@<TRIPOS>MOLECULE
DB04802
18 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.5627    -1.4754    -0.5231	O.2	1	noname	-0.2491
2	C1    -0.3750    -1.1678    -0.7623	C.2	1	noname	0.1445
3	O2     0.3988    -1.9890    -1.5034	O.3	1	noname	-0.2136
4	C2     0.1753     0.0797    -0.2403	C.3	1	noname	0.1063
5	N1     0.6185     0.9197    -1.3518	N.3	1	noname	-0.3181
6	C3     1.3647    -0.2295     0.6711	C.3	1	noname	0.0261
7	N2     1.9158     1.0197     1.1938	N.3	1	noname	-0.3260
8	C4     2.4412    -0.9669    -0.1279	C.3	1	noname	-0.0479
9	H1     0.9230    -2.5453    -0.9226	H	1	noname	0.2213
10	H2    -0.6189     0.6056     0.2897	H	1	noname	0.0588
11	H3    -0.0410     1.2099    -2.0597	H	1	noname	0.1192
12	H4     1.5840     1.2099    -1.4118	H	1	noname	0.1192
13	H5     1.0482    -0.8227     1.5290	H	1	noname	0.0481
14	H6     2.9064     1.0981     1.3744	H	1	noname	0.1187
15	H7     1.3059     1.8042     1.3744	H	1	noname	0.1187
16	H8     3.1395    -1.4453     0.5588	H	1	noname	0.0247
17	H9     1.9725    -1.7246    -0.7558	H	1	noname	0.0247
18	H10     2.9784    -0.2562    -0.7558	H	1	noname	0.0247
@<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	6	8	1
8	3	9	1
9	4	10	1
10	5	11	1
11	5	12	1
12	6	13	1
13	7	14	1
14	7	15	1
15	8	16	1
16	8	17	1
17	8	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1