@<TRIPOS>MOLECULE
DB02734
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.0972    -0.9989    -0.6766	O.2	1	noname	-0.2457
2	C1    -1.2756    -0.2842    -1.2904	C.2	1	noname	0.1212
3	O2    -1.6059     0.2495    -2.4857	O.3	1	noname	-0.2091
4	C2    -0.0491    -0.0443    -0.7542	C.2	1	noname	0.0720
5	O3     0.4936    -0.9989     0.0458	O.3	1	noname	-0.2275
6	C3     0.5523     1.1269    -1.0503	C.2	1	noname	0.0429
7	C4     1.4987    -0.5315     0.9909	C.3	1	noname	0.1897
8	C5     1.8688     1.4623    -0.4949	C.3	1	noname	0.1061
9	O4     2.1156    -1.6473     1.6162	O.3	1	noname	-0.3653
10	C6     2.5858     0.3642     0.3432	C.3	1	noname	0.1346
11	O5     2.7269     1.8959    -1.5399	O.3	1	noname	-0.3859
12	O6     3.4024    -0.4244    -0.5098	O.3	1	noname	-0.3846
13	H1    -1.7795    -0.4554    -3.1139	H	1	noname	0.2217
14	H2    -0.0080     1.7818    -1.7175	H	1	noname	0.0633
15	H3     0.9457     0.0125     1.7566	H	1	noname	0.0954
16	H4     1.6492     2.3114     0.1524	H	1	noname	0.0676
17	H5     2.0617    -1.5499     2.5697	H	1	noname	0.2134
18	H6     3.2796     0.7760     1.0761	H	1	noname	0.0685
19	H7     3.0957     1.1318    -1.9890	H	1	noname	0.2110
20	H8     3.9775    -0.9799     0.0216	H	1	noname	0.2108
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	2
6	5	7	1
7	6	8	1
8	7	9	1
9	7	10	1
10	8	11	1
11	8	10	1
12	10	12	1
13	3	13	1
14	6	14	1
15	7	15	1
16	8	16	1
17	9	17	1
18	10	18	1
19	11	19	1
20	12	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1