@<TRIPOS>MOLECULE
DB03091
20 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1727    -2.0855     0.9385	O.2	1	noname	-0.2925
2	C1     1.6541    -1.4985    -0.0356	C.2	1	noname	0.0410
3	N1     1.3284    -2.1880    -1.1375	N.3	1	noname	-0.0853
4	C2     1.4032    -0.0616     0.0271	C.3	1	noname	0.0791
5	N2     2.1427     0.6093    -1.0409	N.3	1	noname	-0.3203
6	C3    -0.0939     0.2028    -0.1453	C.3	1	noname	-0.0201
7	C4    -0.3568     1.7086    -0.0796	C.3	1	noname	0.0354
8	C5    -1.7854     1.9608    -0.2441	C.2	1	noname	0.1348
9	O2    -2.2197     3.1327    -0.2221	O.2	1	noname	-0.2559
10	O3    -2.6373     0.9284    -0.4201	O.3	1	noname	-0.2189
11	H1     0.3668    -2.4479    -1.3048	H	1	noname	0.1271
12	H2     2.0444    -2.4479    -1.8007	H	1	noname	0.1271
13	H3     1.7750     0.3066     0.9833	H	1	noname	0.0559
14	H4     1.6790     0.8410    -1.9077	H	1	noname	0.1191
15	H5     3.1172     0.8410    -0.9118	H	1	noname	0.1191
16	H6    -0.3562    -0.1187    -1.1533	H	1	noname	0.0293
17	H7    -0.5931    -0.2417     0.7157	H	1	noname	0.0293
18	H8    -0.1075     2.0427     0.9275	H	1	noname	0.0373
19	H9     0.1295     2.1656    -0.9414	H	1	noname	0.0373
20	H10    -2.9143     0.5927     0.4356	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	6	7	1
7	7	8	1
8	8	9	2
9	8	10	1
10	3	11	1
11	3	12	1
12	4	13	1
13	5	14	1
14	5	15	1
15	6	16	1
16	6	17	1
17	7	18	1
18	7	19	1
19	10	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1