@<TRIPOS>MOLECULE
71587657
12 11 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.7764    -0.0154    -0.6119	S.2	1	noname	0.1802
2	O1    -0.6024     0.3156     0.4800	O.3	1	noname	-0.3737
3	O2     1.9906    -1.5253     0.1165	O.3	1	noname	-0.2186
4	O3     2.4352     1.1101     0.2977	O.2	1	noname	-0.2559
5	O4    -1.4131     2.0841    -1.6677	O.3	1	noname	-0.2078
6	O5     0.8265     2.3097    -1.7427	O.2	1	noname	-0.2416
7	C1     0.0171     0.3170    -0.7977	C.3	1	noname	0.2254
8	C2    -0.1679     1.6213    -1.4269	C.2	1	noname	0.1551
9	H1    -0.4345    -0.4546    -1.4213	H	1	noname	0.0823
10	H2    -0.4782    -0.5599     0.9024	H	1	noname	0.2118
11	H3     1.5630    -1.5262     0.9983	H	1	noname	0.2214
12	H4    -1.5869     3.0485    -1.6627	H	1	noname	0.2214
@<TRIPOS>BOND
1	1	3	1
2	1	4	2
3	1	7	1
4	2	7	1
5	2	10	1
6	3	11	1
7	5	8	1
8	5	12	1
9	6	8	2
10	7	8	1
11	7	9	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1