@<TRIPOS>MOLECULE
DB07003
22 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.2333     0.3470     0.2065	S.3	1	noname	-0.2261
2	C1     0.6161    -0.3553     0.1897	C.2	1	noname	0.0550
3	C2     1.8572     1.9415     0.8578	C.2	1	noname	0.0233
4	C3     0.2733    -1.6248    -0.2278	C.2	1	noname	-0.0392
5	C4    -0.1941     0.6437     0.7691	C.2	1	noname	0.0498
6	C5     0.4754     1.8553     1.0760	C.2	1	noname	0.0264
7	N1    -0.8896    -2.1789    -0.2124	N.2	1	noname	-0.2518
8	N2     1.2518    -2.3578    -0.6983	N.3	1	noname	-0.1284
9	O1    -1.5126     0.4966     1.1689	O.3	1	noname	-0.2608
10	C6    -2.1436    -1.7413     0.2122	C.3	1	noname	0.0674
11	C7    -2.3849    -0.2151     0.2557	C.3	1	noname	0.0811
12	C8    -2.2327     0.3656    -1.1517	C.3	1	noname	-0.0363
13	H1     2.4038     2.8547     1.0932	H	1	noname	0.0740
14	H2    -0.0669     2.7121     1.4759	H	1	noname	0.0659
15	H3     1.1047    -3.3404    -0.8797	H	1	noname	0.1258
16	H4     2.1534    -1.9402    -0.8797	H	1	noname	0.1258
17	H5    -2.8133    -2.1514    -0.5437	H	1	noname	0.0542
18	H6    -2.1932    -2.1041     1.2388	H	1	noname	0.0542
19	H7    -3.3739    -0.0323     0.6758	H	1	noname	0.0625
20	H8    -2.1547    -0.4473    -1.8736	H	1	noname	0.0257
21	H9    -3.1024     0.9789    -1.3877	H	1	noname	0.0257
22	H10    -1.3327     0.9789    -1.1963	H	1	noname	0.0257
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	2
5	3	6	2
6	4	7	2
7	4	8	1
8	5	9	1
9	5	6	1
10	7	10	1
11	9	11	1
12	10	11	1
13	11	12	1
14	3	13	1
15	6	14	1
16	8	15	1
17	8	16	1
18	10	17	1
19	10	18	1
20	11	19	1
21	12	20	1
22	12	21	1
23	12	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1