@<TRIPOS>MOLECULE
DB06915
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.0650    -1.1691     0.0000	O.3	1	noname	-0.2746
2	C1     1.3900     0.0000     0.0000	C.2	1	noname	0.0243
3	C2     2.0850     1.2038     0.0000	C.2	1	noname	0.0373
4	C3     0.0000     0.0000     0.0000	C.2	1	noname	0.0046
5	O2     3.4350     1.2038     0.0000	O.3	1	noname	-0.2738
6	C4     1.3900     2.4076     0.0000	C.2	1	noname	0.0106
7	C5    -0.6950     1.2038     0.0000	C.2	1	noname	-0.0170
8	C6    -0.6950    -1.2038     0.0000	C.2	1	noname	-0.0172
9	C7    -0.0000     2.4076     0.0000	C.2	1	noname	0.0123
10	C8    -2.0850     1.2038     0.0000	C.2	1	noname	0.0282
11	C9    -2.0850    -1.2038     0.0000	C.2	1	noname	0.0150
12	O3    -0.6750     3.5767     0.0000	O.3	1	noname	-0.2816
13	O4    -2.7600     2.3729     0.0000	O.3	1	noname	-0.2791
14	C10    -2.7800     0.0000     0.0000	C.2	1	noname	0.0023
15	O5    -2.7600    -2.3729     0.0000	O.3	1	noname	-0.2836
16	H1     2.2250    -1.4463     0.9051	H	1	noname	0.2183
17	H2     3.7550     1.2038     0.9051	H	1	noname	0.2183
18	H3     1.9350     3.3515     0.0000	H	1	noname	0.0678
19	H4    -0.1500    -2.1477     0.0000	H	1	noname	0.0657
20	H5    -0.8350     3.8538     0.9051	H	1	noname	0.2182
21	H6    -2.9200     2.6500     0.9051	H	1	noname	0.2182
22	H7    -3.8700    -0.0000     0.0000	H	1	noname	0.0677
23	H8    -2.9200    -2.6500     0.9051	H	1	noname	0.2181
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	4	8	2
8	6	9	2
9	7	10	2
10	7	9	1
11	8	11	1
12	9	12	1
13	10	13	1
14	10	14	1
15	11	15	1
16	11	14	2
17	1	16	1
18	5	17	1
19	6	18	1
20	8	19	1
21	12	20	1
22	13	21	1
23	14	22	1
24	15	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1