@<TRIPOS>MOLECULE
73425410
19 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1     2.5328     3.8314     0.5410	Br	1	noname	-0.0508
2	O1    -0.9840    -1.8770     0.4494	O.3	1	noname	-0.3778
3	O2    -1.4541    -2.5816    -2.3218	O.3	1	noname	-0.2093
4	O3     0.1638    -1.0298    -2.5378	O.2	1	noname	-0.2435
5	C1    -0.2536     0.2245    -0.3124	C.2	1	noname	-0.0355
6	C2    -1.1309    -0.9111    -0.5811	C.3	1	noname	0.1643
7	C3     1.1205     0.0353    -0.2229	C.2	1	noname	-0.0380
8	C4    -0.7925     1.4950    -0.1460	C.2	1	noname	-0.0380
9	C5     1.9558     1.1165     0.0329	C.2	1	noname	-0.0313
10	C6     0.0428     2.5762     0.1098	C.2	1	noname	-0.0313
11	C7     1.4169     2.3869     0.1993	C.2	1	noname	-0.0225
12	C8    -0.7731    -1.5098    -1.8637	C.2	1	noname	0.1523
13	H1    -2.1658    -0.5707    -0.6151	H	1	noname	0.0762
14	H2     1.5160    -0.8970    -0.3450	H	1	noname	0.0627
15	H3    -1.8009     1.6338    -0.2116	H	1	noname	0.0627
16	H4     2.9642     0.9776     0.0985	H	1	noname	0.0634
17	H5    -0.3527     3.5084     0.2319	H	1	noname	0.0634
18	H6    -1.2242    -1.4752     1.3104	H	1	noname	0.2116
19	H7    -1.0056    -3.2396    -2.8930	H	1	noname	0.2214
@<TRIPOS>BOND
1	1	11	1
2	2	6	1
3	2	18	1
4	3	12	1
5	3	19	1
6	4	12	2
7	5	6	1
8	5	7	2
9	5	8	1
10	6	12	1
11	6	13	1
12	7	9	1
13	7	14	1
14	8	10	2
15	8	15	1
16	9	11	2
17	9	16	1
18	10	11	1
19	10	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1