@<TRIPOS>MOLECULE
DB02688
11 10 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1928    -0.1771    -0.2312	O.2	1	noname	-0.2553
2	C1     1.1942    -0.7235     0.2851	C.2	1	noname	0.0882
3	O2     1.3500    -1.8105     1.0704	O.3	1	noname	-0.2158
4	C2    -0.0494    -0.2230     0.0557	C.2	1	noname	-0.0294
5	N1    -0.2094     1.0583    -0.1647	N.3	1	noname	-0.1397
6	C3    -1.1032    -1.0346     0.0551	C.2	1	noname	-0.0297
7	H1     1.3122    -1.5469     1.9928	H	1	noname	0.2217
8	H2     0.5969     1.6607    -0.2496	H	1	noname	0.1244
9	H3    -1.1390     1.4439    -0.2496	H	1	noname	0.1244
10	H4    -2.1109    -0.6192     0.0549	H	1	noname	0.0556
11	H5    -0.9590    -2.1150     0.0549	H	1	noname	0.0556
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	2
6	3	7	1
7	5	8	1
8	5	9	1
9	6	10	1
10	6	11	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
