@<TRIPOS>MOLECULE
DB02198
8 7 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1     1.9693    -1.7972     0.2027	Br	1	noname	-0.0815
2	C1     1.5157     0.0428    -0.1463	C.3	1	noname	0.0892
3	C2     0.0815     0.1515    -0.3967	C.2	1	noname	0.1403
4	O1    -0.6291     0.8687     0.3403	O.2	1	noname	-0.2521
5	O2    -0.4773    -0.5227    -1.4242	O.3	1	noname	-0.2159
6	H1     1.6335     0.6542     0.7484	H	1	noname	0.0494
7	H2     1.9345     0.3787    -1.0949	H	1	noname	0.0494
8	H3    -0.3938    -1.4667    -1.2707	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	2
4	3	5	1
5	2	6	1
6	2	7	1
7	5	8	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
