@<TRIPOS>MOLECULE
DB03120
19 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1    -0.6907    -1.4772    -0.0379	S	1	noname	-0.0485
2	O1    -0.1271    -2.7586     0.7160	O.2	1	noname	-0.1689
3	O2    -1.4682    -1.9324    -1.3481	O.2	1	noname	-0.1689
4	O3    -1.7477    -0.6424     0.9829	O.3	1	noname	-0.1487
5	C1     0.6239    -0.4422    -0.4778	C.2	1	noname	0.0149
6	C2     1.0514     0.5487     0.3982	C.2	1	noname	0.0201
7	C3     1.2526    -0.6016    -1.7072	C.2	1	noname	0.0201
8	C4     2.1077     1.3802     0.0448	C.2	1	noname	-0.0392
9	C5     2.3089     0.2300    -2.0606	C.2	1	noname	-0.0392
10	C6     2.7365     1.2209    -1.1846	C.2	1	noname	-0.0206
11	C7     3.8459     2.0943    -1.5558	C.3	1	noname	0.0033
12	H1    -1.5188    -0.8232     1.8975	H	1	noname	0.2388
13	H2     0.5584     0.6737     1.3623	H	1	noname	0.0639
14	H3     0.9174    -1.3787    -2.3941	H	1	noname	0.0639
15	H4     2.4430     2.1573     0.7318	H	1	noname	0.0625
16	H5     2.8019     0.1050    -3.0246	H	1	noname	0.0625
17	H6     4.3273     2.4733    -0.6542	H	1	noname	0.0279
18	H7     4.5699     1.5316    -2.1451	H	1	noname	0.0279
19	H8     3.4689     2.9302    -2.1451	H	1	noname	0.0279
@<TRIPOS>BOND
1	1	2	2
2	1	3	2
3	1	4	1
4	1	5	1
5	5	6	2
6	5	7	1
7	6	8	1
8	7	9	2
9	8	10	2
10	9	10	1
11	10	11	1
12	4	12	1
13	6	13	1
14	7	14	1
15	8	15	1
16	9	16	1
17	11	17	1
18	11	18	1
19	11	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1