@<TRIPOS>MOLECULE
DB01080
20 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.4557    -1.0858    -0.1611	O.2	1	noname	-0.2559
2	C1     2.2112    -1.0188    -0.0644	C.2	1	noname	0.1348
3	O2     1.4839    -2.1465     0.0830	O.3	1	noname	-0.2189
4	C2     1.5443     0.2792    -0.1107	C.3	1	noname	0.0352
5	C3     0.0335     0.0816     0.0284	C.3	1	noname	-0.0250
6	C4    -0.6654     1.4417    -0.0202	C.3	1	noname	0.0227
7	N1    -2.1090     1.2529     0.1127	N.3	1	noname	-0.3244
8	C5    -0.3810     2.0794    -1.2682	C.2	1	noname	-0.0842
9	C6     0.2376     3.2567    -1.2877	C.2	1	noname	-0.0923
10	H1     1.3650    -2.3308     1.0176	H	1	noname	0.2213
11	H2     1.8874     0.8241     0.7687	H	1	noname	0.0373
12	H3     1.7337     0.6781    -1.1073	H	1	noname	0.0373
13	H4    -0.2938    -0.4720    -0.8517	H	1	noname	0.0291
14	H5    -0.1401    -0.3260     1.0243	H	1	noname	0.0291
15	H6    -0.3255     2.1146     0.7671	H	1	noname	0.0507
16	H7    -2.7211     2.0550     0.1587	H	1	noname	0.1189
17	H8    -2.4942     0.3204     0.1587	H	1	noname	0.1189
18	H9    -0.6444     1.6541    -2.2366	H	1	noname	0.0586
19	H10     1.3267     3.3000    -1.2957	H	1	noname	0.0535
20	H11    -0.3446     4.1782    -1.2957	H	1	noname	0.0535
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	5	6	1
6	6	7	1
7	6	8	1
8	8	9	2
9	3	10	1
10	4	11	1
11	4	12	1
12	5	13	1
13	5	14	1
14	6	15	1
15	7	16	1
16	7	17	1
17	8	18	1
18	9	19	1
19	9	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1