@<TRIPOS>MOLECULE
DB03675
22 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.4403    -1.3701    -2.4548	O.2	1	noname	-0.2442
2	C1     0.3791    -1.0438    -1.8806	C.2	1	noname	0.1514
3	O2    -0.5465    -0.3126    -2.5372	O.3	1	noname	-0.2098
4	C2     0.1405    -1.4535    -0.4997	C.3	1	noname	0.1676
5	O3    -1.0331    -2.2506    -0.4385	O.3	1	noname	-0.3796
6	C3    -0.0398    -0.2123     0.3766	C.3	1	noname	0.0972
7	O4    -1.1487     0.5409    -0.0920	O.3	1	noname	-0.3868
8	C4     1.2246     0.6466     0.3107	C.3	1	noname	-0.0241
9	C5    -0.2899    -0.6416     1.8237	C.3	1	noname	-0.0330
10	C6     1.0443     1.8878     1.1870	C.3	1	noname	-0.0625
11	H1    -1.1113     0.1336    -1.9021	H	1	noname	0.2214
12	H2     0.9658    -2.0853    -0.1715	H	1	noname	0.0741
13	H3    -1.2653    -2.4084     0.4795	H	1	noname	0.2113
14	H4    -1.6456     0.8785     0.6568	H	1	noname	0.2109
15	H5     2.0272     0.0598     0.7575	H	1	noname	0.0294
16	H6     1.3134     0.9975    -0.7174	H	1	noname	0.0294
17	H7    -0.3002    -1.7300     1.8832	H	1	noname	0.0261
18	H8     0.5032    -0.2504     2.4610	H	1	noname	0.0261
19	H9    -1.2508    -0.2504     2.1579	H	1	noname	0.0261
20	H10     1.0861     1.6000     2.2375	H	1	noname	0.0231
21	H11     1.8399     2.6017     0.9739	H	1	noname	0.0231
22	H12     0.0784     2.3458     0.9739	H	1	noname	0.0231
@<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	1
7	6	8	1
8	6	9	1
9	8	10	1
10	3	11	1
11	4	12	1
12	5	13	1
13	7	14	1
14	8	15	1
15	8	16	1
16	9	17	1
17	9	18	1
18	9	19	1
19	10	20	1
20	10	21	1
21	10	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1