@<TRIPOS>MOLECULE
DB02763
18 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1    -0.3335    -1.6398     0.2171	S.3	1	noname	-0.1247
2	C1     0.2512    -0.0179     0.0739	C.2	1	noname	0.0178
3	C2     1.6179     0.2240    -0.0019	C.2	1	noname	0.0334
4	C3    -0.6456     1.0433     0.0347	C.2	1	noname	0.0041
5	C4     2.0877     1.5271    -0.1169	C.2	1	noname	0.0821
6	C5    -0.1758     2.3464    -0.0803	C.2	1	noname	0.0467
7	C6     1.1909     2.5883    -0.1561	C.2	1	noname	0.0767
8	C7     3.4544     1.7691    -0.1927	C.2	1	noname	0.1052
9	N1     1.6319     3.8118    -0.2641	N.2	1	noname	-0.0045
10	O1     4.2582     0.9965     0.3726	O.2	1	noname	-0.2560
11	O2     3.9137     2.8384    -0.8769	O.3	1	noname	-0.2167
12	O3     1.0287     4.6919     0.2037	O.2	1	noname	-0.1431
13	O4     2.7145     4.0421    -0.8766	O.3	1	noname	-0.1431
14	H1    -0.4473    -1.9554     1.4937	H	1	noname	0.1078
15	H2     2.3212    -0.6082     0.0288	H	1	noname	0.0643
16	H3    -1.7174     0.8536     0.0942	H	1	noname	0.0635
17	H4    -0.8791     3.1786    -0.1110	H	1	noname	0.0647
18	H5     4.2036     3.5133    -0.2588	H	1	noname	0.2216
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	4	6	2
6	5	7	2
7	5	8	1
8	6	7	1
9	7	9	1
10	8	10	2
11	8	11	1
12	9	12	2
13	9	13	1
14	1	14	1
15	3	15	1
16	4	16	1
17	6	17	1
18	11	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1