@<TRIPOS>MOLECULE
DB03343
13 12 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.7940    -2.3605    -0.0905	O.2	1	noname	-0.4725
2	C1     1.8956    -1.1506     0.2069	C.2	1	noname	-0.0592
3	O2     2.8873    -0.7374     1.0243	O.3	1	noname	-0.4725
4	C2     0.9418    -0.1844    -0.3299	C.3	1	noname	0.1089
5	O3     1.6350     0.7893    -1.0966	O.3	1	noname	-0.3971
6	C3     0.2559     0.4577     0.7481	C.2	1	noname	-0.2063
7	C4    -0.6659     1.3819     0.4933	C.2	1	noname	-0.1554
8	O4    -0.9476     1.7066    -0.7548	O.3	1	noname	-0.3468
9	O5    -1.2991     1.9746     1.4884	O.3	1	noname	-0.4973
10	H1     0.2127    -0.6770    -0.9733	H	1	noname	0.0543
11	H2     2.0747     1.4068    -0.5075	H	1	noname	0.2092
12	H3     0.4418     0.2352     1.7988	H	1	noname	0.0304
13	H4    -1.0649     0.9080    -1.2745	H	1	noname	0.2045
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	2
7	7	8	1
8	7	9	1
9	4	10	1
10	5	11	1
11	6	12	1
12	8	13	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
