@<TRIPOS>MOLECULE
DB02721
9 9 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	I1    -1.2226    -1.6470    -0.0000	I	1	noname	-0.0411
2	C1    -0.0025     0.0004    -0.0000	C.2	1	noname	0.0263
3	C2     1.3889     0.0068    -0.0000	C.2	1	noname	0.0381
4	C3    -0.4009     1.3291     0.0000	C.2	1	noname	-0.0517
5	N1     1.7714     1.2892     0.0000	N.2	1	noname	-0.2944
6	N2     0.7254     2.0530     0.0000	N.3	1	noname	-0.0205
7	H1     2.0650    -0.8482    -0.0000	H	1	noname	0.0868
8	H2    -1.4140     1.7311     0.0000	H	1	noname	0.0817
9	H3     0.7799     3.0615     0.0000	H	1	noname	0.1747
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	2	4	2
4	3	5	2
5	4	6	1
6	5	6	1
7	3	7	1
8	4	8	1
9	6	9	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1