@<TRIPOS>MOLECULE
72941521
4 3 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.6320     0.0000     0.0000	S.3	1	noname	-0.0367
2	N1    -1.1480     0.0000     0.0000	N.1	1	noname	-0.1694
3	C1     0.0000     0.0000     0.0000	C.1	1	noname	0.0869
4	H1     2.0853     1.2822     0.0000	H	1	noname	0.1192
@<TRIPOS>BOND
1	1	3	1
2	1	4	1
3	2	3	3
@<TRIPOS>SUBSTRUCTURE
1	noname	1
