@<TRIPOS>MOLECULE
DB02637
12 11 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.6967    -1.9467     0.5228	O.2	1	noname	-0.2346
2	C1     1.8955    -1.2913    -0.5228	C.2	1	noname	0.1651
3	O2     2.2811    -1.9225    -1.6521	O.3	1	noname	-0.2016
4	C2     1.7195     0.0875    -0.5228	C.2	1	noname	0.2110
5	O3     1.9183     0.7430     0.5228	O.2	1	noname	-0.2587
6	C3     1.3024     0.7702    -1.7441	C.3	1	noname	0.0547
7	C4     1.1892     2.2028    -1.4864	C.2	1	noname	-0.0673
8	O4     0.8424     2.9774    -2.4042	O.2	1	noname	-0.4789
9	O5     1.4590     2.6909    -0.2570	O.3	1	noname	-0.4789
10	H1     2.2358    -2.8722    -1.5193	H	1	noname	0.2217
11	H2     2.1087     0.6432    -2.4666	H	1	noname	0.0338
12	H3     0.2998     0.4123    -1.9779	H	1	noname	0.0338
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	6	7	1
7	7	8	2
8	7	9	1
9	3	10	1
10	6	11	1
11	6	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1