@<TRIPOS>MOLECULE
DB03630
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	I1    -0.6211    -1.8832     0.1247	I	1	noname	-0.0439
2	C1     0.1764     0.0024     0.0199	C.2	1	noname	-0.0183
3	C2     1.5057     0.1753    -0.3478	C.2	1	noname	-0.0259
4	C3    -0.6121     1.1080     0.3167	C.2	1	noname	-0.0349
5	C4     2.0465     1.4539    -0.4188	C.2	1	noname	-0.0466
6	C5     2.3339    -0.9859    -0.6595	C.3	1	noname	0.0165
7	C6    -0.0713     2.3865     0.2456	C.2	1	noname	-0.0536
8	C7     1.2580     2.5595    -0.1221	C.2	1	noname	-0.0572
9	S1     3.1387    -1.5691     0.8413	S.3	1	noname	-0.1744
10	H1    -1.6544     0.9724     0.6050	H	1	noname	0.0633
11	H2     3.0889     1.5895    -0.7072	H	1	noname	0.0626
12	H3     1.6074    -1.7206    -1.0066	H	1	noname	0.0428
13	H4     3.0738    -0.5824    -1.3507	H	1	noname	0.0428
14	H5    -0.6896     3.2535     0.4783	H	1	noname	0.0622
15	H6     1.6821     3.5620    -0.1778	H	1	noname	0.0622
16	H7     3.1448    -2.8890     0.8528	H	1	noname	0.1025
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	5	8	2
8	6	9	1
9	7	8	1
10	4	10	1
11	5	11	1
12	6	12	1
13	6	13	1
14	7	14	1
15	8	15	1
16	9	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1