@<TRIPOS>MOLECULE
86208488
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1     1.3046    -1.0032     1.9171	Br	1	noname	-0.0479
2	Br2    -2.6945    -3.4567     0.1717	Br	1	noname	-0.0467
3	Br3    -5.2656    -2.4525     1.8818	Br	1	noname	-0.0495
4	Br4     3.0217     3.3811    -1.1584	Br	1	noname	-0.0507
5	O1    -0.7291    -1.2082    -0.3136	O.3	1	noname	-0.1925
6	C1     0.1167    -0.1734    -0.5041	C.2	1	noname	0.0318
7	C2    -1.7981    -0.7907     0.3974	C.2	1	noname	0.0373
8	C3     1.1232     0.0808     0.4202	C.2	1	noname	0.0205
9	C4    -0.0191     0.6380    -1.6245	C.2	1	noname	-0.0074
10	C5    -2.8113    -1.6861     0.7195	C.2	1	noname	0.0372
11	C6    -1.8855     0.5345     0.8074	C.2	1	noname	-0.0133
12	C7     1.9941     1.1463     0.2241	C.2	1	noname	0.0015
13	C8     0.8517     1.7035    -1.8206	C.2	1	noname	-0.0217
14	C9    -3.9119    -1.2563     1.4515	C.2	1	noname	0.0135
15	C10    -2.9861     0.9644     1.5395	C.2	1	noname	-0.0396
16	C11     1.8583     1.9576    -0.8964	C.2	1	noname	-0.0226
17	C12    -3.9993     0.0690     1.8616	C.2	1	noname	-0.0340
18	H1    -0.7578     0.4515    -2.3027	H	1	noname	0.0651
19	H2    -1.1420     1.1916     0.5711	H	1	noname	0.0650
20	H3     2.7327     1.3327     0.9023	H	1	noname	0.0647
21	H4     0.7521     2.2989    -2.6428	H	1	noname	0.0635
22	H5    -3.0503     1.9369     1.8404	H	1	noname	0.0623
23	H6    -4.8070     0.3844     2.3988	H	1	noname	0.0634
@<TRIPOS>BOND
1	1	8	1
2	2	10	1
3	3	14	1
4	4	16	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	11	19	1
17	12	16	2
18	12	20	1
19	13	16	1
20	13	21	1
21	14	17	2
22	15	17	1
23	15	22	1
24	17	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1