@<TRIPOS>MOLECULE
DB02952
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.5142     0.1211    -0.3054	O.2	1	noname	-0.2486
2	C1     1.2954     0.1594    -0.5803	C.2	1	noname	0.1451
3	O2     0.8947     0.4834    -1.8280	O.3	1	noname	-0.2132
4	C2     0.3052    -0.1461     0.4482	C.3	1	noname	0.0967
5	N1    -0.4978    -1.2927     0.0263	N.3	1	noname	-0.3173
6	C3    -0.6055     1.0658     0.6554	C.3	1	noname	-0.0377
7	C4     1.0186    -0.4782     1.7604	C.3	1	noname	-0.0377
8	H1     0.7333    -0.3185    -2.3306	H	1	noname	0.2213
9	H2    -1.4916    -1.1870    -0.1194	H	1	noname	0.1194
10	H3    -0.0587    -2.1905    -0.1194	H	1	noname	0.1194
11	H4    -0.7381     1.2423     1.7228	H	1	noname	0.0254
12	H5    -0.1521     1.9438     0.1955	H	1	noname	0.0254
13	H6    -1.5750     0.8745     0.1955	H	1	noname	0.0254
14	H7     1.0814    -1.5602     1.8760	H	1	noname	0.0254
15	H8     2.0232    -0.0555     1.7449	H	1	noname	0.0254
16	H9     0.4594    -0.0555     2.5950	H	1	noname	0.0254
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	4	7	1
7	3	8	1
8	5	9	1
9	5	10	1
10	6	11	1
11	6	12	1
12	6	13	1
13	7	14	1
14	7	15	1
15	7	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
