@<TRIPOS>MOLECULE
DB03441
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	I1    -3.7817    -1.9557    -1.0822	I	1	noname	-0.0854
2	C1    -3.0163    -2.1902     0.8808	C.3	1	noname	0.0120
3	C2    -1.6714    -1.4694     0.9934	C.3	1	noname	0.0578
4	C3    -1.8552    -0.0492     0.7091	C.2	1	noname	0.1370
5	C4    -1.1191    -1.6387     2.4101	C.3	1	noname	-0.0149
6	O1    -1.2428     0.4821    -0.2423	O.2	1	noname	-0.2544
7	O2    -2.6865     0.6902     1.4738	O.3	1	noname	-0.2177
8	C5     0.1643    -0.9509     2.5175	C.2	1	noname	-0.0546
9	C6     0.2078     0.3819     2.9100	C.2	1	noname	-0.0570
10	C7     1.3425    -1.6288     2.2273	C.2	1	noname	-0.0570
11	C8     1.4296     1.0367     3.0122	C.2	1	noname	-0.0605
12	C9     2.5644    -0.9739     2.3296	C.2	1	noname	-0.0605
13	C10     2.6079     0.3588     2.7220	C.2	1	noname	-0.0616
14	H1    -3.6073    -1.6428     1.6150	H	1	noname	0.0385
15	H2    -2.7175    -3.2194     1.0797	H	1	noname	0.0385
16	H3    -0.9658    -1.8526     0.2562	H	1	noname	0.0420
17	H4    -1.7946    -1.1208     3.0909	H	1	noname	0.0324
18	H5    -0.9048    -2.6975     2.5556	H	1	noname	0.0324
19	H6    -2.5005     0.5247     2.4010	H	1	noname	0.2213
20	H7    -0.7162     0.9134     3.1375	H	1	noname	0.0625
21	H8     1.3084    -2.6739     1.9196	H	1	noname	0.0625
22	H9     1.4637     2.0818     3.3200	H	1	noname	0.0622
23	H10     3.4883    -1.5055     2.1020	H	1	noname	0.0622
24	H11     3.5660     0.8723     2.8022	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	3	2	1
3	3	4	1
4	3	5	1
5	4	6	2
6	4	7	1
7	5	8	1
8	8	9	2
9	8	10	1
10	9	11	1
11	10	12	2
12	11	13	2
13	12	13	1
14	2	14	1
15	2	15	1
16	3	16	1
17	5	17	1
18	5	18	1
19	7	19	1
20	9	20	1
21	10	21	1
22	11	22	1
23	12	23	1
24	13	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1