@<TRIPOS>MOLECULE
DB04252
20 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.5666     0.5245     1.4728	O.2	1	noname	-0.2942
2	C1     1.3728     0.2985     1.1793	C.2	1	noname	-0.0411
3	N1     0.9596     0.4231    -0.0893	N.3	1	noname	-0.0649
4	N2     0.5062    -0.0683     2.1332	N.3	1	noname	-0.0826
5	C2    -0.3871     0.1682    -0.4204	C.3	1	noname	0.1104
6	C3    -0.4518    -0.9190    -1.3927	C.2	1	noname	0.1443
7	C4    -1.0116     1.4285    -1.0223	C.3	1	noname	0.0589
8	O2    -1.0735    -1.9678    -1.1171	O.2	1	noname	-0.2492
9	O3     0.1598    -0.7916    -2.5895	O.3	1	noname	-0.2137
10	C5    -0.9469     2.5158    -0.0500	C.2	1	noname	0.1358
11	O4    -0.3252     3.5646    -0.3257	O.2	1	noname	-0.2553
12	O5    -1.5585     2.3883     1.1467	O.3	1	noname	-0.2184
13	H1     1.6446     0.7016    -0.7773	H	1	noname	0.1332
14	H2     0.8270    -0.2066     3.0809	H	1	noname	0.1285
15	H3    -0.4679    -0.2066     1.9046	H	1	noname	0.1285
16	H4    -0.8745    -0.1492     0.5014	H	1	noname	0.0584
17	H5    -0.3865     1.7379    -1.8600	H	1	noname	0.0394
18	H6    -2.0717     1.2284    -1.1781	H	1	noname	0.0394
19	H7     0.3436    -1.6624    -2.9492	H	1	noname	0.2213
20	H8    -1.6646     1.4571     1.3543	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	5	3	1
5	5	6	1
6	5	7	1
7	6	8	2
8	6	9	1
9	7	10	1
10	10	11	2
11	10	12	1
12	3	13	1
13	4	14	1
14	4	15	1
15	5	16	1
16	7	17	1
17	7	18	1
18	9	19	1
19	12	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1