@<TRIPOS>MOLECULE
DB04129
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.2999    -0.9626    -0.5091	O.2	1	noname	-0.2816
2	C1     0.3046     0.1250    -0.3905	C.2	1	noname	0.0233
3	N1     1.6017     0.1753     0.0721	N.3	1	noname	0.0234
4	N2    -0.3012     1.3189    -0.7174	N.3	1	noname	0.0774
5	C2     2.2890     1.3639     0.2113	C.2	1	noname	-0.0496
6	C3     2.2491    -1.0295     0.4150	C.3	1	noname	0.0364
7	C4     0.3461     2.5315    -0.5948	C.2	1	noname	0.0600
8	C5     1.6883     2.6149    -0.1190	C.2	1	noname	0.0363
9	C6     2.9703    -1.5884    -0.8132	C.3	1	noname	0.1050
10	O2    -0.2574     3.5805    -0.9078	O.2	1	noname	-0.2903
11	N3     3.6415    -2.8376    -0.4576	N.3	1	noname	-0.3183
12	C7     3.9587    -0.6204    -1.2796	C.2	1	noname	0.1443
13	O3     3.8776    -0.1520    -2.4357	O.2	1	noname	-0.2492
14	O4     4.9603    -0.2313    -0.4623	O.3	1	noname	-0.2137
15	H1    -1.2517     1.3046    -1.0585	H	1	noname	0.1417
16	H2     3.3120     1.3143     0.5842	H	1	noname	0.0758
17	H3     3.0011    -0.7527     1.1539	H	1	noname	0.0462
18	H4     1.4498    -1.7203     0.6833	H	1	noname	0.0462
19	H5     2.2154     3.5633    -0.0156	H	1	noname	0.0685
20	H6     2.2815    -1.7923    -1.6331	H	1	noname	0.0585
21	H7     3.1029    -3.6831    -0.3348	H	1	noname	0.1192
22	H8     4.6439    -2.8550    -0.3348	H	1	noname	0.1192
23	H9     4.6869    -0.3375     0.4518	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	5	8	2
8	6	9	1
9	7	10	2
10	7	8	1
11	9	11	1
12	9	12	1
13	12	13	2
14	12	14	1
15	4	15	1
16	5	16	1
17	6	17	1
18	6	18	1
19	8	19	1
20	9	20	1
21	11	21	1
22	11	22	1
23	14	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1