@<TRIPOS>MOLECULE
DB02267
38 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.0247    -4.3070    -0.9682	O.2	1	noname	-0.2492
2	C1     3.6954    -3.2792    -1.2053	C.2	1	noname	0.1443
3	O2     4.5121    -3.2391    -2.2795	O.3	1	noname	-0.2137
4	C2     3.5908    -2.0666    -0.2782	C.3	1	noname	0.1089
5	N1     3.1345    -0.9522    -1.0116	N.3	1	noname	-0.1146
6	C3     4.9040    -1.7721     0.2879	C.3	1	noname	0.0588
7	C4     1.9562    -1.2165    -1.5195	C.2	1	noname	-0.1383
8	C5     4.8042    -0.6150     1.1727	C.2	1	noname	0.1358
9	N2     0.9011    -0.9441    -0.8576	N.2	1	noname	-0.2724
10	N3     1.8621    -1.7605    -2.7074	N.3	1	noname	-0.1234
11	O3     5.8203    -0.1914     1.7647	O.2	1	noname	-0.2553
12	O4     3.6144    -0.0026     1.3514	O.3	1	noname	-0.2184
13	C6     0.5029    -1.9466    -3.0328	C.3	1	noname	0.0024
14	C7     0.3930    -2.5821    -4.4203	C.3	1	noname	-0.0382
15	C8    -1.0820    -2.7840    -4.7734	C.3	1	noname	-0.0271
16	C9    -1.1919    -3.4195    -6.1608	C.3	1	noname	0.0913
17	N4    -2.6013    -3.6124    -6.4982	N.3	1	noname	-0.3194
18	C10    -0.5104    -4.7107    -6.1601	C.2	1	noname	0.1437
19	O5     0.4484    -4.9118    -6.9364	O.2	1	noname	-0.2496
20	O6    -0.9159    -5.6874    -5.3210	O.3	1	noname	-0.2140
21	H1     4.7220    -4.1343    -2.5556	H	1	noname	0.2213
22	H2     2.8779    -2.2123     0.5334	H	1	noname	0.0583
23	H3     3.5982    -0.0667    -1.1564	H	1	noname	0.1315
24	H4     5.1755    -2.6232     0.9124	H	1	noname	0.0394
25	H5     5.5461    -1.4787    -0.5426	H	1	noname	0.0394
26	H6     1.1011    -0.9957     0.1310	H	1	noname	0.1898
27	H7     2.6747    -1.9905    -3.2615	H	1	noname	0.1306
28	H8     3.4389     0.0877     2.2909	H	1	noname	0.2213
29	H9     0.1263    -2.6613    -2.3010	H	1	noname	0.0432
30	H10     0.0785    -0.9439    -3.0838	H	1	noname	0.0432
31	H11     0.7902    -1.8571    -5.1308	H	1	noname	0.0280
32	H12     0.8379    -3.5745    -4.3480	H	1	noname	0.0280
33	H13    -1.4792    -3.5090    -4.0629	H	1	noname	0.0288
34	H14    -1.5269    -1.7916    -4.8457	H	1	noname	0.0288
35	H15    -0.7384    -2.7967    -6.9319	H	1	noname	0.0571
36	H16    -3.2067    -2.8125    -6.6147	H	1	noname	0.1191
37	H17    -2.9695    -4.5457    -6.6147	H	1	noname	0.1191
38	H18    -0.7963    -5.3994    -4.4131	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	7	9	2
9	7	10	1
10	8	11	2
11	8	12	1
12	10	13	1
13	13	14	1
14	14	15	1
15	15	16	1
16	16	17	1
17	16	18	1
18	18	19	2
19	18	20	1
20	3	21	1
21	4	22	1
22	5	23	1
23	6	24	1
24	6	25	1
25	9	26	1
26	10	27	1
27	12	28	1
28	13	29	1
29	13	30	1
30	14	31	1
31	14	32	1
32	15	33	1
33	15	34	1
34	16	35	1
35	17	36	1
36	17	37	1
37	20	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1