@<TRIPOS>MOLECULE
76970223
17 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1    -1.8162     2.4381     3.0172	Br	1	noname	-0.0478
2	Br2     1.5392     3.3861    -1.3954	Br	1	noname	-0.0478
3	S1    -1.0437    -1.4512    -0.8149	S	1	noname	-0.0471
4	O1    -2.3932    -1.4050    -1.8312	O.3	1	noname	-0.1486
5	O2     0.0745     3.9391     1.1936	O.3	1	noname	-0.2687
6	O3    -1.3351    -2.4231     0.4093	O.2	1	noname	-0.1688
7	O4     0.2140    -1.9853    -1.6279	O.2	1	noname	-0.1688
8	C1    -0.7135     0.1401    -0.2219	C.2	1	noname	0.0278
9	C2     0.1373     0.9824    -0.9282	C.2	1	noname	0.0606
10	C3    -1.2991     0.5765     0.9607	C.2	1	noname	0.0606
11	C4    -1.0339     1.8551     1.4372	C.2	1	noname	0.0391
12	C5     0.4025     2.2610    -0.4518	C.2	1	noname	0.0391
13	C6    -0.1831     2.6973     0.7309	C.2	1	noname	0.0829
14	H1     0.5670     0.6622    -1.7961	H	1	noname	0.0652
15	H2    -1.9235    -0.0415     1.4790	H	1	noname	0.0652
16	H3    -0.4144     4.0838     2.0305	H	1	noname	0.2182
17	H4    -3.1609    -1.0466    -1.3386	H	1	noname	0.2388
@<TRIPOS>BOND
1	1	11	1
2	2	12	1
3	3	4	1
4	3	6	2
5	3	7	2
6	3	8	1
7	4	17	1
8	5	13	1
9	5	16	1
10	8	9	2
11	8	10	1
12	9	12	1
13	9	14	1
14	10	11	2
15	10	15	1
16	11	13	1
17	12	13	2
@<TRIPOS>SUBSTRUCTURE
1	noname	1