@<TRIPOS>MOLECULE
DB01921
21 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.4497     3.2541    -0.0552	O.3	1	noname	-0.2049
2	N1     0.5529     2.4158    -0.3605	N.2	1	noname	-0.2006
3	C1     0.3495     1.4005     0.3834	C.2	1	noname	-0.0100
4	N2     1.1685     1.2066     1.6073	N.3	1	noname	-0.1056
5	C2    -0.7506     0.3764     0.0046	C.3	1	noname	0.1370
6	C3     0.9845     0.0415     2.5231	C.3	1	noname	0.0301
7	O2    -1.9868     1.0529    -0.1706	O.3	1	noname	-0.3827
8	C4    -0.9563    -0.8443     0.9479	C.3	1	noname	0.1139
9	C5    -0.1014    -1.0333     2.2124	C.3	1	noname	0.0958
10	O3    -0.9417    -2.0409     0.1834	O.3	1	noname	-0.3871
11	O4    -0.9512    -1.1873     3.3396	O.3	1	noname	-0.3888
12	H1     1.5170     3.3170     0.9003	H	1	noname	0.2481
13	H2     1.8770     1.8927     1.8250	H	1	noname	0.1295
14	H3    -0.4617    -0.0291    -0.9650	H	1	noname	0.0708
15	H4     1.9377    -0.4835     2.4612	H	1	noname	0.0460
16	H5     0.6759     0.5021     3.4616	H	1	noname	0.0460
17	H6    -2.3633     1.2589     0.6882	H	1	noname	0.2111
18	H7    -1.9541    -0.6914     1.3592	H	1	noname	0.0660
19	H8     0.4245    -1.9766     2.0650	H	1	noname	0.0642
20	H9    -0.9325    -2.7978     0.7739	H	1	noname	0.2107
21	H10    -1.0836    -2.1218     3.5152	H	1	noname	0.2106
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	3	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	5	8	1
8	6	9	1
9	8	10	1
10	8	9	1
11	9	11	1
12	1	12	1
13	4	13	1
14	5	14	1
15	6	15	1
16	6	16	1
17	7	17	1
18	8	18	1
19	9	19	1
20	10	20	1
21	11	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1