@<TRIPOS>MOLECULE
DB01670
17 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.3450    -1.1691     0.0000	O.2	1	noname	-0.2554
2	C1     2.0950    -1.1691     0.0000	C.2	1	noname	0.1383
3	O2     1.4200     0.0000     0.0000	O.3	1	noname	-0.2080
4	C2     1.3650    -2.4335     0.0000	C.3	1	noname	0.0220
5	C3     0.0000     0.0000     0.0000	C.3	1	noname	0.0561
6	C4    -0.5100     1.4425     0.0000	C.3	1	noname	-0.0318
7	C5    -2.0400     1.4425     0.0000	C.3	1	noname	-0.0632
8	H1     1.1833    -2.7482     1.0277	H	1	noname	0.0336
9	H2     0.4126    -2.3032    -0.5138	H	1	noname	0.0336
10	H3     1.9541    -3.1932    -0.5138	H	1	noname	0.0336
11	H4    -0.2908    -0.4609    -0.9440	H	1	noname	0.0572
12	H5    -0.2908    -0.4609     0.9440	H	1	noname	0.0572
13	H6    -0.1953     1.8875     0.9440	H	1	noname	0.0287
14	H7    -0.1953     1.8875    -0.9440	H	1	noname	0.0287
15	H8    -2.4033     1.4425     1.0277	H	1	noname	0.0231
16	H9    -2.4033     2.3325    -0.5138	H	1	noname	0.0231
17	H10    -2.4033     0.5525    -0.5138	H	1	noname	0.0231
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	5	6	1
6	6	7	1
7	4	8	1
8	4	9	1
9	4	10	1
10	5	11	1
11	5	12	1
12	6	13	1
13	6	14	1
14	7	15	1
15	7	16	1
16	7	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1