@<TRIPOS>MOLECULE
DB02806
13 12 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.4200     0.0000     0.0000	O.3	1	noname	-0.3821
2	C1     0.0000     0.0000     0.0000	C.3	1	noname	0.0695
3	C2     1.8933    -1.3388     0.0000	C.3	1	noname	0.0357
4	C3    -0.5100     1.4425     0.0000	C.3	1	noname	0.0666
5	O2    -1.9300     1.4425     0.0000	O.3	1	noname	-0.3938
6	H1    -0.2908    -0.4609    -0.9440	H	1	noname	0.0590
7	H2    -0.2908    -0.4609     0.9440	H	1	noname	0.0590
8	H3     2.0144    -1.6813     1.0277	H	1	noname	0.0529
9	H4     1.1754    -1.9780    -0.5138	H	1	noname	0.0529
10	H5     2.8535    -1.3847    -0.5138	H	1	noname	0.0529
11	H6    -0.2192     1.9034     0.9440	H	1	noname	0.0587
12	H7    -0.2192     1.9034    -0.9440	H	1	noname	0.0587
13	H8    -2.2500     1.4425     0.9051	H	1	noname	0.2101
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	4	5	1
5	2	6	1
6	2	7	1
7	3	8	1
8	3	9	1
9	3	10	1
10	4	11	1
11	4	12	1
12	5	13	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1