@<TRIPOS>MOLECULE
72941894
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	-0.0660
3	Cl3    -0.6558     1.6213     0.4166	Cl	1	noname	-0.0660
4	Cl4     3.2157     1.4547     1.3458	Cl	1	noname	-0.0694
5	Cl5     0.6869     2.6882    -3.1805	Cl	1	noname	-0.0806
6	Cl6    -5.3352     0.5907     2.7500	Cl	1	noname	-0.0835
7	O1    -0.7291    -1.2082    -0.3136	O.3	1	noname	-0.1824
8	C1     0.1167    -0.1734    -0.5041	C.2	1	noname	0.0515
9	C2    -1.7981    -0.7907     0.3974	C.2	1	noname	0.0654
10	C3     1.1232     0.0808     0.4202	C.2	1	noname	0.0533
11	C4    -0.0191     0.6380    -1.6245	C.2	1	noname	0.0186
12	C5    -2.8113    -1.6861     0.7195	C.2	1	noname	0.0401
13	C6    -1.8855     0.5345     0.8074	C.2	1	noname	0.0401
14	C7     1.9941     1.1463     0.2241	C.2	1	noname	0.0362
15	C8     0.8517     1.7035    -1.8206	C.2	1	noname	0.0069
16	C9    -3.9119    -1.2563     1.4515	C.2	1	noname	0.0146
17	C10    -2.9861     0.9644     1.5395	C.2	1	noname	0.0146
18	C11     1.8583     1.9576    -0.8964	C.2	1	noname	0.0051
19	C12    -3.9993     0.0690     1.8616	C.2	1	noname	-0.0024
20	H1    -0.7578     0.4515    -2.3027	H	1	noname	0.0666
21	H2    -4.6554    -1.9134     1.6879	H	1	noname	0.0654
22	H3    -3.0503     1.9369     1.8404	H	1	noname	0.0654
23	H4     2.4973     2.7395    -1.0403	H	1	noname	0.0654
@<TRIPOS>BOND
1	1	10	1
2	2	12	1
3	3	13	1
4	4	14	1
5	5	15	1
6	6	19	1
7	7	8	1
8	7	9	1
9	8	10	2
10	8	11	1
11	9	12	2
12	9	13	1
13	10	14	1
14	11	15	2
15	11	20	1
16	12	16	1
17	13	17	2
18	14	18	2
19	15	18	1
20	16	19	2
21	16	21	1
22	17	19	1
23	17	22	1
24	18	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1