@<TRIPOS>MOLECULE
DB01537
28 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Br1    -0.6026    -1.5576    -0.2658	Br	1	noname	-0.0478
2	C1     0.1467     0.1288    -0.0581	C.2	1	noname	0.0059
3	C2     1.4831     0.2558     0.3025	C.2	1	noname	0.0113
4	C3    -0.6287     1.2640    -0.2633	C.2	1	noname	0.0031
5	O1     2.2362    -0.8467     0.5018	O.3	1	noname	-0.2729
6	C4     2.0441     1.5181     0.4580	C.2	1	noname	-0.0166
7	C5    -0.0678     2.5262    -0.1078	C.2	1	noname	-0.0093
8	C6     2.8487    -1.2289    -0.7210	C.3	1	noname	0.0423
9	C7     1.2686     2.6533     0.2528	C.2	1	noname	-0.0137
10	O2    -0.8209     3.6288    -0.3071	O.3	1	noname	-0.2784
11	C8     1.8578     3.9791     0.4161	C.3	1	noname	0.0266
12	C9    -1.4334     4.0110     0.9157	C.3	1	noname	0.0423
13	C10     2.4390     4.4469    -0.9196	C.3	1	noname	-0.0035
14	N1     3.0290     5.7746    -0.7561	N.3	1	noname	-0.3301
15	H1    -1.6766     1.1644    -0.5461	H	1	noname	0.0663
16	H2     3.0920     1.6177     0.7408	H	1	noname	0.0654
17	H3     2.8816    -2.3164    -0.7865	H	1	noname	0.0535
18	H4     2.2717    -0.8318    -1.5561	H	1	noname	0.0535
19	H5     3.8631    -0.8318    -0.7589	H	1	noname	0.0535
20	H6     1.0323     4.6451     0.6673	H	1	noname	0.0330
21	H7     2.6883     3.8545     1.1110	H	1	noname	0.0330
22	H8    -1.7140     3.1190     1.4759	H	1	noname	0.0535
23	H9    -0.7324     4.6036     1.5035	H	1	noname	0.0535
24	H10    -2.3239     4.6036     0.7063	H	1	noname	0.0535
25	H11     3.2643     3.7805    -1.1705	H	1	noname	0.0429
26	H12     1.6083     4.5711    -1.6142	H	1	noname	0.0429
27	H13     4.0321     5.8780    -0.6996	H	1	noname	0.1184
28	H14     2.4335     6.5884    -0.6996	H	1	noname	0.1184
@<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	2
7	5	8	1
8	6	9	2
9	7	10	1
10	7	9	1
11	9	11	1
12	10	12	1
13	11	13	1
14	13	14	1
15	4	15	1
16	6	16	1
17	8	17	1
18	8	18	1
19	8	19	1
20	11	20	1
21	11	21	1
22	12	22	1
23	12	23	1
24	12	24	1
25	13	25	1
26	13	26	1
27	14	27	1
28	14	28	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1