@<TRIPOS>MOLECULE
DB00847
11 10 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     2.1300     1.6971     0.0000	S.3	1	noname	-0.1779
2	C1     1.5300     0.0000     0.0000	C.3	1	noname	0.0026
3	C2     0.0000     0.0000     0.0000	C.3	1	noname	0.0012
4	N1    -0.4873    -1.3784     0.0000	N.3	1	noname	-0.3296
5	H1     2.2767     2.1119     1.2445	H	1	noname	0.1022
6	H2     1.7919    -0.4779    -0.9440	H	1	noname	0.0390
7	H3     1.7919    -0.4779     0.9440	H	1	noname	0.0390
8	H4    -0.3288     0.4347     0.9440	H	1	noname	0.0434
9	H5    -0.3288     0.4347    -0.9440	H	1	noname	0.0434
10	H6    -1.4803    -1.5629     0.0000	H	1	noname	0.1184
11	H7     0.1690    -2.1461     0.0000	H	1	noname	0.1184
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	1	5	1
5	2	6	1
6	2	7	1
7	3	8	1
8	3	9	1
9	4	10	1
10	4	11	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1