@<TRIPOS>MOLECULE
DB04804
18 17 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.4112     0.0837    -0.4614	O.2	1	noname	-0.2491
2	C1     1.2884     0.5674    -0.2006	C.2	1	noname	0.1445
3	O2     1.1648     1.8872     0.0547	O.3	1	noname	-0.2136
4	C2     0.0543    -0.3365    -0.1707	C.3	1	noname	0.1063
5	N1    -0.5524    -0.2892     1.1586	N.3	1	noname	-0.3181
6	C3    -0.9116     0.1258    -1.1632	C.3	1	noname	0.0261
7	N2    -2.0909    -0.7379    -1.1347	N.3	1	noname	-0.3260
8	C4    -0.2767     0.0763    -2.5544	C.3	1	noname	-0.0479
9	H1     1.1514     2.0297     1.0040	H	1	noname	0.2213
10	H2     0.3026    -1.3736    -0.3960	H	1	noname	0.0588
11	H3     0.0338    -0.2729     1.9809	H	1	noname	0.1192
12	H4    -1.5576    -0.2729     1.2547	H	1	noname	0.1192
13	H5    -1.2209     1.1350    -0.8915	H	1	noname	0.0481
14	H6    -3.0150    -0.3306    -1.1248	H	1	noname	0.1187
15	H7    -1.9814    -1.7419    -1.1248	H	1	noname	0.1187
16	H8    -0.1398    -0.9626    -2.8545	H	1	noname	0.0247
17	H9    -0.9287     0.5781    -3.2693	H	1	noname	0.0247
18	H10     0.6906     0.5781    -2.5304	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
