@<TRIPOS>MOLECULE
DB02239
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.2456    -1.6049     0.0000	O.2	1	noname	-0.2558
2	C1     2.0167    -1.3765     0.0000	C.2	1	noname	0.1350
3	O2     1.1394    -2.4026     0.0000	O.3	1	noname	-0.2188
4	C2     1.5300     0.0000     0.0000	C.3	1	noname	0.0403
5	C3     0.0000     0.0000     0.0000	C.3	1	noname	0.0151
6	C4    -0.4867     1.3765     0.0000	C.2	1	noname	0.1308
7	O3    -1.7156     1.6049     0.0000	O.2	1	noname	-0.3006
8	C5     0.4621     2.4862     0.0000	C.3	1	noname	-0.0057
9	H1     0.9315    -2.6458     0.9051	H	1	noname	0.2213
10	H2     1.8592     0.4343     0.9440	H	1	noname	0.0377
11	H3     1.8592     0.4343    -0.9440	H	1	noname	0.0377
12	H4    -0.3292    -0.4343    -0.9440	H	1	noname	0.0351
13	H5    -0.3292    -0.4343     0.9440	H	1	noname	0.0351
14	H6     0.6982     2.7624     1.0277	H	1	noname	0.0310
15	H7     1.3746     2.1840    -0.5138	H	1	noname	0.0310
16	H8     0.0217     3.3407    -0.5138	H	1	noname	0.0310
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	5	6	1
6	6	7	2
7	6	8	1
8	3	9	1
9	4	10	1
10	4	11	1
11	5	12	1
12	5	13	1
13	8	14	1
14	8	15	1
15	8	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1