@<TRIPOS>MOLECULE
DB02934
36 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.7543    -2.5699     1.1856	O.3	1	noname	-0.3480
2	C1     1.7211    -1.8832     0.5002	C.3	1	noname	0.1590
3	C2     3.9178    -2.0090     0.6280	C.3	1	noname	0.1142
4	N1     0.4406    -2.2503     1.0201	N.3	1	noname	0.0163
5	C3     2.1275    -0.4088     0.5548	C.3	1	noname	0.1258
6	C4     3.6437    -0.5179     0.4205	C.3	1	noname	0.1129
7	C5     5.0849    -2.1823     1.6020	C.3	1	noname	0.0802
8	C6    -0.0277    -3.5176     1.0697	C.2	1	noname	0.1107
9	C7    -0.5172    -1.4543     1.5851	C.2	1	noname	-0.0358
10	O2     1.5998     0.2698    -0.5754	O.3	1	noname	-0.3857
11	O3     4.0306    -0.1439    -0.8936	O.3	1	noname	-0.3873
12	O4     5.2962    -3.5651     1.8462	O.3	1	noname	-0.3905
13	C8     6.3502    -1.5723     0.9955	C.3	1	noname	-0.0363
14	N2     0.5031    -4.7029     0.6406	N.2	1	noname	-0.2210
15	C9    -1.2660    -3.4361     1.7234	C.2	1	noname	0.0503
16	N3    -1.5642    -2.1761     2.0195	N.2	1	noname	-0.2160
17	C10    -0.1879    -5.8670     0.8779	C.2	1	noname	0.0505
18	C11    -1.9656    -4.6332     1.9693	C.2	1	noname	0.0533
19	N4    -1.3905    -5.7932     1.5386	N.2	1	noname	-0.2522
20	C12    -3.2535    -4.6332     2.6570	C.3	1	noname	0.0470
21	H1     1.5914    -2.2258    -0.5264	H	1	noname	0.0853
22	H2     4.1081    -2.5416    -0.3038	H	1	noname	0.0659
23	H3     1.7548     0.1706     1.3995	H	1	noname	0.0674
24	H4     4.2118     0.1516     1.0663	H	1	noname	0.0657
25	H5     4.8595    -1.7458     2.5750	H	1	noname	0.0625
26	H6    -0.4535    -0.3702     1.6783	H	1	noname	0.1016
27	H7     1.2979    -0.3723    -1.2221	H	1	noname	0.2107
28	H8     4.1851    -0.9328    -1.4184	H	1	noname	0.2106
29	H9     5.3203    -3.7228     2.7928	H	1	noname	0.2105
30	H10     7.0176    -1.2505     1.7950	H	1	noname	0.0257
31	H11     6.8537    -2.3176     0.3798	H	1	noname	0.0257
32	H12     6.0807    -0.7142     0.3798	H	1	noname	0.0257
33	H13     0.2091    -6.8276     0.5495	H	1	noname	0.1062
34	H14    -3.0900    -4.6332     3.7347	H	1	noname	0.0296
35	H15    -3.8161    -3.7432     2.3749	H	1	noname	0.0296
36	H16    -3.8160    -5.5232     2.3749	H	1	noname	0.0296
@<TRIPOS>BOND
1	1	2	1
2	3	1	1
3	2	4	1
4	2	5	1
5	3	6	1
6	3	7	1
7	4	8	1
8	4	9	1
9	5	10	1
10	5	6	1
11	6	11	1
12	7	12	1
13	7	13	1
14	8	14	2
15	8	15	1
16	9	16	2
17	14	17	1
18	15	18	2
19	15	16	1
20	17	19	2
21	18	20	1
22	18	19	1
23	2	21	1
24	3	22	1
25	5	23	1
26	6	24	1
27	7	25	1
28	9	26	1
29	10	27	1
30	11	28	1
31	12	29	1
32	13	30	1
33	13	31	1
34	13	32	1
35	17	33	1
36	20	34	1
37	20	35	1
38	20	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1