@<TRIPOS>MOLECULE
DB01971
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.4043    -3.6966    -0.7596	O.2	1	noname	-0.2621
2	C1    -2.4000    -2.5869    -0.1843	C.2	1	noname	0.0931
3	O2    -3.4484    -2.2203     0.5831	O.3	1	noname	-0.2210
4	C2    -1.3391    -1.7487    -0.3315	C.2	1	noname	0.0701
5	C3    -1.3346    -0.5680     0.2806	C.2	1	noname	0.0300
6	C4    -0.2737     0.2702     0.1334	C.2	1	noname	0.0200
7	N1     0.9977    -0.0972    -0.0774	N.2	1	noname	-0.2316
8	C5    -0.3171     1.6580     0.1750	C.2	1	noname	-0.0809
9	C6     1.7374     1.0198    -0.1667	C.2	1	noname	-0.0503
10	N2     0.9392     2.0885    -0.0134	N.3	1	noname	-0.0579
11	H1    -3.2112    -2.3033     1.5096	H	1	noname	0.2216
12	H2    -0.4832    -2.0263    -0.9468	H	1	noname	0.0687
13	H3    -2.1904    -0.2903     0.8958	H	1	noname	0.0647
14	H4    -1.1860     2.2979     0.3288	H	1	noname	0.0812
15	H5     2.8135     1.0537    -0.3364	H	1	noname	0.1013
16	H6     1.2344     3.0541    -0.0360	H	1	noname	0.1531
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	5	6	1
6	6	7	1
7	6	8	2
8	7	9	2
9	8	10	1
10	9	10	1
11	3	11	1
12	4	12	1
13	5	13	1
14	8	14	1
15	9	15	1
16	10	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1