@<TRIPOS>MOLECULE
86278308
36 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -2.8344     1.3858     1.2845	Cl	1	noname	-0.0726
2	Cl2    -8.0177    -0.3319     0.0465	Cl	1	noname	-0.0726
3	S1    -6.2953     2.4553    -4.2633	S.2	1	noname	0.1519
4	F1    -5.1983    -1.5612     5.0432	F	1	noname	-0.1661
5	F2    -5.8495     0.5324     5.5770	F	1	noname	-0.1661
6	F3    -7.3313    -1.0135     5.0467	F	1	noname	-0.1661
7	O1    -7.7983     2.8020    -3.8417	O.2	1	noname	-0.3034
8	O2    -1.8829     1.5548    -2.9192	O.2	1	noname	-0.2835
9	N1    -5.2862     1.0862    -0.6770	N.3	1	noname	0.0223
10	N2    -4.1571     0.9450    -1.2760	N.2	1	noname	-0.2855
11	N3    -7.3845     2.1497    -1.1790	N.3	1	noname	-0.1228
12	N4    -3.3045     1.6720    -4.6325	N.3	1	noname	-0.0762
13	C1    -5.5317     1.8637    -2.7604	C.2	1	noname	0.0455
14	C2    -6.1520     1.7032    -1.5145	C.2	1	noname	0.0143
15	C3    -5.4629     0.6693     0.6226	C.2	1	noname	0.0500
16	C4    -4.2049     1.4764    -2.5083	C.2	1	noname	0.0800
17	C5    -4.3994     0.7812     1.5860	C.2	1	noname	0.0192
18	C6    -6.7016     0.0971     1.0481	C.2	1	noname	0.0192
19	C7    -6.5353     1.1292    -5.5532	C.3	1	noname	0.0081
20	C8    -5.8583    -0.1163     3.3407	C.2	1	noname	-0.0122
21	C9    -4.6058     0.3794     2.9168	C.2	1	noname	0.0090
22	C10    -6.8978    -0.2297     2.3988	C.2	1	noname	0.0090
23	C11    -3.0707     1.5639    -3.3276	C.2	1	noname	0.0513
24	C12    -5.3640     0.5921    -6.3812	C.3	1	noname	-0.0581
25	C13    -6.0698    -0.5406     4.7501	C.3	1	noname	0.4162
26	H1    -7.3507     1.4129    -6.2186	H	1	noname	0.0347
27	H2    -6.9017     0.2655    -4.9982	H	1	noname	0.0347
28	H3    -3.8264     0.4424     3.5841	H	1	noname	0.0645
29	H4    -7.8141    -0.5670     2.7006	H	1	noname	0.0645
30	H5    -7.5537     1.9595    -0.2430	H	1	noname	0.1256
31	H6    -8.0501     1.7029    -1.7252	H	1	noname	0.1256
32	H7    -5.7258    -0.1713    -7.0700	H	1	noname	0.0235
33	H8    -4.9145     1.4082    -6.9470	H	1	noname	0.0235
34	H9    -4.6180     0.1572    -5.7160	H	1	noname	0.0235
35	H10    -2.7209     1.2623    -5.2813	H	1	noname	0.1275
36	H11    -4.1478     2.0360    -4.9436	H	1	noname	0.1275
@<TRIPOS>BOND
1	1	17	1
2	2	18	1
3	3	7	2
4	3	13	1
5	3	19	1
6	4	25	1
7	5	25	1
8	6	25	1
9	8	23	2
10	9	10	1
11	9	14	1
12	9	15	1
13	10	16	2
14	11	14	1
15	11	30	1
16	11	31	1
17	12	23	1
18	12	35	1
19	12	36	1
20	13	14	2
21	13	16	1
22	15	17	2
23	15	18	1
24	16	23	1
25	17	21	1
26	18	22	2
27	19	24	1
28	19	26	1
29	19	27	1
30	20	21	2
31	20	22	1
32	20	25	1
33	21	28	1
34	22	29	1
35	24	32	1
36	24	33	1
37	24	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1