@<TRIPOS>MOLECULE
DB06151
19 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     3.3143    -1.5770     0.4822	S.3	1	noname	-0.1770
2	C1     1.5695    -1.1735     0.3010	C.3	1	noname	0.0157
3	C2     1.4340     0.0860    -0.4249	C.3	1	noname	0.1087
4	N1     0.0672     0.4021    -0.5668	N.3	1	noname	-0.0719
5	C3     2.0720    -0.0517    -1.8087	C.2	1	noname	0.1444
6	C4    -0.6977     0.5711     0.5203	C.2	1	noname	0.0394
7	O1     3.0199     0.6942    -2.1369	O.2	1	noname	-0.2491
8	O2     1.6112    -0.9786    -2.6752	O.3	1	noname	-0.2136
9	O3    -1.9094     0.8513     0.3945	O.2	1	noname	-0.2971
10	C5    -0.1160     0.4279     1.8518	C.3	1	noname	0.0095
11	H1     3.6187    -1.6474     1.7646	H	1	noname	0.1022
12	H2     1.0838    -1.8919    -0.3594	H	1	noname	0.0399
13	H3     1.1331    -0.9456     1.2735	H	1	noname	0.0399
14	H4     1.8740     0.8877     0.1683	H	1	noname	0.0586
15	H5    -0.3744     0.5100    -1.4687	H	1	noname	0.1318
16	H6     1.2433    -1.7186    -2.1866	H	1	noname	0.2213
17	H7    -0.0116    -0.6304     2.0908	H	1	noname	0.0324
18	H8     0.8645     0.9037     1.8729	H	1	noname	0.0324
19	H9    -0.7666     0.9037     2.5856	H	1	noname	0.0324
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	3	5	1
5	4	6	1
6	5	7	2
7	5	8	1
8	6	9	2
9	6	10	1
10	1	11	1
11	2	12	1
12	2	13	1
13	3	14	1
14	4	15	1
15	8	16	1
16	10	17	1
17	10	18	1
18	10	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
