@<TRIPOS>MOLECULE
DB03540
18 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.4788     1.8585    -0.3712	O.2	1	noname	-0.2982
2	C1    -0.6054     0.9956    -0.6057	C.2	1	noname	0.1350
3	C2     0.1707     0.0828     0.3821	C.3	1	noname	0.0179
4	C3    -0.0038     0.5468    -1.9596	C.3	1	noname	0.0092
5	C4     0.1918    -1.2539    -0.3347	C.3	1	noname	-0.0402
6	C5     1.6863     0.3865     0.5198	C.3	1	noname	-0.0432
7	C6     0.9272    -0.6197    -1.5172	C.3	1	noname	-0.0338
8	C7     2.2267    -0.1304    -0.8423	C.3	1	noname	-0.0493
9	H1    -0.3042     0.1577     1.3603	H	1	noname	0.0382
10	H2    -0.8062     0.1357    -2.5721	H	1	noname	0.0349
11	H3     0.6158     1.3566    -2.3450	H	1	noname	0.0349
12	H4     0.8383    -1.9583     0.1887	H	1	noname	0.0277
13	H5    -0.8172    -1.5499    -0.6217	H	1	noname	0.0277
14	H6     1.8196     1.4677     0.5568	H	1	noname	0.0274
15	H7     2.0932    -0.2402     1.3134	H	1	noname	0.0274
16	H8     1.1513    -1.2442    -2.3820	H	1	noname	0.0307
17	H9     2.6097     0.7186    -1.4086	H	1	noname	0.0270
18	H10     2.8646    -0.9946    -0.6574	H	1	noname	0.0270
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	3	6	1
6	7	4	1
7	5	7	1
8	6	8	1
9	7	8	1
10	3	9	1
11	4	10	1
12	4	11	1
13	5	12	1
14	5	13	1
15	6	14	1
16	6	15	1
17	7	16	1
18	8	17	1
19	8	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
