@<TRIPOS>MOLECULE
DB03939
14 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.8285    -0.3862    -2.6822	O.3	1	noname	-0.2534
2	C1     1.2574     0.5082    -1.8971	C.2	1	noname	-0.0417
3	N1     0.0652     0.9156    -2.1638	N.2	1	noname	-0.2135
4	N2     1.9329     0.9807    -0.8274	N.3	1	noname	-0.0681
5	C2    -0.5441     1.8028    -1.4101	C.2	1	noname	0.0227
6	C3     1.3744     1.9482     0.0731	C.3	1	noname	0.1322
7	C4     0.0172     2.3548    -0.3122	C.2	1	noname	-0.0020
8	O2     2.2155     3.0913     0.1208	O.3	1	noname	-0.3743
9	H1     2.2567    -1.0567    -2.1449	H	1	noname	0.2209
10	H2     2.8628     0.6078    -0.7000	H	1	noname	0.1346
11	H3    -1.5525     2.0914    -1.7066	H	1	noname	0.0838
12	H4     1.3407     1.4845     1.0590	H	1	noname	0.0827
13	H5    -0.5872     3.0828     0.2289	H	1	noname	0.0633
14	H6     2.3870     3.3245     1.0361	H	1	noname	0.2125
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	4	6	1
6	5	7	2
7	6	8	1
8	6	7	1
9	1	9	1
10	4	10	1
11	5	11	1
12	6	12	1
13	7	13	1
14	8	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1