@<TRIPOS>MOLECULE
DB04720
19 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1    -1.2390    -3.6672     1.0635	Br	1	noname	-0.0482
2	C1    -1.3859    -1.8653     0.6394	C.2	1	noname	0.0555
3	C2    -2.6885    -1.2643     0.5418	C.2	1	noname	0.0516
4	C3    -0.1968    -1.0921     0.4136	C.2	1	noname	0.0636
5	Br2    -4.1997    -2.3021     0.8377	Br	1	noname	-0.0482
6	C4    -2.8376     0.1272     0.2188	C.2	1	noname	0.0388
7	Br3     1.4914    -1.8595     0.5097	Br	1	noname	-0.0471
8	C5    -0.3694     0.2867     0.1131	C.2	1	noname	0.0472
9	Br4    -4.5133     0.9130     0.0671	Br	1	noname	-0.0474
10	C6    -1.6459     0.8763     0.0203	C.2	1	noname	-0.0189
11	N1     0.5363     1.2644    -0.0012	N.2	1	noname	-0.2047
12	N2    -1.4716     2.1920    -0.1477	N.3	1	noname	-0.0135
13	C7    -0.1422     2.4212    -0.1478	C.2	1	noname	-0.0083
14	S1     0.5899     3.9799    -0.3127	S.3	1	noname	-0.0688
15	C8     2.3811     3.8104    -0.2578	C.3	1	noname	-0.0109
16	H1    -2.2033     2.8801    -0.2540	H	1	noname	0.1549
17	H2     2.7114     3.7792     0.7804	H	1	noname	0.0348
18	H3     2.6744     2.8887    -0.7603	H	1	noname	0.0348
19	H4     2.8421     4.6608    -0.7603	H	1	noname	0.0348
@<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	12	16	1
18	15	17	1
19	15	18	1
20	15	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1