@<TRIPOS>MOLECULE
DB02335
12 12 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.5506    -0.1757    -0.9533	S.3	1	noname	-0.0832
2	C1     0.0201     0.5355    -0.5756	C.2	1	noname	-0.0508
3	C2     1.9554    -0.9494     0.6562	C.3	1	noname	0.0202
4	N1    -0.2233     0.2447     0.6460	N.2	1	noname	-0.2500
5	N2    -0.7402     1.2343    -1.3818	N.3	1	noname	-0.1249
6	C3     0.6731    -0.5168     1.4115	C.3	1	noname	0.0509
7	H1     1.9358    -2.0372     0.5897	H	1	noname	0.0404
8	H2     2.7948    -0.4479     1.1377	H	1	noname	0.0404
9	H3    -0.4413     2.1476    -1.6925	H	1	noname	0.1263
10	H4    -1.6252     0.8596    -1.6925	H	1	noname	0.1263
11	H5     0.1097    -1.4195     1.6478	H	1	noname	0.0524
12	H6     0.9741     0.1623     2.2092	H	1	noname	0.0524
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	2
4	2	5	1
5	3	6	1
6	4	6	1
7	3	7	1
8	3	8	1
9	5	9	1
10	5	10	1
11	6	11	1
12	6	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1