@<TRIPOS>MOLECULE
71586998
21 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.5391     3.2516    -1.9366	Cl	1	noname	-0.1134
2	S1     1.7791    -1.2574    -0.6841	S	1	noname	0.0239
3	S2     2.5123     0.3529    -1.7584	S.3	1	noname	0.0702
4	O1     0.1972    -1.3180    -0.8334	O.2	1	noname	-0.1811
5	O2     2.1605    -1.0888     0.8502	O.2	1	noname	-0.1811
6	C1     3.7954    -3.0840    -0.5621	C.3	1	noname	-0.0363
7	C2     2.5003    -2.7800    -1.3178	C.3	1	noname	0.0673
8	C3     4.4085    -4.3782    -1.1008	C.3	1	noname	-0.0549
9	C4     5.7036    -4.6822    -0.3450	C.3	1	noname	-0.0653
10	C5     1.9167     1.8848    -1.0248	C.3	1	noname	0.0856
11	H1     3.5779    -3.1995     0.4998	H	1	noname	0.0279
12	H2     4.4988    -2.2632    -0.7017	H	1	noname	0.0279
13	H3     1.7969    -3.6009    -1.1782	H	1	noname	0.0472
14	H4     2.7178    -2.6645    -2.3797	H	1	noname	0.0472
15	H5     3.7051    -5.1990    -0.9612	H	1	noname	0.0264
16	H6     4.6260    -4.2627    -2.1626	H	1	noname	0.0264
17	H7     6.1403    -5.6042    -0.7288	H	1	noname	0.0230
18	H8     5.4860    -4.7977     0.7168	H	1	noname	0.0230
19	H9     6.4070    -3.8613    -0.4846	H	1	noname	0.0230
20	H10     0.8270     1.8989    -1.0474	H	1	noname	0.0564
21	H11     2.2595     1.9506     0.0078	H	1	noname	0.0564
@<TRIPOS>BOND
1	1	10	1
2	2	3	1
3	2	4	2
4	2	5	2
5	2	7	1
6	3	10	1
7	6	7	1
8	6	8	1
9	6	11	1
10	6	12	1
11	7	13	1
12	7	14	1
13	8	9	1
14	8	15	1
15	8	16	1
16	9	17	1
17	9	18	1
18	9	19	1
19	10	20	1
20	10	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1