@<TRIPOS>MOLECULE
76963929
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.4398    -1.4905     0.5654	S.3	1	noname	-0.0822
2	S2    -0.5359    -1.0176     1.1857	S.3	1	noname	-0.0822
3	O1     0.1477     1.0029    -1.9421	O.2	1	noname	-0.2896
4	C1     1.7798     0.0633    -0.3424	C.3	1	noname	0.0721
5	C2    -0.6303     0.6221     0.3623	C.3	1	noname	0.0721
6	C3     0.3990     0.6113    -0.7819	C.2	1	noname	0.1521
7	C4     2.6243    -0.2438    -1.5807	C.3	1	noname	-0.0454
8	C5    -0.2661     1.7183     1.3656	C.3	1	noname	-0.0454
9	H1     2.2406     0.7767     0.3409	H	1	noname	0.0504
10	H2    -1.6363     0.8447     0.0065	H	1	noname	0.0504
11	H3     2.8267     0.6810    -2.1209	H	1	noname	0.0246
12	H4     2.0818    -0.9320    -2.2289	H	1	noname	0.0246
13	H5     3.5661    -0.6992    -1.2744	H	1	noname	0.0246
14	H6    -0.3221     2.6911     0.8772	H	1	noname	0.0246
15	H7    -0.9639     1.6912     2.2026	H	1	noname	0.0246
16	H8     0.7472     1.5535     1.7319	H	1	noname	0.0246
@<TRIPOS>BOND
1	1	2	1
2	1	4	1
3	2	5	1
4	3	6	2
5	4	6	1
6	4	7	1
7	4	9	1
8	5	6	1
9	5	8	1
10	5	10	1
11	7	11	1
12	7	12	1
13	7	13	1
14	8	14	1
15	8	15	1
16	8	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1