@<TRIPOS>MOLECULE
DB03229
19 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.4295    -2.0182    -0.2304	O.2	1	noname	-0.2345
2	C1     1.4527    -1.4362     0.2888	C.2	1	noname	0.1654
3	O2     0.6008    -2.1223     1.0801	O.3	1	noname	-0.2015
4	C2     1.2436    -0.0827     0.0515	C.2	1	noname	0.2115
5	O3     2.2166     0.6714    -0.1655	O.2	1	noname	-0.2582
6	C3    -0.1125     0.4582     0.0556	C.3	1	noname	0.0188
7	C4    -0.0632     1.9606    -0.2297	C.3	1	noname	-0.0396
8	C5    -1.4843     2.5274    -0.2254	C.3	1	noname	-0.0623
9	C6     0.7672     2.6577     0.8498	C.3	1	noname	-0.0623
10	H1     0.8120    -1.9522     2.0010	H	1	noname	0.2217
11	H2    -0.6279    -0.0185    -0.7782	H	1	noname	0.0355
12	H3    -0.4840     0.3282     1.0720	H	1	noname	0.0355
13	H4     0.3928     2.1304    -1.2051	H	1	noname	0.0301
14	H5    -1.8191     2.6609     0.8033	H	1	noname	0.0233
15	H6    -1.4934     3.4892    -0.7382	H	1	noname	0.0233
16	H7    -2.1529     1.8359    -0.7382	H	1	noname	0.0233
17	H8     0.4091     2.3570     1.8344	H	1	noname	0.0233
18	H9     1.8143     2.3747     0.7420	H	1	noname	0.0233
19	H10     0.6699     3.7380     0.7420	H	1	noname	0.0233
@<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	1
8	7	9	1
9	3	10	1
10	6	11	1
11	6	12	1
12	7	13	1
13	8	14	1
14	8	15	1
15	8	16	1
16	9	17	1
17	9	18	1
18	9	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1