@<TRIPOS>MOLECULE
90478610
22 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1     3.0924    -0.8746     0.0000	Br	1	noname	-0.0489
2	Br2    -3.4589     0.0994     0.0000	Br	1	noname	-0.0501
3	Br3     1.5334    -3.3958    -0.0000	Br	1	noname	-0.0501
4	Br4     4.1021     1.5958    -0.0000	Br	1	noname	-0.0495
5	C1     0.1461     0.0278     0.0000	C.2	1	noname	-0.0047
6	C2    -0.6792    -1.2268    -0.0000	C.2	1	noname	0.0111
7	C3     1.6023     0.2105    -0.0000	C.2	1	noname	0.0190
8	C4    -0.5704     1.2792     0.0000	C.2	1	noname	-0.0336
9	C5    -2.1534    -1.2392    -0.0000	C.2	1	noname	-0.0029
10	C6    -0.1190    -2.5766     0.0000	C.2	1	noname	-0.0029
11	C7     2.2485     1.4844    -0.0000	C.2	1	noname	0.0077
12	C8     0.0506     2.5730    -0.0000	C.2	1	noname	-0.0456
13	C9    -2.9261    -2.4263    -0.0000	C.2	1	noname	-0.0289
14	C10    -0.9199    -3.7375     0.0000	C.2	1	noname	-0.0289
15	C11     1.4634     2.6583     0.0000	C.2	1	noname	-0.0235
16	C12    -2.3177    -3.6897     0.0000	C.2	1	noname	-0.0459
17	H1    -1.5897     1.2422     0.0000	H	1	noname	0.0629
18	H2    -0.5184     3.4196    -0.0000	H	1	noname	0.0623
19	H3    -3.9440    -2.3609    -0.0000	H	1	noname	0.0634
20	H4    -0.4613    -4.6486     0.0000	H	1	noname	0.0634
21	H5     1.9167     3.5720     0.0000	H	1	noname	0.0634
22	H6    -2.8751    -4.5440     0.0000	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	7	1
2	2	9	1
3	3	10	1
4	4	11	1
5	5	6	1
6	5	7	2
7	5	8	1
8	6	9	2
9	6	10	1
10	7	11	1
11	8	12	2
12	8	17	1
13	9	13	1
14	10	14	2
15	11	15	2
16	12	15	1
17	12	18	1
18	13	16	2
19	13	19	1
20	14	16	1
21	14	20	1
22	15	21	1
23	16	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1