@<TRIPOS>MOLECULE
DB02249
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.4200     0.0000     0.0000	O.3	1	noname	-0.3792
2	C1     0.0000     0.0000     0.0000	C.3	1	noname	0.0698
3	C2     1.8933    -1.3388     0.0000	C.3	1	noname	0.0440
4	C3    -0.5100     1.4425     0.0000	C.3	1	noname	0.0666
5	C4     3.4233    -1.3388     0.0000	C.3	1	noname	-0.0416
6	O2    -1.9300     1.4425     0.0000	O.3	1	noname	-0.3938
7	H1    -0.2908    -0.4609    -0.9440	H	1	noname	0.0590
8	H2    -0.2908    -0.4609     0.9440	H	1	noname	0.0590
9	H3     1.5557    -1.7666     0.9440	H	1	noname	0.0563
10	H4     1.5557    -1.7666    -0.9440	H	1	noname	0.0563
11	H5    -0.2192     1.9034     0.9440	H	1	noname	0.0587
12	H6    -0.2192     1.9034    -0.9440	H	1	noname	0.0587
13	H7     3.7867    -1.3388     1.0277	H	1	noname	0.0254
14	H8     3.7867    -2.2288    -0.5138	H	1	noname	0.0254
15	H9     3.7867    -0.4488    -0.5138	H	1	noname	0.0254
16	H10    -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	3	5	1
5	4	6	1
6	2	7	1
7	2	8	1
8	3	9	1
9	3	10	1
10	4	11	1
11	4	12	1
12	5	13	1
13	5	14	1
14	5	15	1
15	6	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1