@<TRIPOS>MOLECULE
118984406
22 22 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -0.0210     1.8760     0.2438	Cl	1	noname	-0.0685
2	Cl2    -0.3241     1.3730    -5.0532	Cl	1	noname	-0.0858
3	O1    -0.6423    -0.9803     0.2570	O.3	1	noname	-0.2577
4	O2    -1.3142    -1.0029     3.1407	O.3	1	noname	-0.2104
5	O3    -2.8174    -2.4778     2.3422	O.2	1	noname	-0.2450
6	C1    -1.9755    -0.8872     0.7369	C.3	1	noname	0.1467
7	C2    -0.5685    -0.4342    -0.9754	C.2	1	noname	0.0345
8	C3    -2.8695    -1.6044    -0.1676	C.3	1	noname	-0.0284
9	C4    -0.2795     0.9177    -1.1203	C.2	1	noname	0.0257
10	C5    -0.7814    -1.2237    -2.0994	C.2	1	noname	-0.0098
11	C6    -2.0592    -1.5062     2.1336	C.2	1	noname	0.1502
12	C7    -0.2034     1.4800    -2.3892	C.2	1	noname	0.0138
13	C8    -0.7054    -0.6614    -3.3683	C.2	1	noname	-0.0159
14	C9    -0.4164     0.6905    -3.5132	C.2	1	noname	-0.0151
15	H1    -2.2718     0.1606     0.7855	H	1	noname	0.0715
16	H2    -3.8929    -1.5329     0.2008	H	1	noname	0.0262
17	H3    -2.8099    -1.1634    -1.1626	H	1	noname	0.0262
18	H4    -2.5732    -2.6522    -0.2162	H	1	noname	0.0262
19	H5    -0.9935    -2.2158    -1.9930	H	1	noname	0.0651
20	H6     0.0086     2.4721    -2.4956	H	1	noname	0.0654
21	H7    -0.8617    -1.2408    -4.1931	H	1	noname	0.0639
22	H8    -1.0097    -1.5886     3.8650	H	1	noname	0.2214
@<TRIPOS>BOND
1	1	9	1
2	2	14	1
3	3	6	1
4	3	7	1
5	4	11	1
6	4	22	1
7	5	11	2
8	6	8	1
9	6	11	1
10	6	15	1
11	7	9	2
12	7	10	1
13	8	16	1
14	8	17	1
15	8	18	1
16	9	12	1
17	10	13	2
18	10	19	1
19	12	14	2
20	12	20	1
21	13	14	1
22	13	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1