@<TRIPOS>MOLECULE
DB04719
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1    -2.4167    -3.2644     0.2910	Br	1	noname	-0.0482
2	C1    -2.0556    -1.5129    -0.2093	C.2	1	noname	0.0555
3	C2    -2.9840    -0.8117    -1.0542	C.2	1	noname	0.0510
4	C3    -0.8531    -0.8783     0.2532	C.2	1	noname	0.0628
5	Br2    -4.5247    -1.6720    -1.6326	Br	1	noname	-0.0482
6	C4    -2.7368     0.5445    -1.4573	C.2	1	noname	0.0319
7	Br3     0.3687    -1.7790     1.3230	Br	1	noname	-0.0471
8	C5    -0.6395     0.4699    -0.1441	C.2	1	noname	0.0363
9	Br4    -3.9148     1.4562    -2.5662	Br	1	noname	-0.0474
10	C6    -1.5507     1.1580    -0.9698	C.2	1	noname	-0.0541
11	N1     0.2967     1.3444     0.2408	N.2	1	noname	-0.2400
12	N2    -1.1365     2.4269    -1.0585	N.3	1	noname	-0.0345
13	C7    -0.0193     2.5347    -0.3100	C.2	1	noname	-0.0105
14	N3     0.6786     3.6656    -0.1377	N.3	1	noname	-0.0898
15	C8     0.7114     3.9934     1.2332	C.3	1	noname	-0.0061
16	C9     1.9949     3.4819    -0.6087	C.3	1	noname	-0.0061
17	H1    -1.5818     3.1623    -1.5886	H	1	noname	0.1554
18	H2     0.7256     3.0784     1.8254	H	1	noname	0.0399
19	H3     1.6068     4.5777     1.4458	H	1	noname	0.0399
20	H4    -0.1727     4.5777     1.4884	H	1	noname	0.0399
21	H5     2.6740     3.3871     0.2386	H	1	noname	0.0399
22	H6     2.0410     2.5768    -1.2144	H	1	noname	0.0399
23	H7     2.2871     4.3397    -1.2144	H	1	noname	0.0399
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	4	8	2
8	6	9	1
9	6	10	2
10	8	11	1
11	8	10	1
12	10	12	1
13	11	13	2
14	12	13	1
15	13	14	1
16	14	15	1
17	14	16	1
18	12	17	1
19	15	18	1
20	15	19	1
21	15	20	1
22	16	21	1
23	16	22	1
24	16	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1