@<TRIPOS>MOLECULE
DB02373
37 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	W1     5.0133     0.2680     3.4834	W	1	noname	0.4393
2	O1     5.1646     2.3122     3.4503	O.2	1	noname	-0.2917
3	O2     3.9125    -0.3972     1.7606	O.3	1	noname	-0.2213
4	O3     3.9874    -0.3457     5.2704	O.3	1	noname	-0.2332
5	O4     6.9815    -0.5968     3.4541	O.3	1	noname	-0.2332
6	C1     2.6126     0.1741     1.7800	C.3	1	noname	0.0606
7	C2     1.8291    -0.2993     0.5540	C.3	1	noname	0.1101
8	O5     2.5005     0.1023    -0.6153	O.3	1	noname	-0.3484
9	C3     0.4542     0.3721     0.5368	C.3	1	noname	0.1126
10	C4     2.1103     1.4587    -0.7452	C.3	1	noname	0.1590
11	O6    -0.5276    -0.5700     0.1308	O.3	1	noname	-0.3873
12	C5     0.5949     1.4526    -0.5316	C.3	1	noname	0.1258
13	N1     2.6187     2.0155    -1.9602	N.3	1	noname	0.0257
14	O7     0.1872     2.7032     0.0034	O.3	1	noname	-0.3857
15	C6     3.9285     2.0502    -2.2939	C.2	1	noname	0.1238
16	C7     1.9311     2.5646    -3.0069	C.2	1	noname	-0.0362
17	N2     5.0509     1.6497    -1.6228	N.2	1	noname	-0.2441
18	C8     3.9734     2.5937    -3.5862	C.2	1	noname	0.0254
19	N3     2.7562     2.9188    -4.0068	N.2	1	noname	-0.2172
20	C9     6.2725     1.7587    -2.2431	C.2	1	noname	0.0503
21	C10     5.2274     2.6964    -4.2186	C.2	1	noname	0.0729
22	N4     6.3177     2.2693    -3.5180	N.2	1	noname	-0.2575
23	N5     5.3451     3.1931    -5.4576	N.3	1	noname	-0.1031
24	H1     3.9634    -1.3045     5.3123	H	1	noname	0.1868
25	H2     7.2858    -0.7305     4.3547	H	1	noname	0.1868
26	H3     2.1290    -0.2336     2.6678	H	1	noname	0.0574
27	H4     2.7660     1.2493     1.6882	H	1	noname	0.0574
28	H5     1.7729    -1.3875     0.5262	H	1	noname	0.0656
29	H6     0.0996     0.7262     1.5048	H	1	noname	0.0657
30	H7     2.6128     2.1153    -0.0349	H	1	noname	0.0853
31	H8    -0.9356    -0.9615     0.9066	H	1	noname	0.2106
32	H9    -0.0242     1.3398    -1.4215	H	1	noname	0.0674
33	H10     0.2011     2.6609     0.9623	H	1	noname	0.2107
34	H11     0.8505     2.7038    -3.0404	H	1	noname	0.1016
35	H12     7.1852     1.4471    -1.7353	H	1	noname	0.1062
36	H13     4.5187     3.3803    -6.0072	H	1	noname	0.1258
37	H14     6.2602     3.3803    -5.8417	H	1	noname	0.1258
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	7	6	1
7	7	8	1
8	7	9	1
9	8	10	1
10	9	11	1
11	9	12	1
12	10	13	1
13	10	12	1
14	12	14	1
15	13	15	1
16	13	16	1
17	15	17	2
18	15	18	1
19	16	19	2
20	17	20	1
21	18	21	2
22	18	19	1
23	20	22	2
24	21	23	1
25	21	22	1
26	4	24	1
27	5	25	1
28	6	26	1
29	6	27	1
30	7	28	1
31	9	29	1
32	10	30	1
33	11	31	1
34	12	32	1
35	14	33	1
36	16	34	1
37	20	35	1
38	23	36	1
39	23	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1