@<TRIPOS>MOLECULE
76971430
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.2393    -0.1996     1.8341	Cl	1	noname	-0.0542
2	Cl2    -2.4079     0.4700    -0.6876	Cl	1	noname	-0.0703
3	Cl3     2.1229     2.0990    -2.9728	Cl	1	noname	-0.0703
4	O1     3.3757     1.0745    -0.5385	O.3	1	noname	-0.2602
5	O2    -0.6589    -0.3760     1.4964	O.3	1	noname	-0.2602
6	C1     2.0335     0.9342    -0.5731	C.2	1	noname	0.0668
7	C2    -0.0133     0.1984     0.4592	C.2	1	noname	0.0668
8	C3     1.3688     0.3428     0.4948	C.2	1	noname	0.0563
9	C4    -0.7306     0.6453    -0.6444	C.2	1	noname	0.0177
10	C5     1.3162     1.3812    -1.6767	C.2	1	noname	0.0177
11	C6    -0.0658     1.2367    -1.7123	C.2	1	noname	0.0188
12	C7     3.7061     2.3235     0.0507	C.3	1	noname	0.0424
13	C8    -1.0255     0.6224     2.4372	C.3	1	noname	0.0424
14	H1    -0.5922     1.5647    -2.5221	H	1	noname	0.0655
15	H2     4.7898     2.4368     0.0786	H	1	noname	0.0535
16	H3     3.2715     3.1301    -0.5398	H	1	noname	0.0535
17	H4     3.3104     2.3624     1.0656	H	1	noname	0.0535
18	H5    -1.5467     0.1587     3.2746	H	1	noname	0.0535
19	H6    -1.6816     1.3493     1.9584	H	1	noname	0.0535
20	H7    -0.1295     1.1257     2.8007	H	1	noname	0.0535
@<TRIPOS>BOND
1	1	8	1
2	2	9	1
3	3	10	1
4	4	6	1
5	4	12	1
6	5	7	1
7	5	13	1
8	6	8	2
9	6	10	1
10	7	8	1
11	7	9	2
12	9	11	1
13	10	11	2
14	11	14	1
15	12	15	1
16	12	16	1
17	12	17	1
18	13	18	1
19	13	19	1
20	13	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1