@<TRIPOS>MOLECULE
90479533
22 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1    -0.9285     4.0158     0.0000	Br	1	noname	-0.0495
2	Br2     3.9420     1.2038     0.0000	Br	1	noname	-0.0495
3	Br3     2.3185     4.0158     0.0000	Br	1	noname	-0.0483
4	Br4    -4.6370    -2.4076     0.0000	Br	1	noname	-0.0508
5	C1     0.0000     0.0000     0.0000	C.2	1	noname	-0.0214
6	C2    -0.6950    -1.2038     0.0000	C.2	1	noname	-0.0324
7	C3     1.3900     0.0000     0.0000	C.2	1	noname	-0.0106
8	C4    -0.6950     1.2038     0.0000	C.2	1	noname	-0.0106
9	C5    -2.0850    -1.2038     0.0000	C.2	1	noname	-0.0209
10	C6    -0.0000    -2.4076     0.0000	C.2	1	noname	-0.0444
11	C7    -0.0000     2.4076     0.0000	C.2	1	noname	0.0153
12	C8     2.0850     1.2038     0.0000	C.2	1	noname	0.0153
13	C9     1.3900     2.4076     0.0000	C.2	1	noname	0.0291
14	C10    -2.7800    -2.4076     0.0000	C.2	1	noname	-0.0191
15	C11    -0.6950    -3.6113     0.0000	C.2	1	noname	-0.0492
16	C12    -2.0850    -3.6113     0.0000	C.2	1	noname	-0.0338
17	H1     1.9000    -0.8833     0.0000	H	1	noname	0.0641
18	H2    -1.7150     1.2038     0.0000	H	1	noname	0.0641
19	H3    -2.5950    -0.3204     0.0000	H	1	noname	0.0640
20	H4     1.0200    -2.4076     0.0000	H	1	noname	0.0629
21	H5    -0.1850    -4.4947     0.0000	H	1	noname	0.0623
22	H6    -2.5950    -4.4947     0.0000	H	1	noname	0.0634
@<TRIPOS>BOND
1	1	11	1
2	2	12	1
3	3	13	1
4	4	14	1
5	5	6	1
6	5	7	2
7	5	8	1
8	6	9	2
9	6	10	1
10	7	12	1
11	7	17	1
12	8	11	2
13	8	18	1
14	9	14	1
15	9	19	1
16	10	15	2
17	10	20	1
18	11	13	1
19	12	13	2
20	14	16	2
21	15	16	1
22	15	21	1
23	16	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1