@<TRIPOS>MOLECULE
86278126
22 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	I1     2.0121     0.0699     0.4942	I	1	noname	0.0000
2	Cl1     3.9149    -2.5180    -4.2879	Cl	1	noname	0.0000
3	Cl2    -2.7953     0.8695     3.5322	Cl	1	noname	0.0000
4	O1     0.3419     1.3881    -1.5384	O.3	1	noname	0.0000
5	C1     0.1804     0.7026     0.9321	C.2	1	noname	0.0000
6	C2     2.3026    -0.2495    -1.4633	C.2	1	noname	0.0000
7	C3    -0.3743     1.1662    -0.3203	C.2	1	noname	0.0000
8	C4     1.2603     0.4918    -2.1402	C.2	1	noname	0.0000
9	C5     3.1304    -1.2274    -2.0741	C.2	1	noname	0.0000
10	C6    -0.5133     0.5696     2.1539	C.2	1	noname	0.0000
11	C7    -1.7442     1.5276    -0.3001	C.2	1	noname	0.0000
12	C8     1.1362     0.2945    -3.5539	C.2	1	noname	0.0000
13	C9     2.9571    -1.3916    -3.4756	C.2	1	noname	0.0000
14	C10    -1.8779     0.9620     2.1195	C.2	1	noname	0.0000
15	C11     1.9998    -0.6356    -4.2205	C.2	1	noname	0.0000
16	C12    -2.4962     1.4349     0.9145	C.2	1	noname	0.0000
17	H1     3.8056    -1.7766    -1.5422	H	1	noname	0.0000
18	H2    -0.0668     0.2171     3.0005	H	1	noname	0.0000
19	H3    -2.1962     1.8549    -1.1539	H	1	noname	0.0000
20	H4     0.4363     0.8138    -4.0839	H	1	noname	0.0000
21	H5     1.9308    -0.7584    -5.2307	H	1	noname	0.0000
22	H6    -3.4791     1.7073     0.9232	H	1	noname	0.0000
@<TRIPOS>BOND
1	1	5	1
2	1	6	1
3	2	13	1
4	3	14	1
5	4	7	1
6	4	8	1
7	5	7	2
8	5	10	1
9	6	8	2
10	6	9	1
11	7	11	1
12	8	12	1
13	9	13	2
14	9	17	1
15	10	14	2
16	10	18	1
17	11	16	2
18	11	19	1
19	12	15	2
20	12	20	1
21	13	15	1
22	14	16	1
23	15	21	1
24	16	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1