@<TRIPOS>MOLECULE
72941859
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.2880    -0.9040     1.7800	Cl	1	noname	-0.0590
2	Cl2    -2.7052    -3.2946     0.2219	Cl	1	noname	-0.0678
3	Cl3    -0.6558     1.6213     0.4166	Cl	1	noname	-0.0678
4	Cl4     3.2157     1.4547     1.3458	Cl	1	noname	-0.0711
5	O1    -0.7291    -1.2082    -0.3136	O.3	1	noname	-0.1836
6	C1     0.1167    -0.1734    -0.5041	C.2	1	noname	0.0412
7	C2    -1.7981    -0.7907     0.3974	C.2	1	noname	0.0622
8	C3     1.1232     0.0808     0.4202	C.2	1	noname	0.0506
9	C4    -0.0191     0.6380    -1.6245	C.2	1	noname	-0.0138
10	C5    -2.8113    -1.6861     0.7195	C.2	1	noname	0.0293
11	C6    -1.8855     0.5345     0.8074	C.2	1	noname	0.0293
12	C7     1.9941     1.1463     0.2241	C.2	1	noname	0.0259
13	C8     0.8517     1.7035    -1.8206	C.2	1	noname	-0.0414
14	C9    -3.9119    -1.2563     1.4515	C.2	1	noname	-0.0186
15	C10    -2.9861     0.9644     1.5395	C.2	1	noname	-0.0186
16	C11     1.8583     1.9576    -0.8964	C.2	1	noname	-0.0275
17	C12    -3.9993     0.0690     1.8616	C.2	1	noname	-0.0504
18	H1    -0.7578     0.4515    -2.3027	H	1	noname	0.0650
19	H2     0.7521     2.2989    -2.6428	H	1	noname	0.0624
20	H3    -4.6554    -1.9134     1.6879	H	1	noname	0.0639
21	H4    -3.0503     1.9369     1.8404	H	1	noname	0.0639
22	H5     2.4973     2.7395    -1.0403	H	1	noname	0.0638
23	H6    -4.8070     0.3844     2.3988	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	8	1
2	2	10	1
3	3	11	1
4	4	12	1
5	5	6	1
6	5	7	1
7	6	8	2
8	6	9	1
9	7	10	2
10	7	11	1
11	8	12	1
12	9	13	2
13	9	18	1
14	10	14	1
15	11	15	2
16	12	16	2
17	13	16	1
18	13	19	1
19	14	17	2
20	14	20	1
21	15	17	1
22	15	21	1
23	16	22	1
24	17	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1