@<TRIPOS>MOLECULE
DB02005
14 13 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.9862    -2.1200     0.0000	O.2	1	noname	-0.2333
2	C1     2.2157    -0.8912     0.0000	C.2	1	noname	0.1559
3	O2     3.4889    -0.4424     0.0000	O.3	1	noname	-0.2004
4	C2     1.1600     0.0130     0.0000	C.2	1	noname	0.1501
5	O3     1.3896     1.2418     0.0000	O.2	1	noname	-0.2632
6	C3    -0.1226    -0.4391     0.0000	C.2	1	noname	0.0501
7	C4    -1.1327     0.4261     0.0000	C.2	1	noname	-0.0400
8	C5    -0.8701     1.8318     0.0000	C.3	1	noname	-0.0465
9	H1     3.7907    -0.3360     0.9051	H	1	noname	0.2218
10	H2    -0.3434    -1.5065     0.0000	H	1	noname	0.0662
11	H3    -2.1360     0.0001     0.0000	H	1	noname	0.0574
12	H4    -0.8034     2.1889     1.0277	H	1	noname	0.0273
13	H5     0.0715     2.0255    -0.5138	H	1	noname	0.0273
14	H6    -1.6782     2.3524    -0.5138	H	1	noname	0.0273
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	6	7	2
7	7	8	1
8	3	9	1
9	6	10	1
10	7	11	1
11	8	12	1
12	8	13	1
13	8	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1