.413	2	106.2905	70.413	2	102.6537	25.272	7	102.6537	25.272	7
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:1:1:	3:3:4:	4:4:4:	C[6a]-3:N[6]-3:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(S)2	C[6a](C[6a]C[6a]H)2(PN[6]SS)	N[6](C[6]C[6]HH)2(PC[6a]SS)	P(C[6a]C[6a]2)(N[6]C[6]2)(S)2	C[6a](C[6a]C[6a]H)2(PN[6]SS){1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]SS){1|O<2>,4|H<1>}	103.2430	0.000	1	103.2430	0.000	1	103.2430	0.000	1	102.4968	4.516	5	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:1:1:	3:3:4:	4:4:4:	C[6a]-3:N[6]-3:Se-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(Se)2	C[6a](C[6a]C[6a]H)2(PN[6]Se2)	N[6](C[6]C[6]HH)2(PC[6a]Se2)	P(C[6a]C[6a]2)(N[6]C[6]2)(Se)2	C[6a](C[6a]C[6a]H)2(PN[6]Se2){1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]Se2){1|O<2>,4|H<1>}	102.3102	2.406	4	102.3102	5.789	4	102.3102	5.789	4	102.4968	4.516	5	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:3:1:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(O)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2	N[6](C[6]C[6]HH)2(PC[6a]2O)	P(C[6a]C[6a]2)2(N[6]C[6]2)(O)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]2O){1|C<4>,4|H<1>}	103.5835	0.244	2	103.5835	0.060	2	103.5835	0.060	2	103.5835	0.060	2	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:3:2:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(OSn)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2	N[6](C[6]C[6]HH)2(PC[6a]2O)	P(C[6a]C[6a]2)2(N[6]C[6]2)(OSn)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]2O){1|N<3>,4|H<1>}	105.1980	1.018	2	105.1980	1.037	2	105.1980	1.037	2	105.1980	1.037	2	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:N[6]-3:N[6]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-4:C[6]-4:	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C)	N[6](PC[6a]N[6]C)(C[6]C[6]HH)2	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C){1|C<3>,2|H<1>}	N[6](PC[6a]N[6]C)(C[6]C[6]HH)2{1|C<4>,4|H<1>}	107.5910	0.000	1	107.5910	0.000	1	107.5910	0.000	1	107.5910	0.000	1	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:3:3:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2	N[6](C[6]C[6]HH)2(PC[6a]2C)	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]2C){1|C<4>,4|H<1>}	104.6510	0.134	2	104.6510	0.018	2	105.6238	4.341	6	105.6238	4.341	6	104.4613	5.379	16	104.4613	5.379	16
992	643	856	0:SP3_SP2_SP3	P	C[6a]	N[6]	3:3:3:3:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	C[6]-4:C[6]-4:P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(CZnP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2	N[6](C[6]C[6]HH)2(PC[6a]2C)	P(C[6a]C[6a]2)2(N[6]C[6]2)(CZnP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	N[6](C[6]C[6]HH)2(PC[6a]2C){1|C<4>,4|H<1>}	106.1103	2.506	4	106.1103	6.282	4	105.6238	4.341	6	105.6238	4.341	6	104.4613	5.379	16	104.4613	5.379	16
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:1:1:1:	3:3:4:	4:	C[6a]-3:Cl-1:Cl-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(Cl)2(O)	C[6a](C[6a]C[6a]C)2(PCl2O)	O(PC[6a]Cl2)	P(C[6a]C[6a]2)(Cl)2(O)	C[6a](C[6a]C[6a]C)2(PCl2O){1|C<3>,2|H<1>}	O(PC[6a]Cl2)	119.7180	0.000	1	119.7180	0.000	1	119.7180	0.000	1	108.7760	9.180	23	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:1:1:1:	3:3:4:	4:	C[6a]-3:H-1:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(H)(O)2	C[6a](C[6a]C[6a]H)2(PHOO)	O(PC[6a]HO)	P(C[6a]C[6a]2)(H)(O)2	C[6a](C[6a]C[6a]H)2(PHOO){1|C<3>,2|H<1>}	O(PC[6a]HO)	110.1220	2.558	2	110.1220	6.545	2	110.1220	6.545	2	108.7760	9.180	23	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:1:1:1:	3:3:4:	4:	C[6a]-3:O-1:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(O)3	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(O)3	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|S<4>}	O(PC[6a]OO)	108.4585	2.123	2	108.0943	3.304	20	108.0943	3.304	20	108.7760	9.180	23	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:1:1:1:	3:3:4:	4:	C[6a]-3:O-1:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(O)3	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(O)3	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	108.0538	1.847	18	108.0943	3.304	20	108.0943	3.304	20	108.7760	9.180	23	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]C)2(PHOO)	O(PC[6a]HO)	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]C)2(PHOO){1|C<3>,2|H<1>}	O(PC[6a]HO)	113.1220	0.000	1	113.1220	0.000	1	111.8235	3.372	2	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]H)2(PHOO)	O(PC[6a]HO)	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]H)2(PHOO){1|C<3>,2|H<1>}	O(PC[6a]HO)	110.5250	0.000	1	110.5250	0.000	1	111.8235	3.372	2	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:N-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	109.7090	0.000	1	109.7090	0.000	1	109.7090	0.000	1	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OH)(O)2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OH)(O)2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)	108.6933	2.107	6	108.6933	4.440	6	108.6933	4.440	6	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6])(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	110.4155	0.134	2	110.4155	0.018	2	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	109.8555	1.169	2	109.8555	1.366	2	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]OO)	109.2406	1.496	16	109.2406	2.238	16	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(PO3){1|C<3>,1|H<1>}	O(PC[6a]OO)	106.6370	0.194	2	106.6370	0.038	2	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|P<4>}	O(PC[6a]OO)	108.0805	2.515	2	108.4891	1.971	54	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	108.4867	1.369	50	108.4891	1.971	54	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|P<4>}	O(PC[6a]OO)	108.9600	2.359	2	108.4891	1.971	54	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OP)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OP)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	110.0607	2.658	6	110.0607	7.064	6	108.7859	2.585	82	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)(O)(S)	C[6a](C[6a]C[6a]H)2(POOS)	O(PC[6a]OS)	P(C[6a]C[6a]2)(OC)(O)(S)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(PC[6a]OS)	108.8402	1.167	28	108.8402	1.363	28	108.8171	1.511	31	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])(O)(S)	C[6a](C[6a]C[6a]H)2(POOS)	O(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6a])(O)(S)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(PC[6a]OS)	108.6007	2.047	3	108.6007	4.190	3	108.8171	1.511	31	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	4:	C[6a]-3:P-2:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(PC[6a])(H)(O)	C[6a](C[6a]C[6a]2)2(PHOP)	O(PC[6a]HP)	P(C[6a]C[6a]2)(PC[6a])(H)(O)	C[6a](C[6a]C[6a]2)2(PHOP){2|H<1>,5|C<3>}	O(PC[6a]HP)	114.2010	0.891	4	114.2010	0.794	4	114.2010	0.794	4	109.0166	3.301	126	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	2:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	N[6a]-2:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]N[6a])(OC)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]O)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]N[6a])(OC)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]O)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)	112.4470	0.000	1	112.4470	0.000	1	112.4470	0.000	1	112.4470	0.000	1	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:2:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[5a,6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3)	O(PC[6a]OO)	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	O(PC[6a]OO)	112.5235	0.711	2	112.6437	0.296	3	112.6437	0.296	3	111.6770	3.935	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:2:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[5a,6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3)	O(PC[6a]OO)	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3){1|Cl<1>,1|C<3>,1|N<2>,1|N<3>}	O(PC[6a]OO)	112.8840	0.000	1	112.6437	0.296	3	112.6437	0.296	3	111.6770	3.935	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:2:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]N[6a])(OH)2(O)	C[6a](C[6a]N[6a]H)(N[6a]C[6a])(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]N[6a])(OH)2(O)	C[6a](C[6a]N[6a]H)(N[6a]C[6a])(PO3){1|C<3>,1|H<1>}	O(PC[6a]OO)	108.7770	0.000	1	108.7770	0.000	1	108.7770	0.000	1	111.6770	3.935	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:C-2:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.3150	0.133	2	113.3150	0.018	2	113.3150	0.018	2	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]OO)	114.9020	0.000	1	114.9020	0.000	1	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)	110.2380	0.000	1	110.2380	0.000	1	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3){1|H<1>,1|O<2>,3|C<3>}	O(PC[6a]OO)	116.7220	0.000	1	116.4915	0.106	2	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3){1|H<1>,3|C<3>}	O(PC[6a]OO)	116.2610	0.000	1	116.4915	0.106	2	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OCu)(OH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OCu)(OH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)	109.8205	1.411	4	109.8205	1.990	4	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]OO)	109.0100	0.000	1	109.0100	0.000	1	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)	111.7805	1.767	6	111.7805	3.124	6	111.8065	7.231	15	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)	113.0755	2.324	2	113.0755	5.402	2	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,4|C<3>}	O(PC[6a]OO)	113.5675	2.177	2	113.5675	4.740	2	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PO3){4|C<3>}	O(PC[6a]OO)	113.3030	0.000	1	113.3030	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]C)(PO3){2|C<3>}	O(PC[6a]OO)	111.0760	0.000	1	111.0760	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	113.4820	0.000	1	113.4820	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3){1|C<3>,2|C<4>}	O(PC[6a]OO)	111.1680	0.000	1	111.1680	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	114.5057	2.194	3	114.5057	4.815	3	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	114.7900	1.186	11	114.7900	1.407	11	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	113.0570	0.000	1	113.0570	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	110.6450	0.000	1	110.6450	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	117.2068	1.259	30	117.2068	1.586	30	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OCd)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OCd)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	109.1650	0.000	1	109.1650	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OCu)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OCu)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	108.6710	0.481	2	108.6710	0.231	2	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	111.2988	1.108	9	111.2988	1.228	9	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)	108.9540	0.000	1	108.9540	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	113.9280	0.000	1	113.9280	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	110.4227	1.448	16	110.3624	2.102	20	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|P<4>}	O(PC[6a]OO)	110.1213	1.653	4	110.3624	2.102	20	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OMn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OMn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|S<4>}	O(PC[6a]OO)	108.8140	0.000	1	108.8140	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(ONi)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(ONi)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|P<4>}	O(PC[6a]OO)	110.9640	0.000	1	110.9640	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OP)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OP)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	116.9627	0.249	3	116.9627	0.062	3	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OPd)(OH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OPd)(OH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	107.1600	0.000	1	107.1600	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OSb)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OSb)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	109.0300	2.031	2	109.0300	4.124	2	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OSn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OSn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	108.4845	0.330	2	108.4845	0.109	2	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OZn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OZn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	109.0960	0.000	1	109.0960	0.000	1	113.4213	11.512	99	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS)	O(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(PC[6a]OS)	111.8920	0.000	1	111.8920	0.000	1	112.3155	0.359	2	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS)	O(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(PC[6a]OS)	112.7390	0.000	1	112.7390	0.000	1	112.3155	0.359	2	113.1955	10.815	118	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:3:1:	3:3:4:	4:	C[6a]-3:O-2:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	111.9640	0.000	1	111.9640	0.000	1	111.9640	0.000	1	111.7930	0.058	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:3:1:	3:3:4:	4:	C[6a]-3:O-2:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(OC[6])(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	111.6220	0.000	1	111.6220	0.000	1	111.6220	0.000	1	111.7930	0.058	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[3x6])(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[3x6])(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	112.5590	0.000	1	112.5590	0.000	1	112.1137	1.981	6	112.1137	1.981	6	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	111.4940	0.000	1	111.4940	0.000	1	112.1137	1.981	6	112.1137	1.981	6	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	111.8320	0.317	2	111.8320	0.100	2	112.1137	1.981	6	112.1137	1.981	6	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	110.3860	0.000	1	110.3860	0.000	1	112.1137	1.981	6	112.1137	1.981	6	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(CH3)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CH3)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	114.5790	0.000	1	114.5790	0.000	1	112.1137	1.981	6	112.1137	1.981	6	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[5]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO)	O(PC[6a]C[5]O)	P(C[6a]C[6a]2)(C[5]N[5]2)(O)2	C[6a](C[6a]C[6a]H)2(PC[5]OO){1|C<3>,2|H<1>}	O(PC[6a]C[5]O)	109.5315	0.415	4	109.5315	0.172	4	109.5315	0.172	4	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]HO)	O(PC[6a]2H)	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]HO){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]2H)	112.4995	1.331	2	112.4995	1.773	2	113.3476	1.513	8	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]HO)	O(PC[6a]2H)	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]HO){1|C<3>,2|H<1>}	O(PC[6a]2H)	114.8655	0.981	2	114.8655	0.962	2	113.3476	1.513	8	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]HO)	O(PC[6a]2H)	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]HO){1|C<3>,2|H<1>}	O(PC[6a]2H)	112.0620	0.000	1	112.0620	0.000	1	113.3476	1.513	8	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]HO)	O(PC[6a]2H)	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]HO){1|C<3>,2|C<4>}	O(PC[6a]2H)	113.4095	0.343	2	113.3297	0.078	3	113.3476	1.513	8	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]HO)	O(PC[6a]2H)	P(C[6a]C[6a]2)2(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]HO){1|C<3>,2|H<1>}	O(PC[6a]2H)	113.1700	0.000	1	113.3297	0.078	3	113.3476	1.513	8	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(O)2	C[6a](C[6a]C[6a]F)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(O)2	C[6a](C[6a]C[6a]F)2(PC[6a]OO){1|C<3>,2|F<1>}	O(PC[6a]2O)	108.3039	0.826	8	108.3039	0.681	8	108.4922	1.129	44	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(O)2	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(O)2	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	108.5340	1.114	36	108.5340	1.240	36	108.4922	1.129	44	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(O)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(PC[6a]2S)	P(C[6a]C[6a]2)2(O)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(PC[6a]2S)	107.0090	0.279	2	107.0090	0.078	2	107.0090	0.078	2	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:N-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NCH)(O)2	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(NCH)(O)2	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	107.5095	1.117	2	107.5095	1.247	2	107.5095	1.247	2	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:N[6]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]C)2(PN[6]OO)	O(PC[6a]N[6]O)	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]C)2(PN[6]OO){1|C<3>,2|H<1>}	O(PC[6a]N[6]O)	112.2010	1.192	2	112.2010	1.421	2	111.5175	1.126	4	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:N[6]-3:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]H)2(PN[6]OO)	O(PC[6a]N[6]O)	P(C[6a]C[6a]2)(N[6]C[6]2)(O)2	C[6a](C[6a]C[6a]H)2(PN[6]OO){1|C<3>,2|H<1>}	O(PC[6a]N[6]O)	110.8340	0.294	2	110.8340	0.087	2	111.5175	1.126	4	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:1:1:	3:3:4:	4:	C[6a]-3:P-3:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(PC[6a]H)(H)(O)	C[6a](C[6a]C[6a]2)2(PHOP)	O(PC[6a]HP)	P(C[6a]C[6a]2)(PC[6a]H)(H)(O)	C[6a](C[6a]C[6a]2)2(PHOP){2|H<1>,5|C<3>}	O(PC[6a]HP)	113.7380	0.000	1	113.7380	0.000	1	113.7380	0.000	1	109.3447	4.382	65	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[5a]-3:C[6a]-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[5a]CO)	O(PC[5a]C[6a]C)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[5a]CO){1|C<3>,2|H<1>}	O(PC[5a]C[6a]C)	111.8020	0.000	1	111.8020	0.000	1	111.8020	0.000	1	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCH)(CC)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCH)(CC)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.5980	0.264	2	113.5980	0.070	2	113.5980	0.070	2	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	113.3300	0.000	1	113.3300	0.000	1	112.2750	0.836	3	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	111.7475	0.039	2	111.7475	0.002	2	112.2750	0.836	3	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6]NO)	O(PC[6a]C[6]N)	P(C[6a]C[6a]2)(C[6]C[6]2)(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6]NO){1|C<3>,2|H<1>}	O(PC[6a]C[6]N)	110.2985	0.148	2	110.2985	0.022	2	110.2985	0.022	2	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.9095	2.340	4	112.9095	5.474	4	112.3293	1.833	21	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.1928	1.077	17	112.1928	1.161	17	112.3293	1.833	21	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	112.4275	5.663	2	112.4275	32.072	2	111.2064	4.169	28	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.9825	1.077	16	111.9825	1.160	16	111.2064	4.169	28	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.1560	1.304	4	111.1560	1.700	4	111.2064	4.169	28	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	108.7632	1.381	6	108.7632	1.907	6	111.2064	4.169	28	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OB)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OB)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	111.5095	1.006	2	111.5095	1.012	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OBi)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OBi)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	111.9275	1.265	2	111.9275	1.600	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	112.5150	3.349	2	112.5150	11.215	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	113.0285	1.334	8	113.0285	1.779	8	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	111.0610	0.000	1	111.0610	0.000	1	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	113.8696	1.946	5	113.8696	3.789	5	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	117.2310	0.000	1	117.2310	0.000	1	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	113.1381	1.090	25	113.1381	1.189	25	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OCo)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OCo)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	108.9770	1.755	2	108.9770	3.080	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OGe[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OGe[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	110.3750	1.242	2	110.3750	1.542	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	111.0600	0.000	1	110.8963	0.046	3	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|O<2>}	O(PC[6a]2O)	110.8145	0.230	2	110.8963	0.046	3	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	112.0030	0.000	1	112.0030	0.000	1	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	112.3298	1.198	10	112.3298	1.434	10	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(ON[5,6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(ON[5,6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	112.6730	0.894	2	112.6730	0.799	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	112.6105	1.211	2	112.6105	1.467	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OPd)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OPd)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	109.2920	0.191	2	109.2920	0.036	2	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(ORu)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(ORu)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	109.7468	2.113	4	109.7468	4.465	4	112.3927	3.348	74	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OS)	O(PC[6a]2S)	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OS){1|C<3>,2|H<1>}	O(PC[6a]2S)	110.6050	0.000	1	110.6050	0.000	1	111.8838	2.393	6	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(PC[6a]2S)	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(PC[6a]2S)	109.6720	0.000	1	109.6720	0.000	1	111.8838	2.393	6	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(SC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(PC[6a]2S)	P(C[6a]C[6a]2)2(SC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(PC[6a]2S)	112.7565	0.892	4	112.7565	0.796	4	111.8838	2.393	6	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NCC)(OP)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(NCC)(OP)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	112.8510	0.000	1	112.8510	0.000	1	112.3487	0.506	3	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NC[6]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(NC[6]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	111.5350	0.000	1	111.5350	0.000	1	112.3487	0.506	3	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NC[6a]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)	P(C[6a]C[6a]2)(NC[6a]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)	112.6600	0.000	1	112.6600	0.000	1	112.3487	0.506	3	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:N[6]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO)	O(PC[6a]N[6]O)	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO){1|C<3>,2|H<1>}	O(PC[6a]N[6]O)	114.3140	0.000	1	114.3140	0.000	1	114.3140	0.000	1	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:O-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OCd2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)	P(C[6a]C[6a]2)(OCd2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)	109.2640	0.000	1	109.2640	0.000	1	109.2640	0.000	1	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:	C[6a]-3:Se-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(SeCu2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PSeOO)	O(PC[6a]SeO)	P(C[6a]C[6a]2)(SeCu2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PSeOO){1|C<3>,2|H<1>}	O(PC[6a]SeO)	109.3260	0.000	1	109.3260	0.000	1	109.3260	0.000	1	112.0799	3.312	143	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	2:2:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	N[6a]-2:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](N[6a]C[6a])2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](N[6a]C[6a])2(PC[6a]2O){1|N<2>,2|C<3>}	O(PC[6a]3)	113.0970	0.000	1	111.3115	6.376	2	111.3115	6.376	2	111.3115	6.376	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	2:2:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	N[6a]-2:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](N[6a]C[6a])2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](N[6a]C[6a])2(PC[6a]2O){1|N<2>,2|N<3>}	O(PC[6a]3)	109.5260	0.000	1	111.3115	6.376	2	111.3115	6.376	2	111.3115	6.376	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	2:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	N[6a]-2:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	111.6680	0.000	1	111.6680	0.000	1	111.0267	0.612	4	111.0267	0.612	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	2:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	N[6a]-2:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]H)(PC[6a]2O){2|C<3>}	O(PC[6a]3)	110.8130	0.803	3	110.8130	0.644	3	111.0267	0.612	4	111.0267	0.612	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:2:4:	4:	C[6a]-3:C[6]-3:C[6]-3:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6]2O){1|C<3>,2|H<1>}	O(PC[6a]C[6]2)	113.4743	0.682	3	113.4743	0.465	3	113.4743	0.465	3	113.4647	2.306	12	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:2:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a,6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(N[6a]C[6a,6a])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(N[6a]C[6a,6a])(PC[6a]2O){1|H<1>,4|C<3>}	O(PC[6a]3)	114.8640	0.923	4	114.8640	0.851	4	114.8640	0.851	4	113.4647	2.306	12	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:2:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]2O){1|C<3>,1|H<1>,1|P<4>}	O(PC[6a]3)	111.1140	0.444	2	111.1140	0.197	2	112.3394	1.928	5	113.4647	2.306	12	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:2:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]N[6a])3(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]N[6a])3(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	113.1563	1.120	3	113.1563	1.255	3	112.3394	1.928	5	113.4647	2.306	12	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[5]-3:C[5]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5]C[5]N[5])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5]2O)	O(PC[6a]C[5]2)	P(C[5]C[5]N[5])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5]2O){1|C<3>,2|H<1>}	O(PC[6a]C[5]2)	113.0450	0.000	1	113.0450	0.000	1	113.0450	0.000	1	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[5a]-3:C[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5a]C[5a]N[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]C)2(PC[5a]2O)	O(PC[5a]2C[6a])	P(C[5a]C[5a]N[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]C)2(PC[5a]2O){1|C<3>,2|H<1>}	O(PC[5a]2C[6a])	114.1945	0.400	2	114.1945	0.160	2	115.0816	1.185	5	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[5a]-3:C[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5a]2O)	O(PC[5a]2C[6a])	P(C[5a]C[5a]O[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[5a]2O){1|C<3>,2|H<1>}	O(PC[5a]2C[6a])	115.6730	0.989	3	115.6730	0.978	3	115.0816	1.185	5	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	111.7540	0.000	1	111.7540	0.000	1	111.7540	0.000	1	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CBrC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CBrC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.7485	1.094	2	111.7485	1.197	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.9295	1.146	24	111.9295	1.312	24	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.5920	0.000	1	110.5920	0.000	1	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2416	0.905	9	112.2416	0.820	9	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[3]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[3]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.1020	1.976	2	111.1020	3.903	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[5,6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[5,6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.4125	1.450	2	112.4125	2.103	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[5]O)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[5]O)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.7265	1.155	2	112.7265	1.333	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.1186	1.182	8	112.1186	1.398	8	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6]P)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6]P)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.6963	0.881	4	111.6963	0.776	4	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2277	1.107	70	112.2277	1.226	70	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]C[5])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]C[5])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.2560	2.137	2	111.2560	4.566	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CClC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CClC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	113.4280	1.252	2	113.4280	1.566	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CNO)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CNO)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2670	3.349	4	112.2670	11.218	4	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CNS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CNS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.5390	0.925	2	112.5390	0.855	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CPP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CPP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	109.9630	1.037	2	109.9630	1.075	2	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CSS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CSS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.3692	2.070	4	110.3692	4.286	4	112.0546	1.662	140	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[5,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5,6a]C[5,6a]C[5,5])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5,6a]C[5,6a]C[5,5])(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	O(PC[6a]3)	112.9597	1.349	3	112.9597	1.819	3	111.6090	4.749	5	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[5,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5,6a]C[5,6a]C[5])(C[6a]C[5,6a]C[6a])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5,6a]C[5,6a]C[5])(C[6a]C[5,6a]C[6a])(PC[6a]2O){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	O(PC[6a]3)	109.5830	1.295	2	109.5830	1.678	2	111.6090	4.749	5	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[5a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5a,6a]C[5a,6a]S[5a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[5a,6a]C[5a,6a]S[5a])(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,3|C<3>}	O(PC[6a]3)	112.4140	0.942	3	112.4140	0.887	3	112.4140	0.887	3	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6,6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6,6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6,6a]C[6])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6,6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6,6a]C[6,6a]C[6])(PC[6a]2O){1|O<2>,2|H<1>,5|C<3>}	O(PC[6a]3)	113.3740	0.000	1	113.3740	0.000	1	113.3740	0.000	1	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a,6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])2(PC[6a]2O){2|H<1>,5|C<3>}	O(PC[6a]3)	113.5700	0.000	1	113.5700	0.000	1	113.5700	0.000	1	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[3x6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){2|H<1>,3|C<3>}	O(PC[6a]3)	114.7080	0.000	1	114.7080	0.000	1	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|Si<4>,1|H<1>,3|C<3>}	O(PC[6a]3)	117.9190	0.000	1	117.9190	0.000	1	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a,6a]H)(PC[6a]2O){1|H<1>,4|C<3>}	O(PC[6a]3)	113.2310	0.000	1	113.2310	0.000	1	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	O(PC[6a]3)	111.1120	0.000	1	113.0349	0.956	8	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,1|S<2>,3|C<3>}	O(PC[6a]3)	113.0960	0.000	1	113.0349	0.956	8	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|N<2>,2|C<3>,2|H<1>}	O(PC[6a]3)	113.2715	0.790	4	113.0349	0.956	8	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){2|H<1>,3|C<3>}	O(PC[6a]3)	113.4925	0.692	2	113.0349	0.956	8	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O[6a])(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O[6a])(PC[6a]2O){1|H<1>,5|C<3>}	O(PC[6a]3)	116.7690	0.000	1	116.7690	0.000	1	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]O[6a]C)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]O[6a]C)(PC[6a]2O){1|H<1>,3|C<3>}	O(PC[6a]3)	111.8420	0.000	1	111.8420	0.000	1	113.7498	3.509	13	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|C<4>}	O(PC[6a]3)	112.0293	1.538	4	111.8534	1.562	10	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.7362	1.162	6	111.8534	1.562	10	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	113.3023	0.815	6	113.3023	0.664	6	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	110.4755	3.972	2	110.4755	15.775	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6,6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6,6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	109.5085	1.496	2	109.5085	2.237	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	110.9850	0.000	1	110.9850	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]C[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.5337	1.423	25	111.5337	2.024	25	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a,6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.9857	0.910	8	111.9857	0.828	8	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)2(C[6a]N[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	112.7362	0.434	4	112.7362	0.189	4	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5,6a]C)(C[6a]C[6a]C)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5,6a]C)(C[6a]C[6a]C)(PC[6a]2O){1|C<3>,2|C<4>}	O(PC[6a]3)	110.3910	0.000	1	110.3910	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5,6a]H)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5,6a]H)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]3)	112.5490	0.059	2	112.5490	0.004	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	112.8105	0.347	2	112.8105	0.121	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[5a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|N<2>,2|C<3>,2|H<1>}	O(PC[6a]3)	115.6360	0.000	1	115.6360	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6,6a]C)(C[6a]C[6a]C)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6,6a]C)(C[6a]C[6a]C)(PC[6a]2O){1|C<3>,2|C<4>}	O(PC[6a]3)	116.5340	0.000	1	116.5340	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,4|C<3>}	O(PC[6a]3)	115.2608	1.698	8	115.2608	2.883	8	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]N[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]N[6a]H)(PC[6a]2O){4|C<3>}	O(PC[6a]3)	112.1480	0.000	1	112.1480	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PC[6a]2O){4|C<3>}	O(PC[6a]3)	112.2100	0.000	1	112.2100	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	112.9710	0.359	2	112.9710	0.129	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[6a]2O){3|C<3>}	O(PC[6a]3)	111.0726	2.534	8	111.0726	6.423	8	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]O)(PC[6a]2O){1|C<4>,2|C<3>}	O(PC[6a]3)	109.6050	0.000	1	109.6050	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,2|H<1>,2|N<2>}	O(PC[6a]3)	113.8413	0.792	3	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){1|C<4>,1|H<1>,3|C<3>}	O(PC[6a]3)	113.1775	0.778	4	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,1|O<2>,3|C<3>}	O(PC[6a]3)	114.8049	1.999	12	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,4|C<3>}	O(PC[6a]3)	115.1925	1.340	2	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){2|H<1>,3|C<3>}	O(PC[6a]3)	112.8515	1.491	2	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]2O){2|O<2>,3|C<3>}	O(PC[6a]3)	112.4630	0.000	1	114.1852	2.983	24	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]2)2(PC[6a]2O){2|H<1>,5|C<3>}	O(PC[6a]3)	113.5100	0.035	2	113.5100	0.001	2	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]3)	108.4940	0.000	1	108.4940	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]3)	115.6360	0.000	1	113.2041	3.192	21	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]3)	113.1430	0.000	1	113.2041	3.192	21	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	113.1287	1.828	18	113.2041	3.192	21	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	112.1910	0.000	1	113.2041	3.192	21	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	112.0270	5.494	3	112.0270	30.182	3	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	O(PC[6a]3)	114.7050	0.000	1	113.3353	2.916	3	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O){1|N<3>,2|C<3>,2|H<1>}	O(PC[6a]3)	113.8790	0.000	1	113.3353	2.916	3	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]2O){3|C<3>,3|H<1>}	O(PC[6a]3)	111.4220	0.000	1	113.3353	2.916	3	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)(C[6a]C[6a]H)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	110.5070	0.000	1	110.5070	0.000	1	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)2(PC[6a]2O){1|C<3>,2|F<1>}	O(PC[6a]3)	112.9478	1.804	6	112.6226	3.232	8	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]F)2(PC[6a]2O){1|N<2>,2|F<1>}	O(PC[6a]3)	111.6470	1.954	2	112.6226	3.232	8	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]3)	112.0570	0.000	1	111.8528	0.654	13	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.8358	0.842	12	111.8528	0.654	13	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<2>,1|C<3>,1|C<4>}	O(PC[6a]3)	114.8490	0.000	1	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]3)	113.9870	0.000	1	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]3)	109.9173	0.678	3	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,1|H<1>,1|S<4>}	O(PC[6a]3)	107.7090	0.000	1	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,2|C<4>}	O(PC[6a]3)	110.3705	0.046	2	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.7180	2.151	7	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	108.4720	0.000	1	111.0960	5.161	16	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	114.6470	1.630	4	114.6470	2.658	4	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]S)(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]S)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.3327	1.034	3	111.3327	1.070	3	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,1|H<1>,1|N<3>}	O(PC[6a]3)	112.1483	0.925	6	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]3)	114.4420	0.000	1	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|C<4>}	O(PC[6a]3)	112.5834	0.589	8	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	111.7807	1.196	450	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<4>,1|H<1>,1|N<2>}	O(PC[6a]3)	111.5670	0.000	1	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|Cl<1>,1|C<3>,1|H<1>}	O(PC[6a]3)	111.9753	0.334	3	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]2)3(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|H<1>,2|C<3>}	O(PC[6a]3)	112.2054	1.372	5	111.8098	1.418	474	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)	P(C[6a]C[6a]N[6a])(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)	112.8403	0.668	12	112.8403	0.446	12	112.0198	2.332	671	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	112.2010	1.991	3	112.2010	3.962	3	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	110.2000	0.000	1	110.2000	0.000	1	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.0110	3.490	4	111.0110	12.180	4	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	110.5851	1.635	18	110.5851	2.673	18	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	108.7690	0.000	1	108.7690	0.000	1	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	110.8540	0.000	1	110.8540	0.000	1	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.5666	1.846	30	111.5666	3.409	30	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NCP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NCP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.8413	0.588	4	111.8413	0.346	4	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[5]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[5]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	112.6428	1.636	11	112.6428	2.676	11	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	112.5363	1.767	6	112.5363	3.122	6	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]2N)	110.7385	1.852	2	110.7385	3.430	2	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]NO){1|H<1>,1|O<2>,3|C<3>}	O(PC[6a]2N)	113.5433	1.500	3	113.5433	2.250	3	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,1|H<1>,1|O<2>}	O(PC[6a]2N)	112.1200	0.000	1	111.2233	1.791	35	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.1969	1.349	34	111.2233	1.791	35	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.4580	0.398	4	111.4580	0.158	4	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	111.0745	0.930	2	111.0745	0.865	2	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(NNP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)	P(C[6a]C[6a]2)2(NNP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)	112.4882	1.138	4	112.4882	1.295	4	111.4923	2.932	129	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:O-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(OLi2)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)	P(C[6a]C[6a]2)2(OLi2)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)	106.7970	0.950	2	106.7970	0.903	2	106.7970	0.903	2	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:P-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(PC[6a]2)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]OP)	O(PC[6a]2P)	P(C[6a]C[6a]2)2(PC[6a]2)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]OP){1|C<3>,2|H<1>}	O(PC[6a]2P)	109.0465	0.037	2	109.0465	0.001	2	109.0465	0.001	2	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:N-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NCN)2(O)	C[6a](C[6a]C[6a]H)2(PNNO)	O(PC[6a]NN)	P(C[6a]C[6a]2)(NCN)2(O)	C[6a](C[6a]C[6a]H)2(PNNO){1|C<3>,2|H<1>}	O(PC[6a]NN)	111.0390	0.000	1	111.0390	0.000	1	111.9741	1.292	8	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:N-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NCS)2(O)	C[6a](C[6a]C[6a]H)2(PNNO)	O(PC[6a]NN)	P(C[6a]C[6a]2)(NCS)2(O)	C[6a](C[6a]C[6a]H)2(PNNO){1|C<3>,2|H<1>}	O(PC[6a]NN)	111.5840	0.000	1	111.5840	0.000	1	111.9741	1.292	8	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:N-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NC[6a]H)(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNNO)	O(PC[6a]NN)	P(C[6a]C[6a]2)(NC[6a]H)(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNNO){1|C<3>,2|H<1>}	O(PC[6a]NN)	112.1125	0.083	2	112.1125	0.007	2	111.9741	1.292	8	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:N-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NC[6a]H)2(O)	C[6a](C[6a]C[6a]H)2(PNNO)	O(PC[6a]NN)	P(C[6a]C[6a]2)(NC[6a]H)2(O)	C[6a](C[6a]C[6a]H)2(PNNO){1|C<3>,2|H<1>}	O(PC[6a]NN)	111.8890	1.768	3	111.8890	3.125	3	111.9741	1.292	8	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	C[6a]-3:N-3:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(NHN)2(O)	C[6a](C[6a]C[6a]H)2(PNNO)	O(PC[6a]NN)	P(C[6a]C[6a]2)(NHN)2(O)	C[6a](C[6a]C[6a]H)2(PNNO){1|C<3>,2|H<1>}	O(PC[6a]NN)	113.2780	0.000	1	113.2780	0.000	1	111.9741	1.292	8	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	N[5a]-3:N[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O)	O(PC[6a]N[5a]2)	P(N[5a]C[5a,6a]2)2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O){1|C<3>,2|H<1>}	O(PC[6a]N[5a]2)	113.6030	0.646	2	113.6030	0.418	2	114.3972	1.059	4	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:3:4:	4:	N[5a]-3:N[5a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O)	O(PC[6a]N[5a]2)	P(N[5a]C[5a,6a]C[5a])2(C[6a]C[6a]2)(O)	C[6a](C[6a]C[6a]H)2(PN[5a]2O){1|C<3>,2|H<1>}	O(PC[6a]N[5a]2)	115.1915	0.484	2	115.1915	0.235	2	114.3972	1.059	4	111.9895	2.510	986	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	3:4:3:	4:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	C[6a]-3:P-4:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](C[6a]C[6a,6a]C)(PC[6a]C[6]O)(C[6a]C[6a]H)	O(PC[6a]2C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](C[6a]C[6a,6a]C)(PC[6a]C[6]O)(C[6a]C[6a]H){3|C<3>}	O(PC[6a]2C[6])	113.5320	0.000	1	113.5320	0.000	1	113.5320	0.000	1	113.5320	0.000	1	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[4]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[4]C[4,5]C[4])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2	O(PC[6a]2C[4])	P(C[4]C[4,5]C[4])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[4])	113.2790	0.218	2	113.2790	0.047	2	113.2790	0.047	2	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5]N[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	112.2454	1.615	32	112.2454	2.607	32	112.3148	2.454	42	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5]P[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	111.2560	1.455	4	111.2560	2.117	4	112.3148	2.454	42	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5]S[5])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	113.3912	0.611	6	113.3912	0.374	6	112.3148	2.454	42	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	111.3450	1.171	8	111.3450	1.370	8	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]C)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]C)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	110.9140	2.305	2	110.9140	5.314	2	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	110.5160	1.267	4	110.5160	1.605	4	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a]N[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	112.4367	0.946	16	112.4367	0.894	16	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a]O[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	114.4380	1.628	2	114.4380	2.650	2	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]C[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	111.6397	0.054	3	111.6397	0.003	3	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]N[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]N[5a,6a]C[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	112.3980	1.148	2	112.3980	1.319	2	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]N[5a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	112.2095	0.491	2	112.2095	0.242	2	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(PC[5a]C[6a]2)	P(C[5a]N[5a]S[5a])(C[6a]C[6a]2)2(O)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[5a]C[6a]2)	113.2590	0.572	4	113.2590	0.327	4	112.0857	1.778	43	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6,6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2	O(PC[6,6]C[6a]2)	P(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)2(O)	C[6a](PC[6,6]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6,6]C[6a]2)	111.6461	1.435	14	111.6461	2.059	14	111.6461	2.059	14	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[5,6]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[5,6]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.1520	1.304	2	111.1520	1.700	2	110.8100	2.767	4	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6,6a]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6,6a]C[6])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	110.4680	2.476	2	110.4680	6.132	2	110.8100	2.767	4	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[5]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[6a]C[6a]2)2(C[5]C[5]2)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	112.2074	1.211	8	112.2074	1.466	8	112.2074	1.466	8	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.5886	1.690	7	111.5886	2.857	7	111.5886	2.857	7	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:N[5]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(N[5]C[5]2)(O)	C[6a](PC[6a]N[5]O)(C[6a]C[6a]H)2	O(PC[6a]2N[5])	P(C[6a]C[6a]2)2(N[5]C[5]2)(O)	C[6a](PC[6a]N[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2N[5])	110.2035	1.176	6	110.2035	1.384	6	110.2035	1.384	6	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:N[6]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(O)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2	O(PC[6a]2N[6])	P(C[6a]C[6a]2)2(N[6]C[6]2)(O)	C[6a](PC[6a]N[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2N[6])	111.5255	0.320	2	111.5255	0.103	2	111.5255	0.103	2	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	N[3]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(N[3]C[3]O[3])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[3]O)(C[6a]C[6a]H)2	O(PC[6a]2N[3])	P(N[3]C[3]O[3])(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[3]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2N[3])	112.7955	0.545	2	112.7955	0.297	2	112.7955	0.297	2	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:1:	4:3:3:	4:	N[5a]-3:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[5a]O)(C[6a]C[6a]H)2	O(PC[6a]2N[5a])	P(N[5a]C[5a,6a]2)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]N[5a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2N[5a])	112.4180	0.061	2	112.4180	0.004	2	112.4180	0.004	2	111.9942	2.162	132	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:2:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:	P(C[6a]C[6a]N[6a])2(CCHH)(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]N[6a])2(CCHH)(O)	C[6a](C[6a]C[6a]H)(N[6a]C[6a])(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.0115	0.882	4	112.0115	0.779	4	112.0115	0.779	4	112.0115	0.779	4	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:B-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(BH3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]BO)	O(PC[6a]2B)	P(C[6a]C[6a]2)2(BH3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]BO){1|C<3>,2|H<1>}	O(PC[6a]2B)	108.2425	0.462	2	108.2425	0.213	2	108.2425	0.213	2	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])2(CC[6a]CH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a,6a]C[6a])2(CC[6a]CH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PC[6a]CO){2|H<1>,3|C<3>}	O(PC[6a]2C)	114.3455	0.378	2	114.3455	0.143	2	114.3455	0.143	2	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC3)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC3)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	113.3315	3.009	2	113.3315	9.053	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	109.5595	0.108	2	109.5595	0.012	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCCH)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCCH)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.5900	0.000	1	112.5900	0.000	1	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.8889	1.062	15	111.8889	1.127	15	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|C<4>}	O(PC[6a]2C)	110.1080	0.221	2	110.1080	0.049	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6a]CO){1|C<4>,1|H<1>,3|C<3>}	O(PC[6a]2C)	113.1710	0.000	1	113.1710	0.000	1	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.4988	1.367	6	112.4988	1.868	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.5198	2.242	13	112.5198	5.025	13	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|O<2>,3|H<1>}	O(PC[6a]2C)	111.5520	2.213	2	111.5520	4.898	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.8970	0.966	5	110.8970	0.933	5	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|C<4>}	O(PC[6a]2C)	111.8650	0.396	2	111.5049	0.957	87	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.4964	0.987	85	111.5049	0.957	87	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2995	0.428	2	112.2995	0.183	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.9800	0.423	2	110.9800	0.179	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.9171	1.139	7	111.9171	1.296	7	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|C<4>}	O(PC[6a]2C)	112.0447	1.026	4	111.8744	1.402	12	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.7892	1.314	8	111.8744	1.402	12	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[3]C[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[3]C[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.3625	1.119	2	111.3625	1.253	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[3x6]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[3x6]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.6600	0.666	2	112.6600	0.444	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[5]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[5]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.8562	1.120	6	111.8562	1.255	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[5]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[5]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.6445	0.875	2	111.6445	0.765	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[5a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[5a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.8510	0.000	2	111.8510	0.000	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.3092	1.088	6	112.3092	1.183	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6]HH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6]HH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.9147	0.736	6	110.9147	0.541	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.6414	0.813	16	111.6414	0.660	16	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]CF)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]CF)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.8221	1.344	14	112.8221	1.807	14	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.6688	0.436	20	111.6688	0.190	20	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HH)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2178	2.919	6	112.2178	8.519	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.0152	0.952	35	112.0152	0.907	35	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.6960	1.792	4	112.6960	3.213	4	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.4814	0.760	12	111.4814	0.578	12	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]HP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]HP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.5468	0.591	4	111.5468	0.350	4	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CC[6a]SeH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CC[6a]SeH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.0885	1.630	2	112.0885	2.657	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CClCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CClCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	113.0540	1.423	2	113.0540	2.024	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCo2C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CCo2C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.1552	1.479	6	111.1552	2.186	6	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CFHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CFHH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.2371	0.882	8	112.2371	0.778	8	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]2)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]2)(PC[6a]CO){1|H<1>,4|C<3>}	O(PC[6a]2C)	110.0730	0.000	1	110.0730	0.000	1	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.7795	0.937	2	110.7795	0.878	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	110.7310	1.898	2	110.7310	3.602	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CH3)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.5222	0.765	25	111.5222	0.586	25	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CHHN)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.7987	0.666	24	111.7987	0.444	24	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHHO)(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CHHO)(O)	C[6a](C[6a]C[6a]C[5])(C[6a]C[6a]H)(PC[6a]CO){1|C<3>,2|O<2>,3|H<1>}	O(PC[6a]2C)	112.0130	0.000	1	112.0130	0.000	1	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.4340	0.000	1	111.4340	0.000	1	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CHHP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.5675	1.480	10	111.5675	2.189	10	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHNP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CHNP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.6946	0.795	8	111.6946	0.632	8	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CN[6]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CN[6]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.0950	0.462	2	112.0950	0.214	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CReCH)(O)	C[6a](C[6a]C[6a]F)2(PC[6a]CO)	O(PC[6a]2C)	P(C[6a]C[6a]2)2(CReCH)(O)	C[6a](C[6a]C[6a]F)2(PC[6a]CO){1|C<3>,2|F<1>}	O(PC[6a]2C)	111.0005	3.854	2	111.0005	14.857	2	111.7612	1.377	392	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:P-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(PC[6a]2Fe)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OP)	O(PC[6a]2P)	P(C[6a]C[6a]2)2(PC[6a]2Fe)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OP){1|C<3>,2|H<1>}	O(PC[6a]2P)	112.0715	1.230	2	112.0715	1.512	2	112.7885	1.271	4	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:P-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(PC[6a]HW)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OP)	O(PC[6a]2P)	P(C[6a]C[6a]2)2(PC[6a]HW)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OP){1|C<3>,2|H<1>}	O(PC[6a]2P)	113.5055	0.494	2	113.5055	0.244	2	112.7885	1.271	4	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	3:3:4:	4:	C[6a]-3:N[5]-3:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(N[5]C[5]2)(CH3)(O)	C[6a](C[6a]C[6a]H)2(PN[5]CO)	O(PC[6a]N[5]C)	P(C[6a]C[6a]2)(N[5]C[5]2)(CH3)(O)	C[6a](C[6a]C[6a]H)2(PN[5]CO){1|C<3>,2|H<1>}	O(PC[6a]N[5]C)	112.5085	0.018	2	112.5085	0.000	2	112.5085	0.000	2	111.7705	1.462	402	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[3]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[3]C[3]2C)(O)	C[6a](PC[6a]C[3]O)(C[6a]C[6a]H)2	O(PC[6a]2C[3])	P(C[6a]C[6a]2)2(C[3]C[3]2C)(O)	C[6a](PC[6a]C[3]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[3])	110.6848	0.833	6	110.6848	0.694	6	110.6848	0.694	6	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[4]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[4]C[4]2H)(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2	O(PC[6a]2C[4])	P(C[6a]C[6a]2)2(C[4]C[4]2H)(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[4])	112.2957	1.510	20	112.2957	2.281	20	112.2957	2.281	20	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[5]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[5]C[5]2H)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[6a]C[6a]2)2(C[5]C[5]2H)(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	112.1619	0.767	10	112.1619	0.588	10	112.1619	0.588	10	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[6]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2C)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2C)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	109.7920	0.078	2	109.7920	0.006	2	111.4244	0.552	28	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[6]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2F)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2F)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	112.1102	0.458	4	112.1102	0.210	4	111.4244	0.552	28	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:3:4:1:	4:3:3:	4:	C[6a]-3:C[6a]-3:C[6]-4:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6a]C[6a]2)2(C[6]C[6]2H)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6a]C[6a]2)2(C[6]C[6]2H)(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.4481	0.579	22	111.4481	0.335	22	111.4244	0.552	28	111.7426	1.340	64	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:Cl-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(Cl)(O)	C[6a](C[6a]C[6a]H)2(PClCO)	O(PC[6a]ClC)	P(C[6a]C[6a]2)(CC3)(Cl)(O)	C[6a](C[6a]C[6a]H)2(PClCO){1|C<3>,2|H<1>}	O(PC[6a]ClC)	112.7470	0.000	1	112.7470	0.000	1	112.7470	0.000	1	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)(H)(O)	C[6a](C[6a]C[6a]H)2(PCHO)	O(PC[6a]CH)	P(C[6a]C[6a]2)(CCHH)(H)(O)	C[6a](C[6a]C[6a]H)2(PCHO){1|C<3>,2|H<1>}	O(PC[6a]CH)	110.7135	0.200	2	110.7135	0.040	2	111.3547	1.253	3	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(H)(O)	C[6a](C[6a]C[6a]H)2(PCHO)	O(PC[6a]CH)	P(C[6a]C[6a]2)(CC[6a]HH)(H)(O)	C[6a](C[6a]C[6a]H)2(PCHO){1|C<3>,2|H<1>}	O(PC[6a]CH)	112.6370	0.000	1	112.6370	0.000	1	111.3547	1.253	3	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)(O)2	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CCHH)(O)2	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	110.0090	0.679	4	110.0090	0.461	4	108.8928	1.520	22	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CHHN)(O)2	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CHHN)(O)2	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	108.6448	1.199	18	108.6448	1.437	18	108.8928	1.520	22	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(O)(S)	C[6a](C[6a]C[6a]H)2(PCOS)	O(PC[6a]CS)	P(C[6a]C[6a]2)(CC3)(O)(S)	C[6a](C[6a]C[6a]H)2(PCOS){1|C<3>,2|H<1>}	O(PC[6a]CS)	107.0950	0.856	2	107.0950	0.732	2	108.1490	3.699	3	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C-4:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)(O)(S)	C[6a](C[6a]C[6a]H)2(PCOS)	O(PC[6a]CS)	P(C[6a]C[6a]2)(CCHH)(O)(S)	C[6a](C[6a]C[6a]H)2(PCOS){1|C<3>,2|H<1>}	O(PC[6a]CS)	110.2570	0.000	1	110.2570	0.000	1	108.1490	3.699	3	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C[6]-4:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(H)(O)	C[6a](C[6a]C[6a]C)2(PC[6]HO)	O(PC[6a]C[6]H)	P(C[6a]C[6a]2)(C[6]C[6]2H)(H)(O)	C[6a](C[6a]C[6a]C)2(PC[6]HO){1|C<3>,2|H<1>}	O(PC[6a]C[6]H)	122.7435	1.268	2	122.7435	1.607	2	117.4748	37.568	4	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:1:1:	3:3:4:	4:	C[6a]-3:C[6]-4:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6]HO)	O(PC[6a]C[6]H)	P(C[6a]C[6a]2)(C[6]C[6]2H)(H)(O)	C[6a](C[6a]C[6a]H)2(PC[6]HO){1|C<3>,2|H<1>}	O(PC[6a]C[6]H)	112.2060	0.238	2	112.2060	0.056	2	117.4748	37.568	4	110.2060	13.341	33	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CCHH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	110.5890	1.005	4	110.5890	1.011	4	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	113.5920	1.392	2	113.5920	1.937	2	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]CO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]CO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	113.6040	0.000	2	113.6040	0.000	2	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]CO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]CO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	111.3490	0.000	1	111.3490	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]C)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]C)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	118.2515	0.269	2	118.2515	0.073	2	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	110.8210	0.000	1	110.8210	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HH)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	112.6947	0.441	3	112.6947	0.194	3	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	109.1050	0.000	1	109.1050	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HN)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HN)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	113.3130	0.000	1	113.3130	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CH3)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CH3)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	110.1400	0.000	1	110.1400	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CHHN)(OCo)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CHHN)(OCo)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	109.7630	0.000	1	109.7630	0.000	1	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CN[6]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CN[6]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	113.5885	0.846	4	113.5885	0.716	4	112.6165	5.777	23	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:2:1:	3:3:4:	4:	C[6a]-3:C[6]-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6]OO)	O(PC[6a]C[6]O)	P(C[6a]C[6a]2)(C[6]C[6]2H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6]OO){1|C<3>,2|H<1>}	O(PC[6a]C[6]O)	110.6920	0.000	1	110.6920	0.000	1	110.6920	0.000	1	112.5363	5.680	24	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	111.4580	0.000	1	111.4580	0.000	1	111.7296	0.677	10	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCHH)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	112.8680	0.000	1	112.8680	0.000	1	111.7296	0.677	10	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	111.6213	0.813	8	111.6213	0.662	8	111.7296	0.677	10	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(NCH)(O)	C[6a](C[6a]C[6a]H)2(PCNO)	O(PC[6a]CN)	P(C[6a]C[6a]2)(CC3)(NCH)(O)	C[6a](C[6a]C[6a]H)2(PCNO){1|C<3>,2|H<1>}	O(PC[6a]CN)	109.0915	0.132	2	109.0915	0.017	2	110.4270	3.561	4	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(NHH)(O)	C[6a](C[6a]C[6a]H)2(PCNO)	O(PC[6a]CN)	P(C[6a]C[6a]2)(CC3)(NHH)(O)	C[6a](C[6a]C[6a]H)2(PCNO){1|C<3>,2|H<1>}	O(PC[6a]CN)	110.4340	0.000	1	110.4340	0.000	1	110.4270	3.561	4	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C-4:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)(NHS)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PCNO)	O(PC[6a]CN)	P(C[6a]C[6a]2)(CC3)(NHS)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PCNO){1|C<3>,2|H<1>}	O(PC[6a]CN)	113.0910	0.000	1	113.0910	0.000	1	110.4270	3.561	4	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	O(PC[6a]C[6]C)	112.8405	0.276	2	112.8405	0.076	2	112.8405	0.076	2	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C[6]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]O[6]2H)(C[6]C[6]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]2)(C[6]O[6]2H)(C[6]C[6]2)(O)	C[6a](C[6a]C[6a]H)2(PC[6]2O){1|C<3>,2|H<1>}	O(PC[6a]C[6]2)	113.2040	0.000	1	113.2040	0.000	1	113.2040	0.000	1	111.6405	1.759	17	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:B-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(BH3)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PBCO)	O(PC[6a]BC)	P(C[6a]C[6a]2)(BH3)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PBCO){1|C<3>,2|H<1>}	O(PC[6a]BC)	106.2520	0.000	1	106.2520	0.000	1	106.2520	0.000	1	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(CC3)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a,6a]C[6a])(CC3)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PCCO){2|H<1>,3|C<3>}	O(PC[6a]CC)	113.1270	0.000	1	113.1270	0.000	1	111.7680	4.637	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO){1|As<1>,1|H<1>,3|C<3>}	O(PC[6a]CC)	111.8960	3.062	2	111.5739	5.058	7	111.7680	4.637	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO){1|As<2>,1|H<1>,3|C<3>}	O(PC[6a]CC)	111.1425	2.507	4	111.5739	5.058	7	111.7680	4.637	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a,6a]C[6a])(CCCH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PCCO){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]CC)	112.6550	0.000	1	111.5739	5.058	7	111.7680	4.637	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC3)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PCCO){1|H<1>,4|C<3>}	O(PC[6a]CC)	112.1350	0.000	1	112.1350	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC3)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]I)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC3)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]I)(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	112.4770	0.000	1	112.4770	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCCH)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCCH)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	111.4080	0.000	1	111.4080	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a,6a]Pd)(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a,6a]Pd)(C[6a]C[6a]H)(PCCO){1|H<1>,2|C<3>}	O(PC[6a]CC)	114.0780	0.000	1	114.0780	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a]F)(C[6a]C[6a]O)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a]F)(C[6a]C[6a]O)(PCCO){1|C<3>,1|F<1>,1|O<2>}	O(PC[6a]CC)	110.7930	0.000	1	110.7930	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a]N[5a])(C[6a]C[6a]H)(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCCH)2(O)	C[6a](C[6a]C[6a]N[5a])(C[6a]C[6a]H)(PCCO){2|H<1>,3|C<3>}	O(PC[6a]CC)	114.4890	0.000	1	114.4890	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<2>,1|C<3>,1|H<1>}	O(PC[6a]CC)	111.9210	0.000	1	112.5700	0.842	2	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.2190	0.000	1	112.5700	0.842	2	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CCHS)(CH3)(O)	C[6a](C[6a]C[6a]C)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CCHS)(CH3)(O)	C[6a](C[6a]C[6a]C)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	114.8310	0.000	1	114.8310	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(CCHH)(O)	C[6a](C[6a]C[6a]C)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC[6a]HH)(CCHH)(O)	C[6a](C[6a]C[6a]C)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.1930	0.000	1	113.1930	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]HO)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CC[6a]HO)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	110.7850	1.223	2	110.7850	1.496	2	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CClHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CClHH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.7720	0.000	1	113.7720	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CH3)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CH3)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	111.3060	0.000	1	111.3060	0.000	1	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CHHS)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	O(PC[6a]CC)	P(C[6a]C[6a]2)(CHHS)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(PC[6a]CC)	113.7025	0.086	2	113.7025	0.007	2	112.6623	2.024	16	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC3)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	O(PC[6a]C[6]C)	109.6440	0.000	1	109.6440	0.000	1	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCHH)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCHH)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]CO){2|H<1>,3|C<3>}	O(PC[6a]C[6]C)	111.0500	0.000	1	111.0500	0.000	1	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCHO)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	O(PC[6a]C[6]C)	112.0030	0.000	1	112.0030	0.000	1	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC[6a]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC[6a]CH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	O(PC[6a]C[6]C)	112.6110	0.000	1	112.6110	0.000	1	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC[6a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CC[6a]HH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	O(PC[6a]C[6]C)	112.3140	0.000	1	112.3140	0.000	1	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CHHO)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]CO)	O(PC[6a]C[6]C)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CHHO)(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]CO){2|H<1>,3|C<3>}	O(PC[6a]C[6]C)	113.2780	0.503	3	113.2780	0.253	3	112.1820	1.724	8	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C[6]-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]2O){2|O<2>,3|C<3>}	O(PC[6a]C[6]2)	110.4295	3.108	2	110.4295	9.658	2	110.2563	7.415	6	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C[6]-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]H)(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]Br)(C[6a]C[6a]H)(PC[6]2O){1|N<2>,2|O<2>}	O(PC[6a]C[6]2)	108.3670	1.015	2	108.3670	1.031	2	110.2563	7.415	6	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C[6]-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6]2O){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]C[6]2)	114.5510	0.000	1	114.5510	0.000	1	110.2563	7.415	6	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:4:4:1:	3:3:4:	4:	C[6a]-3:C[6]-4:C[6]-4:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6]2O)	O(PC[6a]C[6]2)	P(C[6a]C[6a]2)(C[6]C[6]2H)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6]2O){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]C[6]2)	109.3940	0.000	1	109.3940	0.000	1	110.2563	7.415	6	111.8458	4.474	39	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	3:5:2:1:	3:3:4:	4:	C[6a]-3:C-5:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)	112.6190	0.000	1	112.6190	0.000	1	112.6190	0.000	1	112.6190	0.000	1	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:2:1:	3:3:4:	4:	C[5]-4:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5]C[5,6a]2H)(C[6a]C[6a]2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[5]OO)	O(PC[6a]C[5]O)	P(C[5]C[5,6a]2H)(C[6a]C[6a]2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[5]OO){1|C<3>,2|H<1>}	O(PC[6a]C[5]O)	110.5950	0.000	1	110.5950	0.000	1	110.7140	0.028	2	110.7140	0.028	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:2:1:	3:3:4:	4:	C[5]-4:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(OC[5])(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[5]OO)	O(PC[6a]C[5]O)	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(OC[5])(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[5]OO){1|H<1>,2|C<3>}	O(PC[6a]C[5]O)	110.8330	0.000	1	110.8330	0.000	1	110.7140	0.028	2	110.7140	0.028	2	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	3:3:4:	4:	C-4:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(CC[6a]C[3]C)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(CC[6a]C[3]C)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	111.1405	0.093	2	111.1405	0.009	2	111.8161	0.933	8	111.8161	0.933	8	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	3:3:4:	4:	C-4:C[6a]-3:C[6a]-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(CC[6a]N[5]H)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)	P(CC[6a]N[5]H)(C[6a]C[6a]2)2(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)	112.0413	1.030	6	112.0413	1.061	6	111.8161	0.933	8	111.8161	0.933	8	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[3,5]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[3,5]C[3,5]C[3]C[5])(C[6a]C[6a]2)2(O)	C[6a](PC[3,5]C[6a]O)(C[6a]C[6a]H)2	O(PC[3,5]C[6a]2)	P(C[3,5]C[3,5]C[3]C[5])(C[6a]C[6a]2)2(O)	C[6a](PC[3,5]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[3,5]C[6a]2)	111.5205	1.821	2	111.5205	3.315	2	111.5205	3.315	2	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[4]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[4]C[4]2Co)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2	O(PC[6a]2C[4])	P(C[4]C[4]2Co)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[4]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[4])	112.4907	0.285	4	112.4907	0.081	4	112.4907	0.081	4	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[5]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5,6a]C[5]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	112.1485	0.675	4	112.1485	0.455	4	111.9112	2.705	42	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[5]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]2Fe)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5]2Fe)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	111.8970	1.765	36	111.8970	3.115	36	111.9112	2.705	42	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[5]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[5]C[5]N[5]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])	P(C[5]C[5]N[5]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])	111.6910	0.403	2	111.6910	0.162	2	111.9112	2.705	42	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[5,6]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[5,6]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	112.3890	1.080	2	112.3890	1.167	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6,6]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6,6]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	110.2225	0.967	2	110.2225	0.934	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6,6a]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6,6a]C[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.5035	0.812	2	111.5035	0.660	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6]2Cr)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6]2Cr)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	112.9550	0.321	2	112.9550	0.103	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6]2Rh)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6]2Rh)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.2610	0.069	2	111.2610	0.005	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	863	0:SP3_SP2_SP2	P	C[6a]	O	4:3:3:1:	4:3:3:	4:	C[6]-4:C[6a]-3:C[6a]-3:O-1:	P-4:C[6a]-3:C[6a]-3:	P-4:	P(C[6]C[6]N[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2	O(PC[6a]2C[6])	P(C[6]C[6]N[6]H)(C[6a]C[6a]2)2(O)	C[6a](PC[6a]C[6]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[6])	111.9970	0.923	2	111.9970	0.853	2	111.7213	1.166	12	111.8988	2.192	60	111.7171	3.947	2279	111.7171	3.947	2279
992	643	880	0:SP3_SP2_SP3	P	C[6a]	Si	3:4:4:1:	3:3:4:	4:4:4:4:	C[6a]-3:B-4:Si-4:H-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-4:C-4:	P(C[6a]C[6a]2)(BC[6a]3)(SiC3)(H)	C[6a](C[6a]C[6a]H)2(PSiBH)	Si(PC[6a]BH)(CCHH)3	P(C[6a]C[6a]2)(BC[6a]3)(SiC3)(H)	C[6a](C[6a]C[6a]H)2(PSiBH){1|C<3>,2|H<1>}	Si(PC[6a]BH)(CCHH)3	105.1250	0.000	1	105.1250	0.000	1	105.1250	0.000	1	105.1250	0.000	1	105.1250	0.000	1	105.1250	0.000	1
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(C[6a]C[6a]2)(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OO)	103.4760	0.000	1	103.4760	0.000	1	103.4760	0.000	1	103.7368	0.473	4	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:1:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(O)(S)	C[6a](C[6a]C[6a]H)2(POOS)	O(C[6a]C[6a]2)(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6a])(O)(S)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OS)	103.8237	0.815	3	103.8237	0.665	3	103.8237	0.665	3	103.7368	0.473	4	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C-3:P-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(CC[6a]C[4])(PC[6a]OO)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(CC[6a]C[4])(PC[6a]OO)	102.4040	0.318	3	102.4040	0.101	3	102.4040	0.101	3	102.7873	3.397	65	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(C[6a]C[6a]2)(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OO)	106.2210	0.000	1	106.2210	0.000	1	102.8986	3.401	60	102.7873	3.397	65	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3)	O(C[6a]C[6a]2)(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OO)	110.4360	0.000	1	110.4360	0.000	1	102.8986	3.401	60	102.7873	3.397	65	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(C[6a]C[6a]2)(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6a])2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OO)	102.7113	1.515	58	102.7113	2.294	58	102.8986	3.401	60	102.7873	3.397	65	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	3:4:	C[6a]-3:O-2:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])2(S)	C[6a](C[6a]C[6a]H)2(POOS)	O(C[6a]C[6a]2)(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6a])2(S)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]OS)	100.0242	0.363	2	100.0242	0.132	2	100.0242	0.132	2	102.7873	3.397	65	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:2:1:	3:3:4:	4:3:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(CC[4]H)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CC[4]H)	106.6475	0.811	2	106.6475	0.658	2	106.6475	0.658	2	106.6475	0.658	2	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:3:1:	3:3:4:	3:4:	C[6a]-3:O-2:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6a]C[6a]2)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]CO)	104.8580	0.000	1	104.8580	0.000	1	104.8580	0.000	1	104.7940	0.008	2	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:3:1:	3:3:4:	3:4:	C[6a]-3:O-2:N-3:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(NCH)(S)	C[6a](C[6a]C[6a]H)2(PNOS)	O(C[6a]C[6a]2)(PC[6a]NS)	P(C[6a]C[6a]2)(OC[6a])(NCH)(S)	C[6a](C[6a]C[6a]H)2(PNOS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]NS)	104.7300	0.000	1	104.7300	0.000	1	104.7300	0.000	1	104.7940	0.008	2	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:2:4:1:	3:3:4:	3:4:	C[6a]-3:O-2:B-4:H-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(OC[6a])(BH3)(H)	C[6a](C[6a]C[6a]H)2(PBHO)	O(C[6a]C[6a]2)(PC[6a]BH)	P(C[6a]C[6a]2)(OC[6a])(BH3)(H)	C[6a](C[6a]C[6a]H)2(PBHO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]BH)	109.9080	0.000	1	109.9080	0.000	1	109.9080	0.000	1	109.9080	0.000	1	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(C[6a]C[6a]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2O)	97.4759	0.000	1	97.4759	0.000	1	102.3018	10.181	26	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6a]C[5a,6a]C[6a])(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[5a,6a]C[6a])(PC[6a]2O)	102.0576	3.806	2	102.0576	14.487	2	102.3018	10.181	26	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6a]C[6,6a]C[6a])(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[6,6a]C[6a])(PC[6a]2O)	102.8295	3.843	2	102.8295	14.770	2	102.3018	10.181	26	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6a]C[6a]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2O)	102.5046	3.166	21	102.5046	10.022	21	102.3018	10.181	26	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	Ge[6]-3:P-4:	P(C[6a]C[6a]2)2(OGe[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(Ge[6]N[6]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(OGe[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(Ge[6]N[6]2)(PC[6a]2O)	105.5280	1.631	2	105.5280	2.659	2	105.5280	2.659	2	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(C[6a]C[6a]2)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC[6a])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2S)	101.1833	3.316	10	101.1833	10.994	10	101.1833	10.994	10	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	Ge[6]-3:P-4:	P(C[6a]C[6a]2)2(OGe[6])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(Ge[6]N[6]2)(PC[6a]2S)	P(C[6a]C[6a]2)2(OGe[6])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(Ge[6]N[6]2)(PC[6a]2S)	104.5885	0.022	2	104.5885	0.000	2	104.5885	0.000	2	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO)	O(C[6a]C[6a]2)(PC[6a]2Se)	P(C[6a]C[6a]2)2(OC[6a])(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2Se)	100.5894	3.003	6	100.5894	9.020	6	100.5894	9.020	6	102.0750	10.228	46	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:2:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-2:	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(NC)	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(NC)	102.2140	5.822	2	102.2140	33.900	2	102.2140	33.900	2	102.2140	33.900	2	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:3:	C[6a]-3:C[6a]-3:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:	P(C[6a]C[6a]2)2(OC)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO)	O(PC[6a]2Se)(CCO)	P(C[6a]C[6a]2)2(OC)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO){1|C<3>,2|H<1>}	O(PC[6a]2Se)(CCO)	100.4301	4.399	2	100.4301	19.355	2	101.0515	14.574	4	101.0515	14.574	4	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:1:	3:3:4:	4:3:	C[6a]-3:C[6a]-3:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:	P(C[6a]C[6a]2)2(OC)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO)	O(PC[6a]2Se)(CC[6a]O)	P(C[6a]C[6a]2)2(OC)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeO){1|C<3>,2|H<1>}	O(PC[6a]2Se)(CC[6a]O)	101.6730	4.777	2	101.6730	22.822	2	101.0515	14.574	4	101.0515	14.574	4	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(ONi)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6a]C[6a]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(ONi)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2O)	102.9275	3.637	2	102.9275	13.225	2	104.0088	11.630	6	104.3579	9.153	18	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(OSn)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6a]C[6a]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6a])(OSn)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2O)	104.5495	3.716	4	104.5495	13.805	4	104.0088	11.630	6	104.3579	9.153	18	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:S-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(SPd)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(C[6a]C[6a]2)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC[6a])(SPd)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2S)	104.3301	2.777	8	104.3301	7.711	8	104.5324	8.760	12	104.3579	9.153	18	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:S-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(SPt)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(C[6a]C[6a]2)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC[6a])(SPt)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2S)	104.9370	3.715	4	104.9370	13.798	4	104.5324	8.760	12	104.3579	9.153	18	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:2:4:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:B-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(OC[6a])(BH3)	C[6a](C[6a]C[6a]H)2(PC[6a]BO)	O(C[6a]C[6a]2)(PC[6a]2B)	P(C[6a]C[6a]2)2(OC[6a])(BH3)	C[6a](C[6a]C[6a]H)2(PC[6a]BO){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]2B)	105.2480	2.203	2	105.2480	4.855	2	105.2480	4.855	2	105.2480	4.855	2	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	B[6a]-3:P-4:	P(C[6a]C[6a]2)3(OB[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(B[6a]C[6a]N[6a])(PC[6a]3)	P(C[6a]C[6a]2)3(OB[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(B[6a]C[6a]N[6a])(PC[6a]3)	108.6027	3.196	3	108.6027	10.212	3	108.6027	10.212	3	109.6249	26.690	9	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(OC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(OC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(C[6a]C[6a]2)(PC[6a]3)	112.5033	6.031	3	112.5033	36.378	3	110.1360	37.678	6	109.6249	26.690	9	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(OC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(C[6a]C[6a]N[6a])(PC[6a]3)	P(C[6a]C[6a]2)3(OC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(C[6a]C[6a]N[6a])(PC[6a]3)	107.7687	6.404	3	107.7687	41.005	3	110.1360	37.678	6	109.6249	26.690	9	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP2	P	C[6a]	O	3:4:3:2:	3:3:4:	4:3:	C[6a]-3:B-4:N-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:	P(C[6a]C[6a]2)(BH3)(NCH)(OC)	C[6a](C[6a]C[6a]H)2(PBNO)	O(PC[6a]BN)(CC[6a]C)	P(C[6a]C[6a]2)(BH3)(NCH)(OC)	C[6a](C[6a]C[6a]H)2(PBNO){1|C<3>,2|H<1>}	O(PC[6a]BN)(CC[6a]C)	97.9840	0.000	1	97.9840	0.000	1	97.9840	0.000	1	97.9840	0.000	1	103.2471	11.142	156	103.2471	11.142	156
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]C)2(PHOO)	O(PC[6a]HO)(H)	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]C)2(PHOO){1|C<3>,2|H<1>}	O(PC[6a]HO)(H)	106.2260	0.000	1	106.2260	0.000	1	107.1055	1.547	2	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:H-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]H)2(PHOO)	O(PC[6a]HO)(H)	P(C[6a]C[6a]2)(OH)(H)(O)	C[6a](C[6a]C[6a]H)2(PHOO){1|C<3>,2|H<1>}	O(PC[6a]HO)(H)	107.9850	0.000	1	107.9850	0.000	1	107.1055	1.547	2	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a,6a]C[6a])(OH)(O)2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a,6a]C[6a])(OH)(O)2	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)(H)	105.1147	0.385	3	105.1147	0.148	3	105.1147	0.148	3	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3){1|C<3>,1|C<4>,1|H<1>}	O(PC[6a]OO)(H)	107.5863	0.365	8	107.5863	0.133	8	105.5265	3.703	37	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)(C[6a]N[6a]H)(PO3){1|C<3>,1|H<1>}	O(PC[6a]OO)(H)	107.0800	0.000	1	107.0800	0.000	1	105.5265	3.703	37	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|P<4>}	O(PC[6a]OO)(H)	106.4200	0.000	1	104.8825	3.126	28	105.5265	3.703	37	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	104.9993	1.559	26	104.8825	3.126	28	105.5265	3.703	37	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|P<4>}	O(PC[6a]OO)(H)	100.3100	0.000	1	104.8825	3.126	28	105.5265	3.703	37	105.5723	3.428	42	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:N-1:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(C[6]C[6]2H)(PC[6a]NO)	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]NO)	104.9490	0.000	1	104.9490	0.000	1	104.9490	0.000	1	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(C[6]C[6]2H)(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6])(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]OO)	99.4441	0.000	1	99.4441	0.000	1	99.4441	0.000	1	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)(OP)(O)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)2	P(C[6a]C[6a]2)(OP)(O)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)2	101.5950	0.082	3	101.5950	0.007	3	101.5950	0.007	3	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)(O)(S)	C[6a](C[6a]C[6a]H)2(POOS)	O(PC[6a]OS)(CCHH)	P(C[6a]C[6a]2)(OC)(O)(S)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(PC[6a]OS)(CCHH)	103.7451	1.060	27	103.7451	1.123	27	103.7451	1.123	27	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:	P(C[6a]C[6a]2)(OC)(S)2	C[6a](C[6a]C[6a]H)2(POSS)	O(CC[6a]CH)(PC[6a]SS)	P(C[6a]C[6a]2)(OC)(S)2	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(CC[6a]CH)(PC[6a]SS)	97.8254	0.000	1	97.8254	0.000	1	97.8254	0.000	1	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(S)2	C[6a](C[6a]C[6a]H)2(POSS)	O(C[6]C[6]2H)(PC[6a]SS)	P(C[6a]C[6a]2)(OC[6])(S)2	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]SS)	96.6624	0.000	1	96.6624	0.000	1	96.6624	0.000	1	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:1:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-1:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)(S)2	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CH3)	P(C[6a]C[6a]2)(OC)(S)2	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CH3)	103.0270	3.058	2	103.0270	9.348	2	103.0270	9.348	2	103.0789	4.075	36	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	2:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	N[6a]-2:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]N[6a])(OC)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]O)(PO3)	O(PC[6a]OO)(CH3)	P(C[6a]C[6a]N[6a])(OC)2(O)	C[6a](N[6a]C[6a,6a])(C[6a]N[6a]O)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)(CH3)	105.5175	0.213	2	105.5175	0.045	2	105.5175	0.045	2	105.5175	0.045	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:2:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:N[6a]-2:P-4:	P-4:H-1:	P(C[6a]C[6a]N[6a])(OH)2(O)	C[6a](C[6a]N[6a]H)(N[6a]C[6a])(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]N[6a])(OH)2(O)	C[6a](C[6a]N[6a]H)(N[6a]C[6a])(PO3){1|C<3>,1|H<1>}	O(PC[6a]OO)(H)	106.5645	1.493	2	106.5645	2.228	2	106.5645	2.228	2	106.5645	2.228	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:2:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[5a,6a]-3:N[6a]-2:P-4:	P-4:C-4:	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	O(PC[6a]OO)(CCHH)	105.1405	2.854	4	104.6780	12.611	6	104.6780	12.611	6	104.6780	12.611	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:2:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[5a,6a]-3:N[6a]-2:P-4:	P-4:C-4:	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[5a,6a]N[6a])(OC)2(O)	C[6a](C[5a,6a]C[5a,6a]N[5a])(N[6a]C[6a])(PO3){1|Cl<1>,1|C<3>,1|N<2>,1|N<3>}	O(PC[6a]OO)(CCHH)	103.7531	6.005	2	104.6780	12.611	6	104.6780	12.611	6	104.6780	12.611	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a,6a]C[6a])(OCu)(OH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a,6a]C[6a])(OCu)(OH)(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)(H)	106.3937	0.771	3	106.3937	0.595	3	106.7478	4.076	17	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[5,6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]OO)(H)	108.4440	1.240	2	108.4440	1.538	2	106.7478	4.076	17	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a,6a]C[6a])(OH)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)(H)	106.5537	2.254	12	106.5537	5.083	12	106.7478	4.076	17	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OC[6a])(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	110.0440	0.000	1	110.0440	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OCd)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OCd)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	105.8010	0.000	1	105.8010	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OCu)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OCu)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	106.6880	0.564	2	106.6880	0.318	2	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	108.5361	1.811	8	108.5361	3.278	8	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)(H)	106.6920	0.728	2	106.6920	0.530	2	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]C)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	107.4550	1.814	2	107.4550	3.292	2	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	107.0389	2.041	32	106.8391	4.261	39	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OH)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|P<4>}	O(PC[6a]OO)(H)	105.9256	2.068	7	106.8391	4.261	39	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OMn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OMn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|S<4>}	O(PC[6a]OO)(H)	104.2300	0.000	1	104.2300	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(ONi)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(ONi)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|P<4>}	O(PC[6a]OO)(H)	103.3100	0.000	1	103.3100	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OPd)(OH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OPd)(OH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	106.5920	0.000	1	106.5920	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OSn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OSn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	106.8090	0.175	2	106.8090	0.031	2	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OZn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OZn)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	105.6090	0.000	1	105.6090	0.000	1	106.9818	4.065	61	106.9308	4.024	78	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(CH3)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]OO)(CH3)	107.3975	5.088	2	107.3975	25.884	2	106.8194	9.984	8	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O)(PO3)	O(PC[6a]OO)(CH3)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]O)(PO3){2|H<1>,3|C<3>}	O(PC[6a]OO)(CH3)	109.5010	0.014	2	109.5010	0.000	2	106.8194	9.984	8	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3){1|H<1>,3|C<3>}	O(PC[6a]OO)(CCHH)	105.6225	3.204	2	105.6225	10.265	2	106.8194	9.984	8	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)(CH3)	P(C[6a]C[6a,6a]C[6a])(OC)2(O)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]N[6a]C)(PO3){1|H<1>,1|O<2>,3|C<3>}	O(PC[6a]OO)(CH3)	104.7565	2.705	2	104.7565	7.315	2	106.8194	9.984	8	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[5a,6a]H)(C[6a]C[6a]H)(PO3){1|H<1>,2|C<3>}	O(PC[6a]OO)(CCHH)	105.9878	3.079	4	105.9878	9.483	4	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,4|C<3>}	O(PC[6a]OO)(CCHH)	106.0055	6.136	2	106.0055	37.645	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(CH3)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(PO3){1|H<1>,4|C<3>}	O(PC[6a]OO)(CH3)	103.0920	0.354	2	103.0920	0.125	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]C[6a])(C[6a]O[6a]O)(PO3){4|C<3>}	O(PC[6a]OO)(CCHH)	104.7625	5.847	2	104.7625	34.188	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]C)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]N[6a]C)(PO3){2|C<3>}	O(PC[6a]OO)(CCHH)	105.9885	1.563	2	105.9885	2.444	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CCHH)	105.2390	2.430	2	105.2390	5.903	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PO3){1|C<3>,2|C<4>}	O(PC[6a]OO)(CCHH)	108.9910	2.679	2	108.9910	7.174	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CCHH)	104.2032	3.329	6	104.2032	11.084	6	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CCHH)	105.4024	2.978	13	105.4024	8.871	13	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(CC[4]CH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CC[4]CH)	102.3190	0.000	1	102.3190	0.000	1	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(CC[4]HH)	P(C[6a]C[6a]2)(OC)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CC[4]HH)	102.8210	0.112	2	102.8210	0.012	2	105.1452	9.375	38	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)2	P(C[6a]C[6a]2)(OH)(OP)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)2	104.3170	2.142	9	104.3170	4.590	9	104.6187	4.122	15	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)(OP)2(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)2	P(C[6a]C[6a]2)(OP)2(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)2	105.0713	1.947	6	105.0713	3.789	6	104.6187	4.122	15	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:S-1:	C[6a,6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a,6a]C[6a])(OC)2(S)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(POOS)	O(PC[6a]OS)(CH3)	P(C[6a]C[6a,6a]C[6a])(OC)2(S)	C[6a](C[6a,6a]C[6a,6a]C[6a])(C[6a]C[6a]H)(POOS){1|H<1>,1|P<4>,3|C<3>}	O(PC[6a]OS)(CH3)	101.6700	0.066	2	101.6700	0.004	2	101.6700	0.004	2	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)2(Se)	C[6a](C[6a]C[6a]H)2(PSeOO)	O(PC[6a]SeO)(CCCH)	P(C[6a]C[6a]2)(OC)2(Se)	C[6a](C[6a]C[6a]H)2(PSeOO){1|C<3>,2|H<1>}	O(PC[6a]SeO)(CCCH)	103.6440	4.702	2	103.6440	22.111	2	103.6440	22.111	2	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS)	O(C[6]C[6]2H)(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]OS)	106.3130	0.000	1	106.3130	0.000	1	106.7760	0.429	2	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS)	O(C[6]C[6]2H)(PC[6a]OS)	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]OS)	107.2390	0.000	1	107.2390	0.000	1	106.7760	0.429	2	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)(SP)(S)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CCHH)	P(C[6a]C[6a]2)(OC)(SP)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CCHH)	101.3819	1.536	22	101.3819	2.360	22	101.1447	1.865	32	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC)(SS)(S)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CCHH)	P(C[6a]C[6a]2)(OC)(SS)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CCHH)	100.6230	0.692	10	100.6230	0.479	10	101.1447	1.865	32	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:S-2:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SNi)(OC)(S)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CH3)	P(C[6a]C[6a]2)(SNi)(OC)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CH3)	97.2940	0.028	3	97.2940	0.001	3	98.4327	2.475	5	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:S-2:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SSn)(OC)(S)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CCHH)	P(C[6a]C[6a]2)(SSn)(OC)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CCHH)	100.1406	0.418	2	100.1406	0.175	2	98.4327	2.475	5	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:Se-2:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O)	O(PC[6a]Se2)(CCHH)	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O){1|C<3>,2|H<1>}	O(PC[6a]Se2)(CCHH)	101.4460	2.294	13	101.4460	5.263	13	101.4460	5.263	13	103.3430	10.549	117	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OCd)(OH)2	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OCd)(OH)2	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	106.1960	1.755	2	106.1960	3.080	2	105.8173	1.464	6	105.8173	1.464	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OCu)2(OH)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OCu)2(OH)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|P<4>}	O(PC[6a]OO)(H)	106.9990	0.000	1	106.9990	0.000	1	105.8173	1.464	6	105.8173	1.464	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OMn)2(OH)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OMn)2(OH)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,1|H<1>,1|S<4>}	O(PC[6a]OO)(H)	105.4030	0.990	2	105.4030	0.980	2	105.8173	1.464	6	105.8173	1.464	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:1:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OZn)2(OH)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OZn)2(OH)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	104.7070	0.000	1	104.7070	0.000	1	105.8173	1.464	6	105.8173	1.464	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(ONi)(OC)2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(ONi)(OC)2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CCHH)	105.4680	3.855	2	105.4680	14.862	2	106.8998	8.583	12	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OPd)(OC)2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3)	O(PC[6a]OO)(CCHH)	P(C[6a]C[6a]2)(OPd)(OC)2	C[6a](C[6a]C[6a]H)(C[6a]C[6a]P)(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(CCHH)	105.5378	2.240	4	105.5378	5.018	4	106.8998	8.583	12	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:O-2:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OSn)(OC)2	C[6a](C[6a]C[6a]Sn)(C[6a]C[6a]H)(PO3)	O(PC[6a]OO)(CCCH)	P(C[6a]C[6a]2)(OSn)(OC)2	C[6a](C[6a]C[6a]Sn)(C[6a]C[6a]H)(PO3){1|C<3>,1|C<4>,1|P<4>}	O(PC[6a]OO)(CCCH)	108.2852	2.879	6	108.2852	8.291	6	106.8998	8.583	12	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:S-2:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:	P(C[6a]C[6a]2)(OC[5])(SAu)2	C[6a](C[6a]C[6a]H)2(POSS)	O(C[5]C[5]2H)(PC[6a]SS)	P(C[6a]C[6a]2)(OC[5])(SAu)2	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(C[5]C[5]2H)(PC[6a]SS)	102.8600	0.000	1	102.8600	0.000	1	102.8600	0.000	1	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:S-2:S-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SCo)2(OC)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CCCH)	P(C[6a]C[6a]2)(SCo)2(OC)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CCCH)	98.0118	0.325	3	98.0118	0.105	3	99.0149	4.672	9	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:S-2:S-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SNi)2(OC)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CCHH)	P(C[6a]C[6a]2)(SNi)2(OC)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CCHH)	100.6437	3.473	3	100.6437	12.063	3	99.0149	4.672	9	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:2:2:	3:3:4:	4:4:	C[6a]-3:S-2:S-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SNi)2(OC)	C[6a](C[6a]C[6a]H)2(POSS)	O(PC[6a]SS)(CH3)	P(C[6a]C[6a]2)(SNi)2(OC)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	O(PC[6a]SS)(CH3)	98.3891	0.667	3	98.3891	0.444	3	99.0149	4.672	9	103.4905	21.521	22	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:3:1:	3:3:4:	4:4:	C[6a]-3:O-2:N-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(C[6]C[6]2H)(PC[6a]NO)	P(C[6a]C[6a]2)(OC[6])(NCH)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]NO)	99.1258	0.000	1	99.1258	0.000	1	99.1258	0.000	1	99.1258	0.000	1	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	C[3x6]-4:P-4:	P(C[6a]C[6a]2)(OC[3x6])(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[3x6]C[6,6]3)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[3x6])(CHHO)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[3x6]C[6,6]3)(PC[6a]CO)	106.6580	0.000	1	106.6580	0.000	1	106.6580	0.000	1	105.7375	3.082	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCCH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	105.6560	0.000	1	105.6560	0.000	1	105.5534	3.598	5	105.7375	3.082	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCCO)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	106.6505	0.076	2	106.6505	0.006	2	105.5534	3.598	5	105.7375	3.082	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CCHH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	106.5650	0.000	1	106.5650	0.000	1	105.5534	3.598	5	105.7375	3.082	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:O-2:C-4:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(OC[6])(CH3)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6,6]C[6]H)(PC[6a]CO)	P(C[6a]C[6a]2)(OC[6])(CH3)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6,6]C[6]H)(PC[6a]CO)	102.2450	0.000	1	102.2450	0.000	1	105.5534	3.598	5	105.7375	3.082	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	N[5,6]-3:P-4:	P(C[6a]C[6a]2)2(ON[5,6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(N[5,6]C[5,5,6]C[5,6])(PC[6a]2O)	P(C[6a]C[6a]2)2(ON[5,6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(N[5,6]C[5,5,6]C[5,6])(PC[6a]2O)	102.7108	5.336	2	102.7108	28.473	2	102.7108	28.473	2	102.7108	28.473	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(H)	104.9860	0.000	1	105.0140	6.181	3	105.2692	4.381	4	105.1693	2.778	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|O<2>}	O(PC[6a]2O)(H)	105.0280	3.516	2	105.0140	6.181	3	105.2692	4.381	4	105.1693	2.778	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]OO)	O(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(OH)(O)	C[6a](C[6a]C[6a]Pd)(C[6a]C[6a]H)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(H)	106.0350	0.000	1	106.0350	0.000	1	105.2692	4.381	4	105.1693	2.778	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:1:	C[6a]-3:O-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(OCd2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3)	O(PC[6a]OO)(H)	P(C[6a]C[6a]2)(OCd2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PO3){1|C<3>,2|H<1>}	O(PC[6a]OO)(H)	105.5290	0.000	1	105.5290	0.000	1	105.5290	0.000	1	105.1693	2.778	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:1:	C[6a]-3:Se-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(SeCu2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PSeOO)	O(PC[6a]SeO)(H)	P(C[6a]C[6a]2)(SeCu2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PSeOO){1|C<3>,2|H<1>}	O(PC[6a]SeO)(H)	104.4100	0.000	1	104.4100	0.000	1	104.4100	0.000	1	105.1693	2.778	6	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:3:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(NCC)	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(NCC)	102.7345	6.194	2	102.7345	38.361	2	102.8055	15.092	8	102.8055	15.092	8	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:3:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(NCH)	P(C[6a]C[6a]2)2(ON)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(NCH)	102.8291	3.668	6	102.8291	13.453	6	102.8055	15.092	8	102.8055	15.092	8	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	106.8065	0.005	2	106.8065	0.000	2	106.8065	0.000	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(CCHH)	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCHH)	101.2870	0.000	1	101.2870	0.000	1	101.2870	0.000	1	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:H-1:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[6a]2)2(OB)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]HO)	O(BC[6a]2H)(PC[6a]2H)	P(C[6a]C[6a]2)2(OB)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]HO){1|C<3>,2|H<1>}	O(BC[6a]2H)(PC[6a]2H)	111.3470	0.516	2	111.3470	0.266	2	111.3470	0.266	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[6a]2)2(OB)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(BC[6a]N[6]H)(PC[6a]2O)	P(C[6a]C[6a]2)2(OB)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(BC[6a]N[6]H)(PC[6a]2O)	104.1055	3.352	2	104.1055	11.239	2	104.1055	11.239	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(C[6]C[6,6]C[6]H)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6]C[6,6]C[6]H)(PC[6a]2O)	108.4930	0.000	1	108.4930	0.000	1	104.0224	21.236	6	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6]C[5,6]C[6]H)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6]C[5,6]C[6]H)(PC[6a]2O)	103.4081	5.184	4	103.4081	26.876	4	104.0224	21.236	6	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(C[6]C[6,6]C[6]H)(PC[6a]2O)	P(C[6a]C[6a]2)2(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(C[6]C[6,6]C[6]H)(PC[6a]2O)	102.0090	0.000	1	102.0090	0.000	1	104.0224	21.236	6	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO)	O(PC[6a]2O)(CH3)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(CH3)	103.3356	5.960	2	103.3356	35.522	2	103.2583	10.880	10	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(CCCH)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(CCCH)	103.5930	0.758	2	103.5930	0.575	2	103.2583	10.880	10	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(CCHH)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(CCHH)	102.9469	4.473	4	102.9469	20.007	4	103.2583	10.880	10	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(CC[3]CH)	P(C[6a]C[6a]2)2(OC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(CC[3]CH)	103.4690	1.042	2	103.4690	1.086	2	103.2583	10.880	10	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)2(OP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2Fe)(PC[6a]2O)	P(C[6a]C[6a]2)2(OP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2Fe)(PC[6a]2O)	102.9840	1.773	2	102.9840	3.145	2	102.9840	3.145	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]C)2(PC[6a]OS)	O(CC[5,6]HH)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]C)2(PC[6a]OS){1|C<3>,2|H<1>}	O(CC[5,6]HH)(PC[6a]2S)	101.8585	0.028	2	101.8585	0.001	2	102.0108	3.827	6	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(CC[5,6]HH)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(CC[5,6]HH)(PC[6a]2S)	102.0869	2.521	4	102.0869	6.355	4	102.0108	3.827	6	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:	P(C[6a]C[6a]2)2(OC[5])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(C[5]C[5]2Fe)(PC[6a]2S)	P(C[6a]C[6a]2)2(OC[5])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(C[5]C[5]2Fe)(PC[6a]2S)	101.6476	3.207	4	101.6476	10.287	4	101.6476	10.287	4	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	O(PC[6a]2S)(CCHH)	P(C[6a]C[6a]2)2(OC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	O(PC[6a]2S)(CCHH)	102.4475	3.048	2	102.4475	9.292	2	102.4475	9.292	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(NC[6]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(C[6]C[6]2H)(PC[6a]NO)	P(C[6a]C[6a]2)(NC[6]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]NO)	99.2088	0.000	1	99.2088	0.000	1	101.1179	7.289	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(NC[6a]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(C[6]C[6]2H)(PC[6a]NO)	P(C[6a]C[6a]2)(NC[6a]H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]NO)	103.0270	0.000	1	103.0270	0.000	1	101.1179	7.289	2	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:N-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)(NCC)(OP)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	O(PC[6a]NO)2	P(C[6a]C[6a]2)(NCC)(OP)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	O(PC[6a]NO)2	98.3759	0.000	1	98.3759	0.000	1	98.3759	0.000	1	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:N[6]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:B-4:	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO)	O(PC[6a]N[6]O)(BC[6a]3)	P(C[6a]C[6a]2)(N[6]C[6]2)(OB)(O)	C[6a](C[6a]C[6a]H)2(PN[6]OO){1|C<3>,2|H<1>}	O(PC[6a]N[6]O)(BC[6a]3)	106.4500	0.000	1	106.4500	0.000	1	106.4500	0.000	1	103.3927	12.845	41	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(OCu)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(OCu)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(H)	105.4545	1.288	2	105.4545	1.658	2	105.7062	3.014	4	105.7062	3.014	4	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(OLi)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(OLi)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(H)	105.9580	2.670	2	105.9580	7.129	2	105.7062	3.014	4	105.7062	3.014	4	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:N-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)2(NP)(OP)	C[6a](C[6a]C[6a]H)2(PC[6a]NO)	O(PC[6a]2N)2	P(C[6a]C[6a]2)2(NP)(OP)	C[6a](C[6a]C[6a]H)2(PC[6a]NO){1|C<3>,2|H<1>}	O(PC[6a]2N)2	103.3712	4.965	2	103.3712	24.651	2	103.3712	24.651	2	106.8117	10.300	12	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	B[5]-4:P-4:	P(C[6a]C[6a]2)2(OB[5])(OLi)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(B[5]O[5]2O)(PC[6a]2O)	P(C[6a]C[6a]2)2(OB[5])(OLi)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(B[5]O[5]2O)(PC[6a]2O)	104.7985	3.441	2	104.7985	11.844	2	104.7985	11.844	2	106.8117	10.300	12	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:Ga-4:	P(C[6a]C[6a]2)2(OGa)2	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(PC[6a]2O)(GaCCO)	P(C[6a]C[6a]2)2(OGa)2	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(PC[6a]2O)(GaCCO)	108.1751	2.075	8	108.1751	4.308	8	108.1751	4.308	8	106.8117	10.300	12	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:3:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:O-3:	C[6a]-3:C[6a]-3:P-4:	B[5]-4:P-4:	P(C[6a]C[6a]2)2(OB[5])(OLi2)	C[6a](C[6a]C[6a]H)2(PC[6a]OO)	O(B[5]O[5]2O)(PC[6a]2O)	P(C[6a]C[6a]2)2(OB[5])(OLi2)	C[6a](C[6a]C[6a]H)2(PC[6a]OO){1|C<3>,2|H<1>}	O(B[5]O[5]2O)(PC[6a]2O)	105.2660	2.531	2	105.2660	6.408	2	105.2660	6.408	2	105.2660	6.408	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:4:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:B-4:	C[5a,6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)(OC[6])(BH3)	C[6a](C[5a,6a]C[5a,6a]O[5a])(C[6a]C[6a]H)(PC[6a]BO)	O(C[6]C[6]2H)(PC[6a]2B)	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)(OC[6])(BH3)	C[6a](C[5a,6a]C[5a,6a]O[5a])(C[6a]C[6a]H)(PC[6a]BO){1|H<1>,3|C<3>}	O(C[6]C[6]2H)(PC[6a]2B)	101.1393	2.994	6	101.1393	8.964	6	101.1393	8.964	6	103.8465	12.932	17	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:4:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:B-4:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)(OC[6])(BH3)	C[6a](C[6a]C[6a]H)2(PC[6a]BO)	O(C[6]C[6]2H)(PC[6a]2B)	P(C[6a]C[5a,6a]C[6a])(C[6a]C[6a]2)(OC[6])(BH3)	C[6a](C[6a]C[6a]H)2(PC[6a]BO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]2B)	104.2290	1.599	7	104.2290	2.557	7	104.2290	2.557	7	103.8465	12.932	17	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:2:4:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:O-2:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)2(OC[6])(CH3)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(C[6]C[6]2H)(PC[6a]2C)	P(C[6a]C[6a]2)2(OC[6])(CH3)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]2C)	107.2380	4.310	4	107.2380	18.580	4	107.2380	18.580	4	103.8465	12.932	17	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)3(OH)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O)	O(PC[6a]3)(H)	P(C[6a]C[6a]2)3(OH)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]N)(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)(H)	115.7110	0.000	1	115.7110	0.000	1	110.1107	23.539	3	108.0165	33.235	4	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)3(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)(H)	P(C[6a]C[6a]2)3(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)(H)	107.3105	0.182	2	107.3105	0.033	2	110.1107	23.539	3	108.0165	33.235	4	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:1:	C[6a]-3:Se-3:Se-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(SeCu2)2(OH)	C[6a](C[6a]C[6a]H)2(PSe2O)	O(PC[6a]Se2)(H)	P(C[6a]C[6a]2)(SeCu2)2(OH)	C[6a](C[6a]C[6a]H)2(PSe2O){1|C<3>,2|H<1>}	O(PC[6a]Se2)(H)	101.7340	0.000	1	101.7340	0.000	1	101.7340	0.000	1	108.0165	33.235	4	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:S-4:	P(C[6a]C[6a]2)2(CPP)(OS)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)(SCOO)	P(C[6a]C[6a]2)2(CPP)(OS)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)(SCOO)	107.2145	2.109	2	107.2145	4.449	2	107.2145	4.449	2	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[4,6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(OB)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2O)	O(BC[6a]2O)(PC[6a]3)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(OB)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2O){1|H<1>,3|C<3>}	O(BC[6a]2O)(PC[6a]3)	105.4340	0.000	1	105.4340	0.000	1	105.4340	0.000	1	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(OB)	C[6a](C[6a]C[6a]C)2(PC[6a]2O)	O(BC[6a]2O)(PC[6a]3)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(OB)	C[6a](C[6a]C[6a]C)2(PC[6a]2O){1|C<3>,2|H<1>}	O(BC[6a]2O)(PC[6a]3)	109.5355	3.484	2	109.5355	12.138	2	109.6174	3.054	5	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[6a]2)3(OB)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(BC[6a]3)(PC[6a]3)	P(C[6a]C[6a]2)3(OB)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(BC[6a]3)(PC[6a]3)	109.6720	0.166	3	109.6720	0.028	3	109.6174	3.054	5	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:	P(C[6a]C[6a]2)3(OC[5])	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(C[5]C[5,5]C[5]H)(PC[6a]3)	P(C[6a]C[6a]2)3(OC[5])	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(C[5]C[5,5]C[5]H)(PC[6a]3)	107.9433	4.598	6	107.9433	21.139	6	107.9433	21.139	6	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)3(OC)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)(CCHH)	P(C[6a]C[6a]2)3(OC)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)(CCHH)	108.0495	3.210	12	108.0495	10.303	12	108.0495	10.303	12	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:Si-4:	P(C[6a]C[6a]2)3(OSi)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)(SiC3)	P(C[6a]C[6a]2)3(OSi)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)(SiC3)	108.8623	2.975	3	108.8623	8.848	3	108.8623	8.848	3	108.2342	9.820	29	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	3:3:4:	4:6:	C[6a]-3:C[6a]-3:C[6a]-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:Si-6:	P(C[6a]C[6a]2)3(OSi)	C[6a](C[6a]C[6a]H)2(PC[6a]2O)	O(PC[6a]3)(SiF4O)	P(C[6a]C[6a]2)3(OSi)	C[6a](C[6a]C[6a]H)2(PC[6a]2O){1|C<3>,2|H<1>}	O(PC[6a]3)(SiF4O)	110.9413	3.811	9	110.9413	14.523	9	110.9413	14.523	9	110.9413	14.523	9	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:3:2:	4:3:3:	4:4:	C[5a]-3:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	B-4:P-4:	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2	O(BC[5a]C[6a]2)(PC[5a]C[6a]2)	P(C[5a]C[5a]2)(C[6a]C[6a]2)2(OB)	C[6a](PC[5a]C[6a]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(BC[5a]C[6a]2)(PC[5a]C[6a]2)	111.7248	4.566	10	111.7248	20.848	10	111.7248	20.848	10	111.7248	20.848	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:4:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C-4:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(CCHH)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CCHH)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)(H)	108.6447	3.409	6	108.6447	11.622	6	109.1599	9.905	10	109.1599	9.905	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:4:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C-4:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)2(CHHP)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	O(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CHHP)(OH)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	O(PC[6a]2C)(H)	109.9327	3.003	4	109.9327	9.018	4	109.1599	9.905	10	109.1599	9.905	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:4:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C-4:O-2:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[6a]2)2(CCHH)(OB)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	O(BC[6a]2C)(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(OB)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	O(BC[6a]2C)(PC[6a]2C)	110.7665	2.242	2	110.7665	5.028	2	110.7665	5.028	2	110.7665	5.028	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:3:4:2:	4:3:3:	4:1:	C[6a]-3:C[6a]-3:C[5]-4:O-2:	P-4:C[6a]-3:C[6a]-3:	P-4:H-1:	P(C[6a]C[6a]2)2(C[5]C[5]2H)(OH)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])(H)	P(C[6a]C[6a]2)2(C[5]C[5]2H)(OH)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])(H)	112.3765	0.350	2	112.3765	0.123	2	112.3765	0.123	2	112.3765	0.123	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:1:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(CCHH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(H)	P(C[6a]C[6a]2)(CCHH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(H)	105.6787	2.631	4	105.6787	6.920	4	106.4934	3.322	10	106.4934	3.322	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:1:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(CC[6a]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(H)	P(C[6a]C[6a]2)(CC[6a]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(H)	106.1540	0.000	1	106.1540	0.000	1	106.4934	3.322	10	106.4934	3.322	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:1:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(CH3)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(H)	P(C[6a]C[6a]2)(CH3)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(H)	106.9120	0.000	1	106.9120	0.000	1	106.4934	3.322	10	106.4934	3.322	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:1:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(CN[6]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(H)	P(C[6a]C[6a]2)(CN[6]HH)(OH)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(H)	107.2883	1.105	4	107.2883	1.222	4	106.4934	3.322	10	106.4934	3.322	10	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(CC[6a]CO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]CO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	107.2780	0.000	1	107.2780	0.000	1	105.6510	1.257	5	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HH)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	104.9330	0.528	3	104.9330	0.279	3	105.6510	1.257	5	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(CC[6a]HN)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]HN)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	106.1780	0.000	1	106.1780	0.000	1	105.6510	1.257	5	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(CCHH)	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCHH)	101.9680	0.000	1	101.9680	0.000	1	104.4664	5.208	7	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(CCHP)	P(C[6a]C[6a]2)(CCHO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCHP)	100.6420	0.000	1	100.6420	0.000	1	104.4664	5.208	7	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CC[6a]CO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(CCHH)	P(C[6a]C[6a]2)(CC[6a]CO)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCHH)	105.5790	0.000	2	105.5790	0.000	2	104.4664	5.208	7	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]C)2(PCOO)	O(PC[6a]CO)(CCHH)	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]C)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCHH)	106.4485	0.163	2	106.4485	0.027	2	104.4664	5.208	7	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(PC[6a]CO)(CCCH)	P(C[6a]C[6a]2)(CC[6a]HH)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(PC[6a]CO)(CCCH)	104.6000	0.000	1	104.6000	0.000	1	104.4664	5.208	7	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C[6]-4:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6]-4:	P(C[6a]C[6a]2)(C[6]C[6]2H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6]OO)	O(PC[6a]C[6]O)(C[6]C[6]2H)	P(C[6a]C[6a]2)(C[6]C[6]2H)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PC[6]OO){1|C<3>,2|H<1>}	O(PC[6a]C[6]O)(C[6]C[6]2H)	105.3840	0.000	1	105.3840	0.000	1	105.3840	0.000	1	104.9926	3.378	13	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:4:2:	3:3:4:	4:1:	C[6a]-3:C[6]-4:B-4:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[6a]C[6a]2)(C[6]C[6]2H)(BH3)(OH)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]BO)	O(PC[6a]C[6]B)(H)	P(C[6a]C[6a]2)(C[6]C[6]2H)(BH3)(OH)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]BO){2|H<1>,3|C<3>}	O(PC[6a]C[6]B)(H)	104.6850	0.000	1	104.6850	0.000	1	104.6850	0.000	1	104.6850	0.000	1	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:4:2:	3:3:4:	4:3:	C[6a]-3:C[6]-4:B-4:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:S-3:	P(C[6a]C[6a]2)(C[6]C[6]2H)(BH3)(OS)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]BO)	O(PC[6a]C[6]B)(SOO)	P(C[6a]C[6a]2)(C[6]C[6]2H)(BH3)(OS)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]BO){2|H<1>,3|C<3>}	O(PC[6a]C[6]B)(SOO)	105.7385	0.747	2	105.7385	0.559	2	105.7385	0.559	2	105.7385	0.559	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:4:4:2:	3:3:4:	4:4:	C[6a]-3:C-4:C-4:O-2:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:	P(C[6a]C[6a]2)(CC3)2(OB)	C[6a](C[6a]C[6a]H)2(PCCO)	O(BC[6a]2H)(PC[6a]CC)	P(C[6a]C[6a]2)(CC3)2(OB)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	O(BC[6a]2H)(PC[6a]CC)	107.2125	5.153	2	107.2125	26.550	2	107.2125	26.550	2	107.2125	26.550	2	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	3:5:2:1:	3:3:4:	4:4:	C[6a]-3:C-5:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	O(C[6]C[6]2H)(PC[6a]CO)	P(C[6a]C[6a]2)(CC[6a]CHO)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	O(C[6]C[6]2H)(PC[6a]CO)	108.0590	0.000	1	108.0590	0.000	1	108.0590	0.000	1	108.0590	0.000	1	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	4:3:2:1:	3:3:4:	4:1:	C[5]-4:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:H-1:	P(C[5]C[5,6a]2H)(C[6a]C[6a]2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[5]OO)	O(PC[6a]C[5]O)(H)	P(C[5]C[5,6a]2H)(C[6a]C[6a]2)(OH)(O)	C[6a](C[6a]C[6a]H)2(PC[5]OO){1|C<3>,2|H<1>}	O(PC[6a]C[5]O)(H)	108.2380	0.000	1	108.2380	0.000	1	108.2380	0.000	1	108.2380	0.000	1	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	4:3:2:1:	3:3:4:	4:4:	C[5]-4:C[6a]-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(OC[5])(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[5]OO)	O(C[5]C[5]2Fe)(PC[6a]C[5]O)	P(C[5]C[5]2Fe)(C[6a]C[6a]2)(OC[5])(O)	C[6a](C[6a]C[6a,6a]H)(C[6a]C[6a]O)(PC[5]OO){1|H<1>,2|C<3>}	O(C[5]C[5]2Fe)(PC[6a]C[5]O)	107.0360	0.000	1	107.0360	0.000	1	107.0360	0.000	1	107.0360	0.000	1	105.2673	13.466	509	105.2673	13.466	509
992	643	893	0:SP3_SP2_SP3	P	C[6a]	O	4:3:3:2:	4:3:3:	4:1:	C[5]-4:C[6a]-3:C[6a]-3:O-2:	P-4:C[6a]-3:C[6a]-3:	P-4:H-1:	P(C[5]C[5]2Fe)(C[6a]C[6a]2)2(OH)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2	O(PC[6a]2C[5])(H)	P(C[5]C[5]2Fe)(C[6a]C[6a]2)2(OH)	C[6a](PC[6a]C[5]O)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	O(PC[6a]2C[5])(H)	110.1485	2.874	2	110.1485	8.262	2	110.1485	8.262	2	110.1485	8.262	2	105.2673	13.466	509	105.2673	13.466	509
992	643	901	0:SP3_SP1_SP2	P	C[6a]	N	3:2:1:1:	3:3:4:	4:	C[6a]-3:O-2:N-1:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO)	N(PC[6a]OO)	P(C[6a]C[6a]2)(OC[6])(N)(O)	C[6a](C[6a]C[6a]H)2(PNOO){1|C<3>,2|H<1>}	N(PC[6a]OO)	112.0680	0.000	1	112.0680	0.000	1	112.0680	0.000	1	112.0680	0.000	1	112.0680	0.000	1	112.0680	0.000	1
992	643	909	0:SP3_SP2_SP2	P	C[6a]	S	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(SC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	S(C[6a]C[6a]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(SC[6a])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	S(C[6a]C[6a]2)(PC[6a]2O)	103.1493	4.299	4	103.1493	18.481	4	103.1493	18.481	4	102.3575	30.722	6	105.7282	41.968	10	105.7282	41.968	10
992	643	909	0:SP3_SP2_SP2	P	C[6a]	S	3:3:2:1:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-3:P-4:	P(C[6a]C[6a]2)2(SC[5])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS)	S(C[5]C[5]2)(PC[6a]2S)	P(C[6a]C[6a]2)2(SC[5])(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS){1|C<3>,2|H<1>}	S(C[5]C[5]2)(PC[6a]2S)	100.7738	9.521	2	100.7738	90.645	2	100.7738	90.645	2	102.3575	30.722	6	105.7282	41.968	10	105.7282	41.968	10
992	643	909	0:SP3_SP2_SP2	P	C[6a]	S	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:S-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2S)	S(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2S){1|C<3>,2|H<1>}	S(C[6a]C[6a]2)(PC[6a]3)	108.9577	2.612	3	108.9577	6.821	3	108.9577	6.821	3	108.9577	6.821	3	105.7282	41.968	10	105.7282	41.968	10
992	643	909	0:SP3_SP2_SP2	P	C[6a]	S	3:3:3:2:	3:3:4:	4:3:	C[6a]-3:C[6]-3:C[6]-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C[6a]-3:	P(C[6a]C[6a]2)(C[6]C[6]2)2(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6]2S)	S(PC[6a]C[6]2)(C[6a]C[6a]2)	P(C[6a]C[6a]2)(C[6]C[6]2)2(SC[6a])	C[6a](C[6a]C[6a]H)2(PC[6]2S){1|C<3>,2|H<1>}	S(PC[6a]C[6]2)(C[6a]C[6a]2)	116.2640	0.000	1	116.2640	0.000	1	116.2640	0.000	1	116.2640	0.000	1	105.7282	41.968	10	105.7282	41.968	10
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:2:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:S-2:	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS)	S(PC[6a]OO)(SP)	P(C[6a]C[6a]2)(OC[6])(SS)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	S(PC[6a]OO)(SP)	109.6990	0.000	1	109.6990	0.000	1	109.6990	0.000	1	108.4642	2.027	11	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:2:	C[6a]-3:O-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:S-2:	P(C[6a]C[6a]2)(OC)(SS)(S)	C[6a](C[6a]C[6a]H)2(POSS)	S(PC[6a]OS)(SP)	P(C[6a]C[6a]2)(OC)(SS)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	S(PC[6a]OS)(SP)	108.3407	1.437	10	108.3407	2.066	10	108.3407	2.066	10	108.4642	2.027	11	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS)	S(PC[6a]OO)(CH3)	P(C[6a]C[6a]2)(OC[6])(SC)(O)	C[6a](C[6a]C[6a]H)2(POOS){1|C<3>,2|H<1>}	S(PC[6a]OO)(CH3)	108.1740	0.000	1	108.1740	0.000	1	108.1740	0.000	1	106.1867	17.183	25	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:O-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:	P(C[6a]C[6a]2)(OC)(SP)(S)	C[6a](C[6a]C[6a]H)2(POSS)	S(PC[6a]OS)2	P(C[6a]C[6a]2)(OC)(SP)(S)	C[6a](C[6a]C[6a]H)2(POSS){1|C<3>,2|H<1>}	S(PC[6a]OS)2	106.4544	4.226	22	106.4544	17.859	22	106.4544	17.859	22	106.1867	17.183	25	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:S-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:	P(C[6a]C[6a]2)(SC)2(S)	C[6a](C[6a]C[6a]H)2(PS3)	S(CC[6a]HH)(PC[6a]SS)	P(C[6a]C[6a]2)(SC)2(S)	C[6a](C[6a]C[6a]H)2(PS3){1|C<3>,2|H<1>}	S(CC[6a]HH)(PC[6a]SS)	102.8810	0.000	1	102.8810	0.000	1	102.8810	0.000	1	106.1867	17.183	25	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:S-2:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SC)2(S)	C[6a](C[6a]C[6a]H)2(PS3)	S(PC[6a]SS)(CCHH)	P(C[6a]C[6a]2)(SC)2(S)	C[6a](C[6a]C[6a]H)2(PS3){1|C<3>,2|H<1>}	S(PC[6a]SS)(CCHH)	101.6140	0.000	1	101.6140	0.000	1	101.6140	0.000	1	106.1867	17.183	25	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:2:4:1:	3:3:4:	4:4:	C[6a]-3:S-2:C-4:S-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:	P(C[6a]C[6a]2)(SC[6])(CC3)(S)	C[6a](C[6a]C[6a]H)2(PCSS)	S(C[6]C[6]2C)(PC[6a]CS)	P(C[6a]C[6a]2)(SC[6])(CC3)(S)	C[6a](C[6a]C[6a]H)2(PCSS){1|C<3>,2|H<1>}	S(C[6]C[6]2C)(PC[6a]CS)	105.3430	0.000	1	105.3430	0.000	1	105.3430	0.000	1	105.3430	0.000	1	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:2:1:	3:3:4:	4:2:	C[6a]-3:C[6a]-3:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:S-2:	P(C[6a]C[6a]2)2(SS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS)	S(PC[6a]2S)(SP)	P(C[6a]C[6a]2)2(SS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS){1|C<3>,2|H<1>}	S(PC[6a]2S)(SP)	101.8207	6.411	2	101.8207	41.103	2	102.0863	26.648	6	102.0863	26.648	6	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:2:1:	3:3:4:	4:2:	C[6a]-3:C[6a]-3:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:S-2:	P(C[6a]C[6a]2)2(SS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS)	S(PC[6a]2S)(SS)	P(C[6a]C[6a]2)2(SS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS){1|C<3>,2|H<1>}	S(PC[6a]2S)(SS)	102.2192	5.536	4	102.2192	30.643	4	102.0863	26.648	6	102.0863	26.648	6	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OS)	S(PC[6a]2O)(CH3)	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]OS){1|C<3>,2|H<1>}	S(PC[6a]2O)(CH3)	102.6720	0.000	1	102.6720	0.000	1	104.8765	9.720	2	104.3355	7.208	4	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:S-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS)	S(PC[6a]2O)(CH3)	P(C[6a]C[6a]2)2(SC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]OS){1|C<3>,2|H<1>}	S(PC[6a]2O)(CH3)	107.0810	0.000	1	107.0810	0.000	1	104.8765	9.720	2	104.3355	7.208	4	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:2:1:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:S-2:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)2(SC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS)	S(PC[6a]2S)(CC[5]HH)	P(C[6a]C[6a]2)2(SC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]SS){1|C<3>,2|H<1>}	S(PC[6a]2S)(CC[5]HH)	103.7945	3.276	2	103.7945	10.732	2	103.7945	10.732	2	104.3355	7.208	4	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:3:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C[6a]-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:I-1:	P(C[6a]C[6a]2)3(SI)	C[6a](C[6a]C[6a]H)2(PC[6a]2S)	S(PC[6a]3)(I)	P(C[6a]C[6a]2)3(SI)	C[6a](C[6a]C[6a]H)2(PC[6a]2S){1|C<3>,2|H<1>}	S(PC[6a]3)(I)	110.0210	5.255	3	110.0210	27.614	3	110.0210	27.614	3	110.0210	27.614	3	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:3:4:2:	3:3:4:	4:4:	C[6a]-3:C[6a]-3:C-4:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:B-4:	P(C[6a]C[6a]2)2(CBHP)(SB)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	S(PC[6a]2C)(BCHH)	P(C[6a]C[6a]2)2(CBHP)(SB)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	S(PC[6a]2C)(BCHH)	107.8435	2.471	2	107.8435	6.108	2	107.8435	6.108	2	107.8435	6.108	2	106.3351	16.738	53	106.3351	16.738	53
992	643	909	0:SP3_SP2_SP3	P	C[6a]	S	3:4:2:1:	3:3:4:	4:4:	C[6a]-3:C-4:S-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(CC3)(SC)(Se)	C[6a](C[6a]C[6a]H)2(PSeCS)	S(PC[6a]SeC)(CCHH)	P(C[6a]C[6a]2)(CC3)(SC)(Se)	C[6a](C[6a]C[6a]H)2(PSeCS){1|C<3>,2|H<1>}	S(PC[6a]SeC)(CCHH)	107.0340	0.000	1	107.0340	0.000	1	107.0340	0.000	1	107.0340	0.000	1	106.3351	16.738	53	106.3351	16.738	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:2:1:1:	3:3:4:	4:2:	C[6a]-3:Se-2:Se-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:Se-2:	P(C[6a]C[6a]2)(SeSe)(Se)2	C[6a](C[6a]C[6a]H)2(PSe3)	Se(PC[6a]Se2)(SeP)	P(C[6a]C[6a]2)(SeSe)(Se)2	C[6a](C[6a]C[6a]H)2(PSe3){1|C<3>,2|H<1>}	Se(PC[6a]Se2)(SeP)	106.0823	0.857	3	106.0823	0.735	3	106.0823	0.735	3	106.0823	0.735	3	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:Se-2:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O)	Se(PC[6a]SeO)(CCHH)	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O){1|C<3>,2|H<1>}	Se(PC[6a]SeO)(CCHH)	105.7979	2.915	9	105.7979	8.495	9	105.2540	9.814	13	105.2540	9.814	13	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:2:2:1:	3:3:4:	4:4:	C[6a]-3:Se-2:O-2:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O)	Se(PC[6a]SeO)(CC[6a]HH)	P(C[6a]C[6a]2)(SeC)(OC)(Se)	C[6a](C[6a]C[6a]H)2(PSe2O){1|C<3>,2|H<1>}	Se(PC[6a]SeO)(CC[6a]HH)	104.0302	3.704	4	104.0302	13.721	4	105.2540	9.814	13	105.2540	9.814	13	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:2:4:1:	3:3:4:	3:4:	C[6a]-3:Se-2:C-4:Se-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)(SeC[6a])(CC3)(Se)	C[6a](C[6a]C[6a]H)2(PSe2C)	Se(C[6a]C[6a]2)(PC[6a]SeC)	P(C[6a]C[6a]2)(SeC[6a])(CC3)(Se)	C[6a](C[6a]C[6a]H)2(PSe2C){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]SeC)	107.4110	0.000	1	107.4110	0.000	1	107.4110	0.000	1	107.4110	0.000	1	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:2:4:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:Se-2:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(SeC[6a])(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	Se(C[6a]C[6a]2)(PC[6a]2C)	P(C[6a]C[6a]2)2(SeC[6a])(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]2C)	108.6660	3.503	2	108.6660	12.271	2	108.1773	12.611	4	108.1773	12.611	4	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:2:4:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:Se-2:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)2(SeC[6a])(CH3)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	Se(C[6a]C[6a]2)(PC[6a]2C)	P(C[6a]C[6a]2)2(SeC[6a])(CH3)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]2C)	107.6885	4.960	2	107.6885	24.605	2	108.1773	12.611	4	108.1773	12.611	4	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2Se)	Se(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]2Se){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]3)	108.5877	0.888	3	108.5877	0.788	3	109.3973	16.475	27	109.3973	16.475	27	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)(C[6a]C[6a]S)(PC[6a]2Se)	Se(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)(C[6a]C[6a]S)(PC[6a]2Se){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]3)	108.9967	0.452	3	108.9967	0.204	3	109.3973	16.475	27	109.3973	16.475	27	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2Se)	Se(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2Se){1|C<3>,1|C<4>,1|H<1>}	Se(C[6a]C[6a]2)(PC[6a]3)	109.6513	6.585	3	109.5702	21.165	21	109.3973	16.475	27	109.3973	16.475	27	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:3:2:	3:3:4:	3:4:	C[6a]-3:C[6a]-3:C[6a]-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2Se)	Se(C[6a]C[6a]2)(PC[6a]3)	P(C[6a]C[6a]2)3(SeC[6a])	C[6a](C[6a]C[6a]H)2(PC[6a]2Se){1|C<3>,2|H<1>}	Se(C[6a]C[6a]2)(PC[6a]3)	109.5567	4.449	18	109.5702	21.165	21	109.3973	16.475	27	109.3973	16.475	27	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:3:2:	3:3:4:	4:2:	C[6a]-3:C[6a]-3:C[6a]-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	P-4:N-2:	P(C[6a]C[6a]2)3(SeN)	C[6a](C[6a]C[6a]H)2(PC[6a]2Se)	Se(PC[6a]3)(NC)	P(C[6a]C[6a]2)3(SeN)	C[6a](C[6a]C[6a]H)2(PC[6a]2Se){1|C<3>,2|H<1>}	Se(PC[6a]3)(NC)	110.2500	5.315	3	110.2500	28.246	3	110.2500	28.246	3	110.2500	28.246	3	108.2461	16.857	53	108.2461	16.857	53
992	643	921	0:SP3_SP2_SP3	P	C[6a]	Se	3:3:4:2:	3:3:4:	4:1:	C[6a]-3:C[6a]-3:C-4:Se-2:	C[6a]-3:C[6a]-3:P-4:	P-4:I-1:	P(C[6a]C[6a]2)2(CHHP)(SeI)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	Se(PC[6a]2C)(I)	P(C[6a]C[6a]2)2(CHHP)(SeI)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	Se(PC[6a]2C)(I)	112.9495	3.384	2	112.9495	11.448	2	112.9495	11.448	2	112.9495	11.448	2	108.2461	16.857	53	108.2461	16.857	53
992	643	923	0:SP3_SP2_SP2	P	C[6a]	As[6a]	3:3:3:3:	4:3:3:	3:3:4:	As[6a]-3:C[6a]-3:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C[6a]-3:	C[6a,6a]-3:C[6a,6a]-3:P-4:	P(As[6a]C[6a,6a]2)(C[6a]C[6a]2)3	C[6a](PAs[6a]C[6a]2)(C[6a]C[6a]H)2	As[6a](C[6a,6a]C[6a,6a]C[6a])2(PC[6a]3)	P(As[6a]C[6a,6a]2)(C[6a]C[6a]2)3	C[6a](PAs[6a]C[6a]2)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	As[6a](C[6a,6a]C[6a,6a]C[6a])2(PC[6a]3){1|N<3>,2|H<1>,4|C<3>}	110.1235	1.896	6	110.1235	3.595	6	110.1235	3.595	6	110.1235	3.595	6	110.1235	3.595	6	110.1235	3.595	6
992	643	924	0:SP3_SP-NON_SP2	P	C[6a]	Br	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:Br-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2Br)	Br(PC[6a]3)	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2Br){1|C<3>,2|H<1>}	Br(PC[6a]3)	106.8340	0.759	3	106.8340	0.575	3	105.9871	4.587	8	105.9871	4.587	8	108.0732	6.304	18	108.0732	6.304	18
992	643	924	0:SP3_SP-NON_SP2	P	C[6a]	Br	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:Br-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]C)2(PC[6a]2Br)	Br(PC[6a]3)	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]C)2(PC[6a]2Br){1|C<3>,2|H<1>}	Br(PC[6a]3)	103.7037	1.375	3	103.7037	1.890	3	105.9871	4.587	8	105.9871	4.587	8	108.0732	6.304	18	108.0732	6.304	18
992	643	924	0:SP3_SP-NON_SP2	P	C[6a]	Br	3:3:3:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C[6a]-3:Br-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]2Br)	Br(PC[6a]3)	P(C[6a]C[6a]2)3(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]2Br){1|C<3>,2|H<1>}	Br(PC[6a]3)	108.1420	0.310	2	108.1420	0.096	2	105.9871	4.587	8	105.9871	4.587	8	108.0732	6.304	18	108.0732	6.304	18
992	643	924	0:SP3_SP-NON_SP2	P	C[6a]	Br	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:Br-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CCHH)(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]BrC)	Br(PC[6a]2C)	P(C[6a]C[6a]2)2(CCHH)(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]BrC){1|C<3>,2|H<1>}	Br(PC[6a]2C)	109.8498	1.519	6	109.8498	2.306	6	109.7420	1.377	10	109.7420	1.377	10	108.0732	6.304	18	108.0732	6.304	18
992	643	924	0:SP3_SP-NON_SP2	P	C[6a]	Br	3:3:4:1:	3:3:4:	4:	C[6a]-3:C[6a]-3:C-4:Br-1:	C[6a]-3:C[6a]-3:P-4:	P-4:	P(C[6a]C[6a]2)2(CHHP)(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]BrC)	Br(PC[6a]2C)	P(C[6a]C[6a]2)2(CHHP)(Br)	C[6a](C[6a]C[6a]H)2(PC[6a]BrC){1|C<3>,2|H<1>}	Br(PC[6a]2C)	109.5802	0.480	4	109.5802	0.230	4	109.7420	1.377	10	109.7420	1.377	10	108.0732	6.304	18	108.0732	6.304	18
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:2:3:1:	3:3:4:	4:3:4:	C[6a]-3:O-2:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:Si-4:	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	C(PC[6a]OO)(CC[6a]H)(SiC3)	P(C[6a]C[6a]2)(OC[6a])(CSiC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	C(PC[6a]OO)(CC[6a]H)(SiC3)	112.5580	0.000	1	112.5580	0.000	1	112.5580	0.000	1	112.5580	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:1:1:	3:3:4:	3:4:3:	C[6a]-3:C-3:H-1:H-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)(CC[6a]C)(H)2	C[6a](C[6a]C[6a]C)2(PCHH)	C(C[6a]C[6a]2)(PC[6a]HH)(CBH)	P(C[6a]C[6a]2)(CC[6a]C)(H)2	C[6a](C[6a]C[6a]C)2(PCHH){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]HH)(CBH)	113.3310	0.000	1	113.3310	0.000	1	113.3310	0.000	1	113.3310	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:1:1:	3:3:4:	4:3:3:	C[6a]-3:C-3:Se-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:N-3:	P(C[6a]C[6a]2)(CNN)(Se)2	C[6a](C[6a]C[6a]H)2(PSe2C)	C(PC[6a]Se2)(NCC)(NHH)	P(C[6a]C[6a]2)(CNN)(Se)2	C[6a](C[6a]C[6a]H)2(PSe2C){1|C<3>,2|H<1>}	C(PC[6a]Se2)(NCC)(NHH)	103.4205	0.086	2	103.4205	0.007	2	101.0952	7.484	4	101.0952	7.484	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:1:1:	3:3:4:	4:3:3:	C[6a]-3:C-3:Se-1:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:N-3:	P(C[6a]C[6a]2)(CNN)(Se)2	C[6a](C[6a]C[6a]H)2(PSe2C)	C(PC[6a]Se2)(NCH)(NHH)	P(C[6a]C[6a]2)(CNN)(Se)2	C[6a](C[6a]C[6a]H)2(PSe2C){1|C<3>,2|H<1>}	C(PC[6a]Se2)(NCH)(NHH)	98.7698	0.903	2	98.7698	0.816	2	101.0952	7.484	4	101.0952	7.484	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:1:1:	3:3:4:	4:4:3:	C[6a]-3:C-3:H-1:H-1:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:C-3:	P(C[6a]C[6a]2)(CBC)(H)2	C[6a](C[6a]C[6a]C)2(PCHH)	C(BC[6a]2F)(PC[6a]HH)(CCH)	P(C[6a]C[6a]2)(CBC)(H)2	C[6a](C[6a]C[6a]C)2(PCHH){1|C<3>,2|H<1>}	C(BC[6a]2F)(PC[6a]HH)(CCH)	128.7720	0.000	1	128.7720	0.000	1	128.9015	0.034	2	128.9015	0.034	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:1:1:	3:3:4:	4:4:3:	C[6a]-3:C-3:H-1:H-1:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:C-3:	P(C[6a]C[6a]2)(CBC)(H)2	C[6a](C[6a]C[6a]C)2(PCHH)	C(BC[6a]2H)(PC[6a]HH)(CCH)	P(C[6a]C[6a]2)(CBC)(H)2	C[6a](C[6a]C[6a]C)2(PCHH){1|C<3>,2|H<1>}	C(BC[6a]2H)(PC[6a]HH)(CCH)	129.0310	0.000	1	129.0310	0.000	1	128.9015	0.034	2	128.9015	0.034	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:1:	3:3:4:	3:4:3:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO)	C(C[6a]C[6a]2)(PC[6a]OO)(CHH)	P(C[6a]C[6a]2)(CC[6a]C)(OC)(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]OO)(CHH)	106.9080	0.000	1	106.9080	0.000	1	107.3123	0.274	3	107.3123	0.274	3	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:1:	3:3:4:	3:4:3:	C[6a]-3:C-3:O-2:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO)	C(C[6a]C[6a]2)(PC[6a]OO)(CHH)	P(C[6a]C[6a]2)(CC[6a]C)(OC[6])(O)	C[6a](C[6a]C[6a]H)2(PCOO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]OO)(CHH)	107.5145	0.549	2	107.5145	0.302	2	107.3123	0.274	3	107.3123	0.274	3	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:1:	3:3:4:	4:3:1:	C[6a]-3:C-3:C-2:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CCH)(CC)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CC[6a]S)(H)	P(C[6a]C[6a]2)(CCH)(CC)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CC[6a]S)(H)	106.2265	1.063	2	106.2265	1.130	2	106.2265	1.130	2	106.2265	1.130	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CGeC)(COO)	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CGeC)(COO)	104.0320	0.919	2	104.0320	0.845	2	104.1851	1.204	8	104.1851	1.204	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CSiC)(COO)	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CSiC)(COO)	103.8745	1.286	2	103.8745	1.654	2	104.1851	1.204	8	104.1851	1.204	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CSnC)(COO)	P(C[6a]C[6a]2)2(NC[6a])(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CSnC)(COO)	104.4170	1.351	4	104.4170	1.825	4	104.1851	1.204	8	104.1851	1.204	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a])(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NC[6a])(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	108.1058	2.579	12	108.1058	6.653	12	108.1058	6.653	12	108.3396	9.898	29	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:Se-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(SeHg)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(H)	P(C[6a]C[6a]2)2(SeHg)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(H)	108.4161	4.402	7	108.4161	19.374	7	108.5046	12.677	17	108.3396	9.898	29	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:Se-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(SeLi)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Li)(PC[6a]2Se)(H)	P(C[6a]C[6a]2)2(SeLi)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Li)(PC[6a]2Se)(H)	110.8555	1.493	2	110.8555	2.228	2	108.5046	12.677	17	108.3396	9.898	29	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:Se-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(SeLi)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(H)	P(C[6a]C[6a]2)2(SeLi)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(H)	108.1792	4.191	4	108.1792	17.568	4	108.5046	12.677	17	108.3396	9.898	29	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:Se-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(SeZn)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(H)	P(C[6a]C[6a]2)2(SeZn)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(H)	107.8093	2.462	4	107.8093	6.061	4	108.5046	12.677	17	108.3396	9.898	29	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)2(NC[6a])(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CN)	P(C[6a]C[6a]2)2(NC[6a])(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CN)	107.1510	2.679	2	107.1510	7.174	2	107.1510	7.174	2	107.1510	7.174	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:N-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(NC[6a])(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2Se)(PC[6a]2N)(CRuN)	P(C[6a]C[6a]2)2(NC[6a])(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2Se)(PC[6a]2N)(CRuN)	113.0640	1.196	2	113.0640	1.431	2	113.0640	1.431	2	114.3762	3.066	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:2:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:Se-2:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(SeRu)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)(PC[6a]2N)(CRuN)	P(C[6a]C[6a]2)2(SeRu)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)(PC[6a]2N)(CRuN)	115.6885	0.937	2	115.6885	0.878	2	115.6885	0.878	2	114.3762	3.066	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:3:4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:C[5]-3:P-4:	P(C[6a]C[6a]2)2(CC[6a]C[5])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(C[5]C[5]2)(PC[6a]2O)	P(C[6a]C[6a]2)2(CC[6a]C[5])(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(C[5]C[5]2)(PC[6a]2O)	105.4925	0.293	2	105.4925	0.086	2	105.4925	0.086	2	105.4925	0.086	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5,6]-3:P-4:H-1:	P(C[6a]C[6a]2)2(CC[5,6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[5,6]C[5,5,6]C[5,6,6])(PC[6a]2O)(H)	P(C[6a]C[6a]2)2(CC[5,6]H)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[5,6]C[5,5,6]C[5,6,6])(PC[6a]2O)(H)	103.6900	1.496	2	103.6900	2.239	2	103.6900	2.239	2	103.6900	2.239	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:2:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:C-2:	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6]C[6]2)(PC[6a]2O)(CC)	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6]C[6]2)(PC[6a]2O)(CC)	106.1525	0.585	6	106.1525	0.343	6	106.1525	0.343	6	105.7098	1.138	44	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:2:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-2:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(PC[6a]2O)(CC)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2O)(CC)	105.6399	1.113	38	105.6399	1.240	38	105.6399	1.240	38	105.7098	1.138	44	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:H-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]CH)	C(C[6a]C[6a]2)(PC[6a]2H)(CBH)	P(C[6a]C[6a]2)2(CC[6a]C)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]CH){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2H)(CBH)	114.9420	7.102	2	114.9420	50.441	2	114.9420	50.441	2	106.3243	8.625	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(PC[6a]2O)(CCH)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2O)(CCH)	106.6035	1.668	2	106.6035	2.782	2	105.7857	2.464	32	106.3243	8.625	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(PC[6a]2O)(CCI)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2O)(CCI)	105.3983	1.371	24	105.3983	1.879	24	105.7857	2.464	32	106.3243	8.625	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(PC[6a]2O)(CHN)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2O)(CHN)	107.7097	1.877	4	107.7097	3.522	4	105.7857	2.464	32	106.3243	8.625	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6a]C[6a]2)(PC[6a]2O)(CSeH)	P(C[6a]C[6a]2)2(CC[6a]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2O)(CSeH)	105.7685	0.255	2	105.7685	0.065	2	105.7857	2.464	32	106.3243	8.625	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C-3:P-4:C-4:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(CC[5a]C[6a])(PC[6a]2O)(CHHN)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(CC[5a]C[6a])(PC[6a]2O)(CHHN)	107.3000	4.120	2	107.3000	16.971	2	107.3000	16.971	2	106.5995	5.144	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:P-4:	P(C[6a]C[6a]2)2(CC[6]P)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6]C[6,6a]O[6])(PC[6a]2O)2	P(C[6a]C[6a]2)2(CC[6]P)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6]C[6,6a]O[6])(PC[6a]2O)2	106.2493	1.557	4	106.2493	2.425	4	106.2493	2.425	4	106.5995	5.144	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:1:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:S-1:S-1:	P(C[6a]C[6a]2)2(CSS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(S)2	P(C[6a]C[6a]2)2(CSS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(S)2	107.0523	3.599	4	107.0523	12.956	4	107.0523	12.956	4	107.0523	12.956	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:2:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-2:Cl-1:	P(C[6a]C[6a]2)2(CClP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(PC[6a])(Cl)	P(C[6a]C[6a]2)2(CClP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(PC[6a])(Cl)	105.1650	1.553	4	105.1650	2.413	4	105.1650	2.413	4	105.1650	2.413	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:2:4:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-2:Si-4:	P(C[6a]C[6a]2)2(CSiP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(PC[6a])(SiC3)	P(C[6a]C[6a]2)2(CSiP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(PC[6a])(SiC3)	107.1767	1.799	4	107.1767	3.237	4	107.1767	3.237	4	107.1767	3.237	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CCH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CC[6a]H)(H)	P(C[6a]C[6a]2)(CCH)2(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CC[6a]H)(H)	104.9195	1.573	2	104.9195	2.475	2	104.9195	2.475	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:H-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]CH)	C(PC[6a]2H)(CBH)(H)	P(C[6a]C[6a]2)2(CCH)(H)	C[6a](C[6a]C[6a]C)2(PC[6a]CH){1|C<3>,2|H<1>}	C(PC[6a]2H)(CBH)(H)	114.3015	5.557	2	114.3015	30.882	2	114.3015	30.882	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:Br-1:	P(C[6a]C[6a]2)2(CBrC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CCH)(Br)	P(C[6a]C[6a]2)2(CBrC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CCH)(Br)	107.1245	2.801	2	107.1245	7.845	2	107.1245	7.845	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:Cl-1:	P(C[6a]C[6a]2)2(CClC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CClH)(Cl)	P(C[6a]C[6a]2)2(CClC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CClH)(Cl)	106.1060	0.728	2	106.1060	0.530	2	106.1060	0.530	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO)	C(PC[6a]2O)(CHH)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)(C[6a]C[6a]O)(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CHH)(H)	107.4430	0.000	1	107.4430	0.000	1	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CCI)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CCI)(H)	104.8965	1.203	2	104.8965	1.447	2	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6]H)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6]H)(H)	105.4530	0.584	2	105.4530	0.341	2	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6a]Te)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6a]Te)(H)	105.9990	1.679	2	105.9990	2.818	2	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CHH)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CHH)(H)	107.5440	0.000	1	107.5440	0.000	1	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CHP)(H)	P(C[6a]C[6a]2)2(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CHP)(H)	103.7095	2.149	2	103.7095	4.618	2	105.5103	2.758	10	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:O-1:	P(C[6a]C[6a]2)2(CNO)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO)	C(PC[6a]2O)(NCH)(O)	P(C[6a]C[6a]2)2(CNO)(O)	C[6a](C[6a]C[6a]C)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(NCH)(O)	106.5411	7.048	4	106.5411	49.669	4	106.5411	49.669	4	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:S-1:	P(C[6a]C[6a]2)2(CNS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(NC[6a]H)(S)	P(C[6a]C[6a]2)2(CNS)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(NC[6a]H)(S)	104.9525	0.168	2	104.9525	0.028	2	104.9525	0.028	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(CC[6a]H)(H)	P(C[6a]C[6a]2)2(CCH)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(CC[6a]H)(H)	106.4735	4.777	2	106.4735	22.815	2	104.8672	11.781	4	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(CC[6a]P)(H)	P(C[6a]C[6a]2)2(CCH)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(CC[6a]P)(H)	103.2610	1.486	2	103.2610	2.209	2	104.8672	11.781	4	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:S-1:	P(C[6a]C[6a]2)2(CNS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(NCH)(S)	P(C[6a]C[6a]2)2(CNS)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(NCH)(S)	105.3610	1.573	2	105.3610	2.473	2	105.3610	2.473	2	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-3:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CCH)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)(CHP)(H)	P(C[6a]C[6a]2)2(CCH)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)(CHP)(H)	104.0992	1.566	4	104.0992	2.452	4	104.0992	2.452	4	105.9607	13.018	34	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6a]C)(CC)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6a]C)(CC)	105.7140	1.314	2	105.7140	1.726	2	105.7140	1.726	2	106.3568	1.599	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:N-2:	P(C[6a]C[6a]2)2(CNN)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(NC[6]H)(NC[6])	P(C[6a]C[6a]2)2(CNN)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(NC[6]H)(NC[6])	107.2790	1.381	4	107.2790	1.907	4	107.2790	1.907	4	106.3568	1.599	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C-3:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:N-2:	P(C[6a]C[6a]2)2(CNN)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)(NC[6]H)(NC[6])	P(C[6a]C[6a]2)2(CNN)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)(NC[6]H)(NC[6])	105.7560	0.650	4	105.7560	0.423	4	105.7560	0.423	4	106.3568	1.599	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C-3:C-3:H-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-3:C-3:	P(C[6a]C[6a]2)(CAlC)(CCP)(H)	C[6a](C[6a]C[6a]C)2(PCCH)	C(PC[6a]CH)(PC[6a]Al)(CCH)	P(C[6a]C[6a]2)(CAlC)(CCP)(H)	C[6a](C[6a]C[6a]C)2(PCCH){1|C<3>,2|H<1>}	C(PC[6a]CH)(PC[6a]Al)(CCH)	109.2090	0.000	1	109.2090	0.000	1	109.2090	0.000	1	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CCC)(CHH)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CCC)(CHH)	108.3700	0.854	2	108.3700	0.730	2	106.3823	4.492	14	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CCH)(CCP)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CCH)(CCP)	106.7105	2.146	8	106.7105	4.605	8	106.3823	4.492	14	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6]S)(CHH)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6]S)(CHH)	104.9900	1.069	2	104.9900	1.143	2	106.3823	4.492	14	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6a]C)(CCO)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6a]C)(CCO)	104.4740	2.090	2	104.4740	4.369	2	106.3823	4.492	14	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:N-3:	P(C[6a]C[6a]2)2(CCN)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(CClN)(NFeO)	P(C[6a]C[6a]2)2(CCN)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(CClN)(NFeO)	105.2735	2.921	2	105.2735	8.533	2	105.2735	8.533	2	106.4181	4.835	17	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:3:4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CC[6a]H)(CHHO)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CC[6a]H)(CHHO)	107.2390	2.485	2	107.2390	6.174	2	107.2390	6.174	2	107.2390	6.174	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:O-1:	P(C[6a]C[6a]2)2(CC[5]O)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[5]C[5]2Fe)(PC[6a]2O)(O)	P(C[6a]C[6a]2)2(CC[5]O)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[5]C[5]2Fe)(PC[6a]2O)(O)	101.9110	0.177	2	101.9110	0.031	2	101.9110	0.031	2	105.0785	8.099	18	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:O-1:	P(C[6a]C[6a]2)2(CC[5]O)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(C[5]C[5]2Fe)(PC[6a]2S)(O)	P(C[6a]C[6a]2)2(CC[5]O)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(C[5]C[5]2Fe)(PC[6a]2S)(O)	103.9135	1.569	2	103.9135	2.462	2	103.9135	2.462	2	105.0785	8.099	18	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2N)(PC[6a]2S)(H)	P(C[6a]C[6a]2)2(CHP)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2N)(PC[6a]2S)(H)	104.8042	2.833	8	104.8042	8.024	8	104.8042	8.024	8	105.0785	8.099	18	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:Se-1:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:O-1:	P(C[6a]C[6a]2)2(CC[5]O)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(C[5]C[5]2Fe)(PC[6a]2Se)(O)	P(C[6a]C[6a]2)2(CC[5]O)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(C[5]C[5]2Fe)(PC[6a]2Se)(O)	103.9630	1.095	2	103.9630	1.198	2	103.9630	1.198	2	105.0785	8.099	18	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:Se-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Se-1:	P(C[6a]C[6a]2)2(CSeP)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(Se)	P(C[6a]C[6a]2)2(CSeP)(Se)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(Se)	108.3510	1.742	4	108.3510	3.036	4	108.3510	3.036	4	105.0785	8.099	18	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(CC[6a]HP)(PC[6a]2O)(CHH)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(CC[6a]HP)(PC[6a]2O)(CHH)	106.3710	1.525	2	106.3710	2.324	2	106.3710	2.324	2	106.8560	3.949	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[3]-4:P-4:C-3:	P(C[6a]C[6a]2)2(CC[3]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[3]C[3]2O)(PC[6a]2O)(CC[6a]C)	P(C[6a]C[6a]2)2(CC[3]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[3]C[3]2O)(PC[6a]2O)(CC[6a]C)	108.4240	2.686	2	108.4240	7.212	2	108.4240	7.212	2	106.8560	3.949	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	C[6]-4:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(C[6]C[6]2O)(PC[6a]2O)(CC[6a]H)	P(C[6a]C[6a]2)2(CC[6]C)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(C[6]C[6]2O)(PC[6a]2O)(CC[6a]H)	107.6710	0.018	2	107.6710	0.000	2	107.6710	0.000	2	106.8560	3.949	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(CCHH)(CCI)	P(C[6a]C[6a]2)2(CCC)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(CCHH)(CCI)	107.0235	0.613	2	107.0235	0.376	2	107.0235	0.376	2	106.8560	3.949	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:S-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)2(CCC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)(CCHH)(CCH)	P(C[6a]C[6a]2)2(CCC)(S)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)(CCHH)(CCH)	104.7905	3.212	2	104.7905	10.319	2	104.7905	10.319	2	106.8560	3.949	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:1:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-4:	P(C[6a]C[6a]2)2(CPP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(PC[6a]3)2	P(C[6a]C[6a]2)2(CPP)(O)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(PC[6a]3)2	110.1805	0.595	2	110.1805	0.354	2	110.1805	0.354	2	110.1805	0.354	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(NC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(C[6a]C[6a]2)(PC[6a]2N)(CCH)	P(C[6a]C[6a]2)2(CC[6a]C)(NC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2N)(CCH)	104.7610	0.532	2	104.7610	0.283	2	104.7610	0.283	2	104.7610	0.283	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:3:1:	C[6a]-3:C[6]-3:C-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(C[6]C[6]2)(CCH)(OZn)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	C(PC[6a]C[6]O)(CHP)(H)	P(C[6a]C[6a]2)(C[6]C[6]2)(CCH)(OZn)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	C(PC[6a]C[6]O)(CHP)(H)	107.5200	0.000	1	107.5200	0.000	1	107.5200	0.000	1	107.5200	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:S-3:N-2:	P(C[6a]C[6a]2)2(CNS)(NP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(SRu2)(NC)	P(C[6a]C[6a]2)2(CNS)(NP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(SRu2)(NC)	105.3930	3.939	4	105.3930	15.519	4	105.3930	15.519	4	105.3930	15.519	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:3:3:	C[6a]-3:C-3:C-3:C-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-3:C-3:	P(C[6a]C[6a]2)(CAlC)(CCP)(CC)	C[6a](C[6a]C[6a]C)2(PC3)	C(PC[6a]CC)(PC[6a]Al)(CCH)	P(C[6a]C[6a]2)(CAlC)(CCP)(CC)	C[6a](C[6a]C[6a]C)2(PC3){1|C<3>,2|H<1>}	C(PC[6a]CC)(PC[6a]Al)(CCH)	105.5910	0.000	1	105.5910	0.000	1	105.5910	0.000	1	104.6437	4.140	3	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)2(CCC)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CSiC)(COO)	P(C[6a]C[6a]2)2(CCC)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CSiC)(COO)	104.1700	2.633	2	104.1700	6.934	2	104.1700	6.934	2	104.6437	4.140	3	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Ge-1:	P(C[6a]C[6a]2)2(CGeP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PGe[5,5]C[6a]2)(PC[6a]2N)(Ge)	P(C[6a]C[6a]2)2(CGeP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PGe[5,5]C[6a]2)(PC[6a]2N)(Ge)	109.9595	0.726	2	109.9595	0.527	2	109.9595	0.527	2	109.3061	8.294	16	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(NC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(CHP)(NC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	111.0815	3.883	2	111.0815	15.076	2	111.0815	15.076	2	109.3061	8.294	16	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(OAl)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)2(H)	P(C[6a]C[6a]2)2(CHP)(OAl)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)2(H)	109.8238	2.752	4	109.8238	7.573	4	109.8238	7.573	4	109.3061	8.294	16	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(SLi)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)2(H)	P(C[6a]C[6a]2)2(CHP)(SLi)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)2(H)	108.4400	3.204	8	108.4400	10.266	8	108.4400	10.266	8	109.3061	8.294	16	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CN)	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CN)	104.4603	2.040	8	104.4603	4.161	8	104.4603	4.161	8	105.9694	11.405	14	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:I-2:	P(C[6a]C[6a]2)2(CIP)(SLi)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)2(ILi)	P(C[6a]C[6a]2)2(CIP)(SLi)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)2(ILi)	105.7645	1.179	2	105.7645	1.389	2	105.7645	1.389	2	105.9694	11.405	14	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Se-2:	P(C[6a]C[6a]2)2(CSeP)(SeSn)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(SeSn)	P(C[6a]C[6a]2)2(CSeP)(SeSn)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(SeSn)	109.0902	4.490	4	109.0902	20.162	4	109.0902	20.162	4	105.9694	11.405	14	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CC[6a]2)	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CC[6a]2)	105.5514	1.427	8	105.5514	2.036	8	106.1185	3.227	14	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CC[6a]H)	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CC[6a]H)	105.6072	0.871	4	105.6072	0.759	4	106.1185	3.227	14	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CC[6a]O)	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CC[6a]O)	109.4095	0.381	2	109.4095	0.145	2	106.1185	3.227	14	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(CCP)(SSn)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2N)(PC[6a]2S)(CNO)	P(C[6a]C[6a]2)2(CCP)(SSn)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2N)(PC[6a]2S)(CNO)	111.4080	1.078	2	111.4080	1.161	2	111.4080	1.161	2	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:S-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Se-3:	P(C[6a]C[6a]2)2(CSeP)(SCu)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)2(SeCu2)	P(C[6a]C[6a]2)2(CSeP)(SCu)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)2(SeCu2)	109.9846	2.638	8	109.9846	6.962	8	109.9846	6.962	8	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C-3:Se-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Se-3:	P(C[6a]C[6a]2)2(CSeP)(SeHg)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC)	C(PC[6a]2Se)2(SeHg2)	P(C[6a]C[6a]2)2(CSeP)(SeHg)	C[6a](C[6a]C[6a]H)2(PC[6a]SeC){1|C<3>,2|H<1>}	C(PC[6a]2Se)2(SeHg2)	109.1393	5.096	4	109.1393	25.967	4	109.1393	25.967	4	108.0325	10.341	28	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C-3:C-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-4:	P(C[6a]C[6a]2)2(CPP)(CN)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2C)(PC[6a]3)2	P(C[6a]C[6a]2)2(CPP)(CN)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(PC[6a]3)2	117.1395	1.051	2	117.1395	1.106	2	117.1395	1.106	2	115.8618	2.881	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C-3:O-2:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-4:	P(C[6a]C[6a]2)2(CPP)(OS)	C[6a](C[6a]C[6a]H)2(PC[6a]CO)	C(PC[6a]2O)(PC[6a]3)2	P(C[6a]C[6a]2)2(CPP)(OS)	C[6a](C[6a]C[6a]H)2(PC[6a]CO){1|C<3>,2|H<1>}	C(PC[6a]2O)(PC[6a]3)2	114.5840	1.004	2	114.5840	1.008	2	114.5840	1.008	2	115.8618	2.881	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:2:	3:3:4:	5:4:4:	C[6a]-3:C[6a]-3:C-3:N-2:	C[6a]-3:C[6a]-3:P-4:	P-5:C-4:P-4:	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2NY)(CC[6a]OY)(PC[6a]2N)	P(C[6a]C[6a]2)2(CCP)(NSi)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2NY)(CC[6a]OY)(PC[6a]2N)	108.9462	2.569	4	108.9462	6.602	4	108.9462	6.602	4	108.9462	6.602	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:3:4:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	N[5]-3:N[5]-3:P-4:	P(C[6a]C[6a]2)2(NC[6a]Zn)(CN[5]2)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(N[5]C[5]N[5])2(PC[6a]2N)	P(C[6a]C[6a]2)2(NC[6a]Zn)(CN[5]2)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(N[5]C[5]N[5])2(PC[6a]2N)	105.1156	0.989	8	105.1156	0.978	8	105.1156	0.978	8	105.1156	0.978	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:C-3:N-3:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:H-1:	P(C[6a]C[6a]2)2(CC[6]H)(NSiZn)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(C[6]C[6]N[6])(PC[6a]2N)(H)	P(C[6a]C[6a]2)2(CC[6]H)(NSiZn)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]2N)(H)	107.4005	4.226	2	107.4005	17.862	2	107.4005	17.862	2	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C-3:P-4:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(CC[6a]Re)(PC[6a]3)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(CC[6a]Re)(PC[6a]3)(H)	110.2670	5.251	3	110.2670	27.573	3	110.2670	27.573	3	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[5]-3:P-4:H-1:	P(C[6a]C[6a]2)3(CC[5]H)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[5]C[5]2)(PC[6a]3)(H)	P(C[6a]C[6a]2)3(CC[5]H)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[5]C[5]2)(PC[6a]3)(H)	110.4292	3.480	9	110.4292	12.109	9	110.4292	12.109	9	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:H-1:	P(C[6a]C[6a]2)3(CC[6a]H)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(H)	P(C[6a]C[6a]2)3(CC[6a]H)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(H)	112.1343	5.033	9	112.1343	25.330	9	112.1343	25.330	9	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]Al)(CC[6]H)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(C[6]C[6]N[6])(PC[6a]2N)(H)	P(C[6a]C[6a]2)2(NC[6a]Al)(CC[6]H)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]2N)(H)	108.9200	3.493	2	108.9200	12.202	2	109.1502	11.294	6	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]Zn)(CC[6]H)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(C[6]C[6]N[6])(PC[6a]2N)(H)	P(C[6a]C[6a]2)2(NC[6a]Zn)(CC[6]H)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]2N)(H)	109.2653	3.834	4	109.2653	14.703	4	109.1502	11.294	6	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:1:	C[6a]-3:N[6]-3:N[6]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[4]-3:P-4:H-1:	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C)	C(C[4]C[4]N[4])(PC[6a]N[6]2)(H)	P(C[6a]C[6a]2)(N[6]C[6]2)2(CC[4]H)	C[6a](C[6a]C[6a]H)2(PN[6]2C){1|C<3>,2|H<1>}	C(C[4]C[4]N[4])(PC[6a]N[6]2)(H)	113.7810	0.000	1	113.7810	0.000	1	113.7810	0.000	1	110.5785	17.033	30	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-2:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CC)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CC)	110.1850	1.806	3	110.1850	3.262	3	110.1850	3.262	3	110.5025	13.388	12	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:N-2:	P(C[6a]C[6a]2)3(CC[6a]N)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(NO)	P(C[6a]C[6a]2)3(CC[6a]N)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(NO)	110.6083	4.188	9	110.6083	17.542	9	110.6083	17.542	9	110.5025	13.388	12	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[4,6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CC[6a]C)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CC[6a]C)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2C){1|H<1>,3|C<3>}	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	101.8100	0.447	2	101.8100	0.200	2	101.8100	0.200	2	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[5]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[5]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[5]C[5]2)(PC[6a]3)(COO)	P(C[6a]C[6a]2)3(CC[5]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[5]C[5]2)(PC[6a]3)(COO)	111.8912	1.434	6	111.8912	2.056	6	111.8912	2.056	6	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6]C[6]N[6])(PC[6a]3)(CRuN)	P(C[6a]C[6a]2)3(CC[6]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6]C[6]N[6])(PC[6a]3)(CRuN)	111.2597	1.632	6	111.2597	2.662	6	111.2597	2.662	6	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CC[6a]C)	C[6a](C[6a]C[6a]C)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CC[6a]C)	C[6a](C[6a]C[6a]C)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	111.5353	7.521	4	111.5353	56.562	4	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,1|C<4>,1|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	111.0220	0.000	1	110.6380	2.648	4	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	110.5100	1.968	3	110.6380	2.648	4	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a,6a]C[6a])(PC[6a]3)(CIrH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a,6a]C[6a])(PC[6a]3)(CIrH)	111.1137	2.750	6	111.1137	7.562	6	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CAlH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CAlH)	110.3780	0.716	3	110.3780	0.513	3	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CBH)	110.6830	3.315	8	110.6830	10.987	8	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CIrH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CIrH)	110.7287	0.864	6	110.7287	0.746	6	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CNN)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CNN)	111.4892	2.974	9	111.4892	8.845	9	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(CRuH)	P(C[6a]C[6a]2)3(CC[6a]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(CRuH)	110.9719	1.950	15	110.9719	3.801	15	110.9877	7.914	55	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:N-3:	P(C[6a]C[6a]2)3(CC[6a]N)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(NCC)	P(C[6a]C[6a]2)3(CC[6a]N)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(NCC)	113.4280	4.568	3	113.4280	20.862	3	113.4280	20.862	3	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:P-3:	P(C[6a]C[6a]2)3(CC[6a]P)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6a]3)(PC[6]2)	P(C[6a]C[6a]2)3(CC[6a]P)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]3)(PC[6]2)	113.8552	2.639	9	113.8552	6.965	9	113.8552	6.965	9	111.2572	10.105	81	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:P-4:	P(C[6a]C[6a]2)3(CC[6a]P)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[6a]C[6a]2)(PC[6]2Au)(PC[6a]3)	P(C[6a]C[6a]2)3(CC[6a]P)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6]2Au)(PC[6a]3)	113.7810	3.235	15	113.7810	10.466	15	113.7810	10.466	15	113.2158	10.897	21	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	3:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-3:P-4:P-4:	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]Cl)(PC[6a]3)2	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]Cl)(PC[6a]3)2	111.8028	3.306	6	111.8028	10.931	6	111.8028	10.931	6	113.2158	10.897	21	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-1:	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(OAl)(O)	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(OAl)(O)	108.1497	0.346	3	108.1497	0.120	3	108.1497	0.120	3	108.1497	0.120	3	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:2:	C[6a]-3:C[6a]-3:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:N-2:O-2:	P(C[6a]C[6a]2)2(CHP)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2C)(NC[6a])(OLi)	P(C[6a]C[6a]2)2(CHP)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(NC[6a])(OLi)	106.3500	4.463	2	106.3500	19.921	2	106.3500	19.921	2	106.4235	19.326	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-2:	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(PC[6a]3)(OAl)2	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(OAl)2	106.5302	2.681	6	106.5302	7.187	6	105.9201	15.526	9	106.4235	19.326	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-2:	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]2C)	C(PC[6a]3)(OAl)2	P(C[6a]C[6a]2)3(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(OAl)2	104.6998	6.386	3	104.6998	40.784	3	105.9201	15.526	9	106.4235	19.326	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:2:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:N-2:O-2:	P(C[6a]C[6a]2)2(NC[6a]Al)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(NC[6a])(OAl)	P(C[6a]C[6a]2)2(NC[6a]Al)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(NC[6a])(OAl)	108.7625	8.634	2	108.7625	74.554	2	108.7625	74.554	2	106.4235	19.326	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:I-2:C-3:	P(C[6a]C[6a]2)3(CCI)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(IC[6a])(COO)	P(C[6a]C[6a]2)3(CCI)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(IC[6a])(COO)	111.4797	2.339	3	111.4797	5.469	3	111.4797	5.469	3	109.8816	7.690	5	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:2:3:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:N-2:N-3:	P(C[6a]C[6a]2)2(NZnC)(CNN)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(NC[6a])(NZnC)	P(C[6a]C[6a]2)2(NZnC)(CNN)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(NC[6a])(NZnC)	107.4845	0.818	2	107.4845	0.669	2	107.4845	0.669	2	109.8816	7.690	5	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:Cl-1:	P(C[6a]C[6a]2)3(CClC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCO)(Cl)	P(C[6a]C[6a]2)3(CClC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCO)(Cl)	110.7090	2.797	3	110.7090	7.823	3	110.7090	7.823	3	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCH)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCH)(H)	110.4762	2.860	12	110.4762	8.179	12	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCN)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCN)(H)	111.9742	4.092	18	111.9742	16.744	18	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCO)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCO)(H)	110.8137	4.155	9	110.8137	17.268	9	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5]O)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5]O)(H)	111.4017	3.761	3	111.4017	14.142	3	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5a]O)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5a]O)(H)	111.9630	5.533	3	111.9630	30.617	3	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6a]O)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6a]O)(H)	111.7253	4.172	21	111.7253	17.402	21	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CHO)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CHO)(H)	110.2370	1.748	3	110.2370	3.057	3	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CIrC)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CIrC)(H)	109.7278	1.867	9	109.7278	3.484	9	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COO)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COO)(H)	112.7303	4.292	6	112.7303	18.420	6	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CReC)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CReC)(H)	111.1320	6.310	3	111.1320	39.811	3	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CRhC)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CRhC)(H)	110.5527	0.816	3	110.5527	0.666	3	111.2733	13.714	90	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(NC[6a]Al)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CC[6a]N)(H)	P(C[6a]C[6a]2)2(NC[6a]Al)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CC[6a]N)(H)	107.2248	2.031	6	107.2248	4.126	6	107.3893	3.379	10	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(NC[6a]Zn)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CC[6a]N)(H)	P(C[6a]C[6a]2)2(NC[6a]Zn)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CC[6a]N)(H)	107.3415	0.087	2	107.3415	0.008	2	107.3893	3.379	10	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(NC[6a]Zn)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CC[6a]O)(H)	P(C[6a]C[6a]2)2(NC[6a]Zn)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CC[6a]O)(H)	107.9305	3.003	2	107.9305	9.019	2	107.3893	3.379	10	110.8798	13.750	103	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(PC[6a]3)(CBC)(CC)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CBC)(CC)	110.4327	3.318	3	110.4327	11.009	3	111.0156	7.054	24	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCH)(COs)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCH)(COs)	110.4130	2.307	12	110.4130	5.322	12	111.0156	7.054	24	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCO)(CN)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCO)(CN)	111.8983	2.018	3	111.8983	4.073	3	111.0156	7.054	24	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6a]C)(CC)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6a]C)(CC)	112.3747	4.740	3	112.3747	22.468	3	111.0156	7.054	24	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-2:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COO)(CN)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COO)(CN)	111.7673	2.612	3	111.7673	6.824	3	111.0156	7.054	24	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:O-2:	P(C[6a]C[6a]2)3(CCO)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCH)(OFe)	P(C[6a]C[6a]2)3(CCO)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCH)(OFe)	110.0568	1.796	6	110.0568	3.227	6	110.0568	3.227	6	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:S-2:	P(C[6a]C[6a]2)3(CCS)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COO)(SC)	P(C[6a]C[6a]2)3(CCS)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COO)(SC)	111.7670	2.145	3	111.7670	4.599	3	111.7670	4.599	3	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-3:C-2:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(PCC)(CN)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(PCC)(CN)	112.2649	1.884	24	112.2649	3.548	24	112.2092	2.848	36	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-3:C-2:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(PC[6a]C)(CN)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(PC[6a]C)(CN)	112.0979	1.274	12	112.0979	1.623	12	112.2092	2.848	36	111.5877	4.752	69	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(PC[6a]3)(CCH)(CHH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCH)(CHH)	108.8877	2.087	3	108.8877	4.354	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCC)(CHH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCC)(CHH)	112.9640	11.535	3	112.9640	133.064	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCC)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCC)(COO)	108.3977	0.522	3	108.3977	0.272	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCH)(CHO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCH)(CHO)	110.2103	2.216	6	110.2103	4.912	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCN)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCN)(COO)	111.7225	2.149	6	111.7225	4.619	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCO)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCO)(COO)	111.9989	2.300	12	111.9989	5.291	12	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCO)2	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCO)2	110.9170	1.980	6	110.9170	3.920	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5]H)(COsH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5]H)(COsH)	110.5673	0.812	3	110.5673	0.659	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5]O)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5]O)(COO)	112.0150	1.111	6	112.0150	1.235	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5]O)(COsH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5]O)(COsH)	110.3413	1.479	6	110.3413	2.187	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[5a]H)(CRuH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[5a]H)(CRuH)	110.1020	1.646	3	110.1020	2.709	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6]H)(CRuH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6]H)(CRuH)	109.4973	2.707	3	109.4973	7.330	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6a]O)(CCO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6a]O)(CCO)	111.5738	2.378	6	111.5738	5.656	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6a]O)(CC[5]O)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6a]O)(CC[5]O)	111.4477	2.473	3	111.4477	6.118	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CIrH)(CCO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CIrH)(CCO)	110.6757	1.215	3	110.6757	1.477	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CNO)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CNO)(COO)	113.5020	2.652	3	113.5020	7.031	3	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COO)2	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COO)2	111.8172	2.607	15	111.8172	6.796	15	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COsC)(CCH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COsC)(CCH)	109.1337	1.653	6	109.1337	2.731	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COsH)(CCH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COsH)(CCH)	110.2015	2.152	48	110.2015	4.631	48	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COsH)(CCO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COsH)(CCO)	110.7831	2.402	15	110.7831	5.770	15	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CRuH)(CCH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CRuH)(CCH)	110.4712	2.595	6	110.4712	6.737	6	110.7824	6.697	165	110.7824	6.697	165	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:4:	C[6a]-3:C[6a]-3:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)2(CZrC)(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2C)(CZrC)(CH3)	P(C[6a]C[6a]2)2(CZrC)(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(CZrC)(CH3)	106.3305	4.716	2	106.3305	22.238	2	106.3305	22.238	2	109.3387	15.272	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6]H)(CRuCH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6]H)(CRuCH)	109.4685	1.208	6	109.4685	1.460	6	110.4053	10.901	9	109.3387	15.272	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CC[6]O)(CH3)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CC[6]O)(CH3)	112.2790	5.662	3	112.2790	32.055	3	110.4053	10.901	9	109.3387	15.272	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:3:4:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)2(NC[6a]Al)(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(CC[6a]Al)(CCHH)	P(C[6a]C[6a]2)2(NC[6a]Al)(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(CC[6a]Al)(CCHH)	107.5470	6.249	2	107.5470	39.055	2	107.5470	39.055	2	109.3387	15.272	13	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2Li)(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CHP)(CNO)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2Li)(PC[6a]2C)(H)	112.2850	7.036	2	112.2850	49.501	2	111.3640	10.791	6	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CNiP)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2Ni)(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CNiP)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2Ni)(PC[6a]2C)(H)	110.9035	0.798	4	110.9035	0.637	4	111.3640	10.791	6	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-3:N-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CHP)(NCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(CHP)(NCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	111.1065	2.303	2	111.1065	5.304	2	111.1065	5.304	2	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:H-1:	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCHH)(H)	P(C[6a]C[6a]2)3(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHH)(H)	113.6113	6.396	3	113.6113	40.905	3	113.6113	40.905	3	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Cl-1:	P(C[6a]C[6a]2)3(CClP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(Cl)	P(C[6a]C[6a]2)3(CClP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(Cl)	111.6438	3.407	6	111.6438	11.609	6	111.6438	11.609	6	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)3(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(H)	P(C[6a]C[6a]2)3(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(H)	112.2204	0.688	10	112.2204	0.473	10	112.2204	0.473	10	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]Al)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NC[6a]Al)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	110.0465	4.515	4	110.0465	20.383	4	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]Be)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NC[6a]Be)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	108.9712	2.343	4	108.9712	5.491	4	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]C)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NC[6a]C)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	110.2627	4.546	4	110.2627	20.663	4	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NC[6a]Cr)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NC[6a]Cr)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	109.0487	1.168	4	109.0487	1.365	4	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NFeC)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(PC[6a]2S)(H)	P(C[6a]C[6a]2)2(NFeC)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(PC[6a]2S)(H)	108.7850	0.533	8	108.7850	0.284	8	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(NSiZn)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(H)	P(C[6a]C[6a]2)2(NSiZn)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(H)	109.6795	5.428	4	109.6795	29.467	4	109.3684	9.011	28	110.6475	10.241	55	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	B-4:P-4:C-2:	P(C[6a]C[6a]2)3(CBC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(BC[6a]3)(PC[6a]3)(CO)	P(C[6a]C[6a]2)3(CBC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(BC[6a]3)(PC[6a]3)(CO)	110.8680	2.038	3	110.8680	4.153	3	110.8680	4.153	3	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6]AuC)(PC[6a]3)(CN)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6]AuC)(PC[6a]3)(CN)	111.4510	4.226	6	111.4510	17.856	6	112.0643	8.056	18	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(PAuCC)(CN)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(PAuCC)(CN)	112.4638	2.095	9	112.4638	4.390	9	112.0643	8.056	18	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]HW)(PC[6a]3)(CN)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]HW)(PC[6a]3)(CN)	112.0927	2.104	3	112.0927	4.426	3	112.0643	8.056	18	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:S-2:	P(C[6a]C[6a]2)3(CPS)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(SC[6a])	P(C[6a]C[6a]2)3(CPS)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(SC[6a])	112.8298	3.413	6	112.8298	11.648	6	112.8298	11.648	6	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-2:	P(C[6a]C[6a]2)2(NC[6a]H)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CN)	P(C[6a]C[6a]2)2(NC[6a]H)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CN)	111.5220	5.302	2	111.5220	28.110	2	111.5220	28.110	2	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:2:	C[6a]-3:C[6a]-3:S-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:I-2:	P(C[6a]C[6a]2)2(SLi2)(CIP)	C[6a](C[6a]C[6a]H)2(PC[6a]CS)	C(PC[6a]2S)2(ILi)	P(C[6a]C[6a]2)2(SLi2)(CIP)	C[6a](C[6a]C[6a]H)2(PC[6a]CS){1|C<3>,2|H<1>}	C(PC[6a]2S)2(ILi)	108.4545	3.327	2	108.4545	11.069	2	108.4545	11.069	2	111.8288	9.180	31	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[4,6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CCC)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2C)	C(PC[6a]3)(CCHH)(CBH)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CCC)	C[6a](C[4,6a]C[4,6a]2)(C[6a]C[6a]H)(PC[6a]2C){1|H<1>,3|C<3>}	C(PC[6a]3)(CCHH)(CBH)	106.2210	0.000	1	106.2210	0.000	1	106.2210	0.000	1	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(CC[5]HH)(PC[6a]3)(CBH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(CC[5]HH)(PC[6a]3)(CBH)	111.1473	5.100	3	111.1473	26.008	3	111.0113	10.853	6	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C-4:P-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(CC[6a]HO)(PC[6a]3)(COsH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(CC[6a]HO)(PC[6a]3)(COsH)	110.8753	1.034	3	110.8753	1.069	3	111.0113	10.853	6	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	C[5]-4:P-4:C-3:	P(C[6a]C[6a]2)3(CC[5]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(C[5]C[5,6]C[5]H)(PC[6a]3)(COsH)	P(C[6a]C[6a]2)3(CC[5]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(C[5]C[5,6]C[5]H)(PC[6a]3)(COsH)	110.4266	2.392	12	110.4266	5.720	12	110.4266	5.720	12	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CCC)	C[6a](C[6a]C[6a]C)2(PC[6a]2C)	C(PC[6a]3)(CCHH)(CBH)	P(C[6a]C[4,6a]C[6a])(C[6a]C[6a]2)2(CCC)	C[6a](C[6a]C[6a]C)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHH)(CBH)	109.3025	7.291	2	109.3025	53.158	2	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C)	C(PC[6a]3)(CCHH)(CBH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]C)(C[6a]C[6a]H)(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHH)(CBH)	109.9960	2.802	3	109.9960	7.850	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCHH)(CAlH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHH)(CAlH)	110.0157	0.913	3	110.0157	0.833	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCHH)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHH)(COO)	112.4383	4.586	3	112.4383	21.029	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCHO)(CIrH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHO)(CIrH)	110.9463	3.096	3	110.9463	9.582	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CCHO)(COsH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CCHO)(COsH)	111.0932	2.343	6	111.0932	5.489	6	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CFeHH)(CFeH)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CFeHH)(CFeH)	110.9577	0.964	3	110.9577	0.930	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CHHS)(CCC)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CHHS)(CCC)	110.6813	1.601	3	110.6813	2.563	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-3:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(COsCH)(COO)	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(COsCH)(COO)	111.9477	2.777	3	111.9477	7.713	3	110.9004	7.224	29	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:Ga-4:C-3:	P(C[6a]C[6a]2)3(CGaC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(GaCl3)(CNO)	P(C[6a]C[6a]2)3(CGaC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(GaCl3)(CNO)	111.8090	3.931	6	111.8090	15.450	6	111.7906	12.636	9	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:Ga-4:C-3:	P(C[6a]C[6a]2)3(CGaC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(GaCl3)(COO)	P(C[6a]C[6a]2)3(CGaC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(GaCl3)(COO)	111.7537	3.452	3	111.7537	11.916	3	111.7906	12.636	9	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:As-3:	P(C[6a]C[6a]2)3(CAsP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(AsCl2)	P(C[6a]C[6a]2)3(CAsP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(AsCl2)	112.5042	3.445	6	112.5042	11.866	6	112.5042	11.866	6	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(COO)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(COO)	113.2645	2.167	6	113.2645	4.697	6	112.9024	5.535	9	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(CSS)	P(C[6a]C[6a]2)3(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(CSS)	112.1783	3.036	3	112.1783	9.217	3	112.9024	5.535	9	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-3:	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(PCl2)	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(PCl2)	112.2222	2.133	12	112.2222	4.551	12	112.2222	4.551	12	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	Si[6]-4:P-4:C-3:	P(C[6a]C[6a]2)3(CSi[6]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(Si[6]N[6]2H)(PC[6a]3)(CCO)	P(C[6a]C[6a]2)3(CSi[6]C)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(Si[6]N[6]2H)(PC[6a]3)(CCO)	114.2632	6.117	6	114.2632	37.413	6	114.2632	37.413	6	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(NAlSi)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CNN)	P(C[6a]C[6a]2)2(NAlSi)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CNN)	110.8620	3.236	4	110.8620	10.472	4	110.4326	8.808	8	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(NSiH)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)2(CC[6a]O)	P(C[6a]C[6a]2)2(NSiH)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)2(CC[6a]O)	111.8035	2.238	2	111.8035	5.009	2	110.4326	8.808	8	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:3:	C[6a]-3:C[6a]-3:N-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:C-3:	P(C[6a]C[6a]2)2(NSiSn)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN)	C(PC[6a]2N)(PC[6a]2S)(CNO)	P(C[6a]C[6a]2)2(NSiSn)(CCP)	C[6a](C[6a]C[6a]H)2(PC[6a]CN){1|C<3>,2|H<1>}	C(PC[6a]2N)(PC[6a]2S)(CNO)	108.2030	3.285	2	108.2030	10.793	2	110.4326	8.808	8	111.4948	9.920	98	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-4:C-4:	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)(CH3)2	P(C[6a]C[6a]2)3(CCC)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)(CH3)2	114.4238	5.998	6	114.4238	35.972	6	114.4238	35.972	6	113.4539	11.108	36	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Ga-4:	P(C[6a]C[6a]2)3(CGaP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(GaC3)	P(C[6a]C[6a]2)3(CGaP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(GaC3)	114.6433	2.637	6	114.6433	6.953	6	114.1282	5.366	12	113.4539	11.108	36	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:Ga-4:	P(C[6a]C[6a]2)3(CGaP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]3)2(GaCl3)	P(C[6a]C[6a]2)3(CGaP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]3)2(GaCl3)	113.6130	2.053	6	113.6130	4.215	6	114.1282	5.366	12	113.4539	11.108	36	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-4:	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]2C)(PC[6a]3)2	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]2C)(PC[6a]3)2	112.6897	4.108	6	112.6897	16.879	6	112.6810	7.531	18	113.4539	11.108	36	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	4:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:P-4:	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]2O)(PC[6a]3)2	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]2O)(PC[6a]3)2	112.6767	1.992	12	112.6767	3.967	12	112.6810	7.531	18	113.4539	11.108	36	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	3:3:4:	5:4:4:	C[6a]-3:C[6a]-3:C[6a]-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-5:P-4:P-4:	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C)	C(PC[6a]2FF)(PC[6a]3)2	P(C[6a]C[6a]2)3(CPP)	C[6a](C[6a]C[6a]H)2(PC[6a]2C){1|C<3>,2|H<1>}	C(PC[6a]2FF)(PC[6a]3)2	112.6220	2.950	6	112.6220	8.705	6	112.6220	8.705	6	112.6220	8.705	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:3:	4:3:3:	4:4:4:	C[6a]-3:C[6a]-3:N[6]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	P-4:P-4:Ga-4:	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2	C(PC[6a]2N[6])2(GaCl3)	P(C[6a]C[6a]2)2(N[6]C[6]2)(CGaP)	C[6a](PC[6a]N[6]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C(PC[6a]2N[6])2(GaCl3)	112.9853	3.221	4	112.9853	10.377	4	112.9853	10.377	4	112.9853	10.377	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:4:	3:3:4:	3:4:2:	C[6a]-3:C[6a]-3:C-3:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:N-2:	P(C[6a]C[6a]2)2(CC[6a]N)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(C[6a]C[6a]2)(PC[6a]2C)(NO)	P(C[6a]C[6a]2)2(CC[6a]N)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2C)(NO)	110.2920	5.952	2	110.2920	35.431	2	110.2920	35.431	2	110.2920	35.431	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:3:4:	3:3:4:	3:4:3:	C[6a]-3:C[6a]-3:C-3:C-4:	C[6a]-3:C[6a]-3:P-4:	C[6a]-3:P-4:C-3:	P(C[6a]C[6a]2)2(CC[6a]C)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(C[6a]C[6a]2)(PC[6a]2C)(CBH)	P(C[6a]C[6a]2)2(CC[6a]C)(CCHH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(C[6a]C[6a]2)(PC[6a]2C)(CBH)	112.6805	1.510	2	112.6805	2.279	2	112.6805	2.279	2	112.6805	2.279	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:2:1:	C[6a]-3:C[6a]-3:B-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:S-2:S-1:	P(C[6a]C[6a]2)2(BH3)(CSS)	C[6a](C[6a]C[6a]H)2(PC[6a]BC)	C(PC[6a]2B)(SC)(S)	P(C[6a]C[6a]2)2(BH3)(CSS)	C[6a](C[6a]C[6a]H)2(PC[6a]BC){1|C<3>,2|H<1>}	C(PC[6a]2B)(SC)(S)	106.4585	1.477	2	106.4585	2.182	2	106.4585	2.182	2	106.7203	52.076	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:2:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-1:	P(C[6a]C[6a]2)2(CCHH)(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]CC)	C(PC[6a]2C)(OB)(O)	P(C[6a]C[6a]2)2(CCHH)(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(OB)(O)	106.4820	12.035	2	106.4820	144.840	2	106.8512	85.998	4	106.7203	52.076	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:2:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-1:	P(C[6a]C[6a]2)2(CCHH)(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]CC)	C(PC[6a]2C)(OZr)(O)	P(C[6a]C[6a]2)2(CCHH)(COO)	C[6a](C[6a]C[6a]C)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(OZr)(O)	107.2203	10.612	2	107.2203	112.610	2	106.8512	85.998	4	106.7203	52.076	6	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:B-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:F-1:	P(C[6a]C[6a]2)2(BH3)(CCF)	C[6a](C[6a]C[6a]H)2(PC[6a]BC)	C(PC[6a]2B)(CC[6a]H)(F)	P(C[6a]C[6a]2)2(BH3)(CCF)	C[6a](C[6a]C[6a]H)2(PC[6a]BC){1|C<3>,2|H<1>}	C(PC[6a]2B)(CC[6a]H)(F)	104.5990	0.672	6	104.5990	0.451	6	104.5990	0.451	6	106.9084	12.676	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:F-1:	P(C[6a]C[6a]2)2(CH3)(CCF)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2C)(CCH)(F)	P(C[6a]C[6a]2)2(CH3)(CCF)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(CCH)(F)	107.7415	1.805	2	107.7415	3.259	2	107.7415	3.259	2	106.9084	12.676	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:3:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)2(CClHH)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2C)(CC[6a]C)(H)	P(C[6a]C[6a]2)2(CClHH)(CCH)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2C)(CC[6a]C)(H)	113.0035	0.940	2	113.0035	0.883	2	113.0035	0.883	2	106.9084	12.676	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:3:2:	C[6a]-3:C[6a]-3:B-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:N-2:	P(C[6a]C[6a]2)2(BH3)(CNN)	C[6a](C[6a]C[6a]H)2(PC[6a]BC)	C(PC[6a]2B)(NC[6]H)(NC[6])	P(C[6a]C[6a]2)2(BH3)(CNN)	C[6a](C[6a]C[6a]H)2(PC[6a]BC){1|C<3>,2|H<1>}	C(PC[6a]2B)(NC[6]H)(NC[6])	103.8425	0.798	2	103.8425	0.637	2	103.8425	0.637	2	103.8425	0.637	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:B-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(BH3)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]BC)	C(PC[6a]2B)2(H)	P(C[6a]C[6a]2)2(BH3)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]BC){1|C<3>,2|H<1>}	C(PC[6a]2B)2(H)	108.1192	3.317	4	108.1192	11.002	4	108.1192	11.002	4	110.8247	14.312	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CIrHN)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2Ir)(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CIrHN)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2Ir)(PC[6a]2C)(H)	113.6215	1.993	2	113.6215	3.973	2	113.5302	2.874	4	110.8247	14.312	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(CPdCH)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC)	C(PC[6a]2Pd)(PC[6a]2C)(H)	P(C[6a]C[6a]2)2(CPdCH)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]CC){1|C<3>,2|H<1>}	C(PC[6a]2Pd)(PC[6a]2C)(H)	113.4390	2.148	2	113.4390	4.615	2	113.5302	2.874	4	110.8247	14.312	8	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:4:3:	4:3:3:	3:4:1:	C[6a]-3:C[6a]-3:C[6]-4:C-3:	P-4:C[6a]-3:C[6a]-3:	C[5]-3:P-4:H-1:	P(C[6a]C[6a]2)2(C[6]C[6]2H)(CC[5]H)	C[6a](PC[6a]C[6]C)(C[6a]C[6a]H)2	C(C[5]N[5]P[5])(PC[6a]2C[6])(H)	P(C[6a]C[6a]2)2(C[6]C[6]2H)(CC[5]H)	C[6a](PC[6a]C[6]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C(C[5]N[5]P[5])(PC[6a]2C[6])(H)	112.8435	3.326	2	112.8435	11.059	2	112.8435	11.059	2	112.8435	11.059	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:3:5:3:	3:3:4:	4:4:1:	C[6a]-3:C[6a]-3:B-5:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-4:H-1:	P(C[6a]C[6a]2)2(BLiH3)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]BC)	C(PC[6a]2B)(PLiCC)(H)	P(C[6a]C[6a]2)2(BLiH3)(CHP)	C[6a](C[6a]C[6a]H)2(PC[6a]BC){1|C<3>,2|H<1>}	C(PC[6a]2B)(PLiCC)(H)	110.9665	1.152	2	110.9665	1.327	2	110.9665	1.327	2	110.9665	1.327	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:1:	3:3:4:	4:2:1:	C[6a]-3:C[6]-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-2:H-1:	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO)	C(PC[6a]C[6]O)(CC)(H)	P(C[6a]C[6a]2)(C[6]C[6]2H)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PC[6]CO){1|C<3>,2|H<1>}	C(PC[6a]C[6]O)(CC)(H)	103.8460	0.573	2	103.8460	0.328	2	103.8460	0.328	2	103.8460	0.328	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:1:	3:3:4:	4:3:1:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CC3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CHH)(H)	P(C[6a]C[6a]2)(CC3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CHH)(H)	106.2410	0.000	1	106.2410	0.000	1	106.3792	2.018	10	106.3792	2.018	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:1:	3:3:4:	4:3:1:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CCHH)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CHH)(H)	P(C[6a]C[6a]2)(CCHH)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CHH)(H)	106.7350	0.000	1	106.7350	0.000	1	106.3792	2.018	10	106.3792	2.018	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:1:	3:3:4:	4:3:1:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CHH)(H)	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CHH)(H)	105.2442	1.269	4	105.2442	1.611	4	106.3792	2.018	10	106.3792	2.018	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:1:	3:3:4:	4:3:1:	C[6a]-3:C-4:C-3:O-1:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO)	C(PC[6a]CO)(CHP)(H)	P(C[6a]C[6a]2)(CH3)(CCH)(O)	C[6a](C[6a]C[6a]H)2(PCCO){1|C<3>,2|H<1>}	C(PC[6a]CO)(CHP)(H)	107.4597	1.059	4	107.4597	1.121	4	106.3792	2.018	10	106.3792	2.018	10	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:3:	3:3:4:	4:2:1:	C[6a]-3:C-4:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-1:	P(C[6a]C[6a]2)(CCHH)(CAlC)(COO)	C[6a](C[6a]C[6a]H)2(PC3)	C(PC[6a]CC)(OAl)(O)	P(C[6a]C[6a]2)(CCHH)(CAlC)(COO)	C[6a](C[6a]C[6a]H)2(PC3){1|C<3>,2|H<1>}	C(PC[6a]CC)(OAl)(O)	105.8130	0.000	1	105.8130	0.000	1	105.8130	0.000	1	105.8130	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:3:	3:3:4:	4:3:1:	C[6a]-3:B-4:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:H-1:	P(C[6a]C[6a]2)(BC[6a]HH)(CCH)2	C[6a](C[6a]C[6a]C)2(PBCC)	C(PC[6a]BC)(CHH)(H)	P(C[6a]C[6a]2)(BC[6a]HH)(CCH)2	C[6a](C[6a]C[6a]C)2(PBCC){1|C<3>,2|H<1>}	C(PC[6a]BC)(CHH)(H)	106.7970	1.363	2	106.7970	1.859	2	106.7970	1.859	2	105.7945	2.038	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:3:	3:3:4:	4:3:1:	C[6a]-3:C-4:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:N-3:O-1:	P(C[6a]C[6a]2)(CCHH)(CAlC)(CNO)	C[6a](C[6a]C[6a]H)2(PC3)	C(PC[6a]CC)(NC[6a]Al)(O)	P(C[6a]C[6a]2)(CCHH)(CAlC)(CNO)	C[6a](C[6a]C[6a]H)2(PC3){1|C<3>,2|H<1>}	C(PC[6a]CC)(NC[6a]Al)(O)	104.7920	0.485	2	104.7920	0.235	2	104.7920	0.235	2	105.7945	2.038	4	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:3:3:	3:3:4:	4:3:3:	C[6a]-3:C-4:C-3:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:P-3:C-3:	P(C[6a]C[6a]2)(CCHH)(CAlC)(CCP)	C[6a](C[6a]C[6a]H)2(PC3)	C(PC[6a]CC)(PC[6a]Al)(CCH)	P(C[6a]C[6a]2)(CCHH)(CAlC)(CCP)	C[6a](C[6a]C[6a]H)2(PC3){1|C<3>,2|H<1>}	C(PC[6a]CC)(PC[6a]Al)(CCH)	109.5185	0.340	2	109.5185	0.116	2	109.5185	0.116	2	109.5185	0.116	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:4:3:	3:3:4:	4:2:1:	C[6a]-3:C[6]-4:C[6]-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:O-2:O-1:	P(C[6a]C[6a]2)(C[6]C[6]2H)2(COO)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]2C)	C(PC[6a]C[6]2)(OB)(O)	P(C[6a]C[6a]2)(C[6]C[6]2H)2(COO)	C[6a](C[6a]C[6a]2)(C[6a]C[6a]H)(PC[6]2C){2|H<1>,3|C<3>}	C(PC[6a]C[6]2)(OB)(O)	101.4460	0.000	1	101.4460	0.000	1	101.4460	0.000	1	101.4460	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	3:4:4:3:	3:3:4:	4:3:4:	C[6a]-3:B-4:C-4:C-3:	C[6a]-3:C[6a]-3:P-4:	P-4:C-3:C-4:	P(C[6a]C[6a]2)(BH3)(CH3)(CCC)	C[6a](C[6a]C[6a]H)2(PBCC)	C(PC[6a]BC)(CC[6a]2)(CH3)	P(C[6a]C[6a]2)(BH3)(CH3)(CCC)	C[6a](C[6a]C[6a]H)2(PBCC){1|C<3>,2|H<1>}	C(PC[6a]BC)(CC[6a]2)(CH3)	101.8980	0.000	1	101.8980	0.000	1	101.8980	0.000	1	101.8980	0.000	1	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	4:3:3:3:	4:3:3:	4:4:1:	Ge[5,5]-4:C[6a]-3:C[6a]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	P-4:P-4:Ge-1:	P(Ge[5,5]Ge[5,5]C[5]2)(C[6a]C[6a]2)2(CGeP)	C[6a](PGe[5,5]C[6a]C)(C[6a]C[6a]H)2	C(PGe[5,5]C[6a]2)(PC[6a]2N)(Ge)	P(Ge[5,5]Ge[5,5]C[5]2)(C[6a]C[6a]2)2(CGeP)	C[6a](PGe[5,5]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C(PGe[5,5]C[6a]2)(PC[6a]2N)(Ge)	116.2720	1.059	2	116.2720	1.122	2	116.2720	1.122	2	116.2720	1.122	2	109.7333	15.652	1139	109.7333	15.652	1139
992	643	930	0:SP3_SP2_SP2	P	C[6a]	C	5:3:3:3:	4:3:3:	4:3:3:	C[3x3,4,3x5,14x6]-5:C[6a]-3:C[6a]-3:C-3:	P-4:C[6a]-3:C[6a]-3:	P-4:C[6a]-3:C-3:	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(CC[6a]C)	C[6a](PC[3x3,4,3x5,14x6]C[6a]C)(C[6a]C[6a]H)2	C(PC[3x3,4,3x5,14x6]C[6a]2)(C[6a]C[6a]2)(CBH)	P(C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6a]C[6a]2)2(CC[6a]C)	C[6a](PC[3x3,4,3x5,14x6]C[6a]C)(C[6a]C[6a]H)2{1|C<3>,2|H<1>}	C(PC[3x3,4,3x5,14x6]C[6a]2)(C[6a]C[6a]2)(CBH)	110.0770	1.024	4	110.0770	1.048	4	110.0770	1.048	4	110.0770	1.048	4	109.7333	15.652	1139	109.7333	15.652	1139