@<TRIPOS>MOLECULE
DB03720
14 13 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1928    -0.1771    -0.2312	O.2	1	noname	-0.2550
2	C1     1.1942    -0.7235     0.2851	C.2	1	noname	0.0894
3	O2     1.3500    -1.8105     1.0704	O.3	1	noname	-0.2156
4	C2    -0.0494    -0.2230     0.0557	C.2	1	noname	-0.0257
5	N1    -0.2094     1.0583    -0.1647	N.3	1	noname	-0.1384
6	C3    -1.1032    -1.0346     0.0551	C.2	1	noname	-0.0216
7	C4    -2.4107    -0.5083    -0.1861	C.3	1	noname	-0.0449
8	H1     1.3122    -1.5469     1.9928	H	1	noname	0.2217
9	H2     0.5969     1.6607    -0.2496	H	1	noname	0.1244
10	H3    -1.1390     1.4439    -0.2496	H	1	noname	0.1244
11	H4    -0.9030    -2.0891     0.2448	H	1	noname	0.0591
12	H5    -2.9038    -0.3099     0.7655	H	1	noname	0.0274
13	H6    -2.3303     0.4187    -0.7539	H	1	noname	0.0274
14	H7    -2.9948    -1.2326    -0.7539	H	1	noname	0.0274
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	2
6	6	7	1
7	3	8	1
8	5	9	1
9	5	10	1
10	6	11	1
11	7	12	1
12	7	13	1
13	7	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
