@<TRIPOS>MOLECULE
DB04304
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.0712    -2.3448     2.9881	O.2	1	noname	-0.2443
2	C1    -3.4911    -2.4561     1.8160	C.2	1	noname	0.1513
3	O2    -4.8078    -2.3136     1.5543	O.3	1	noname	-0.2099
4	C2    -2.5575    -2.7402     0.7300	C.3	1	noname	0.1677
5	O3    -2.9172    -3.9631     0.1044	O.3	1	noname	-0.3798
6	C3    -2.6097    -1.6072    -0.2969	C.3	1	noname	0.1180
7	O4    -2.2500    -0.3843     0.3287	O.3	1	noname	-0.3869
8	C4    -1.6314    -1.9050    -1.4350	C.3	1	noname	0.1111
9	O5    -0.3152    -2.0098    -0.9124	O.3	1	noname	-0.3874
10	C5    -1.6836    -0.7720    -2.4619	C.3	1	noname	0.1056
11	O6    -0.7756    -1.0484    -3.5181	O.3	1	noname	-0.3878
12	C6    -3.1018    -0.6590    -3.0250	C.3	1	noname	0.0718
13	O7    -3.1502     0.3925    -3.9781	O.3	1	noname	-0.3934
14	H1    -5.2944    -2.2609     2.3801	H	1	noname	0.2214
15	H2    -1.5617    -2.8838     1.1494	H	1	noname	0.0739
16	H3    -3.1108    -4.6213     0.7759	H	1	noname	0.2113
17	H4    -3.6221    -1.4560    -0.6716	H	1	noname	0.0662
18	H5    -2.2815    -0.4913     1.2822	H	1	noname	0.2107
19	H6    -1.8394    -2.8703    -1.8964	H	1	noname	0.0657
20	H7    -0.3507    -2.0070     0.0469	H	1	noname	0.2106
21	H8    -1.3502     0.1718    -2.0306	H	1	noname	0.0652
22	H9    -0.6858    -1.9984    -3.6226	H	1	noname	0.2106
23	H10    -3.3162    -1.5692    -3.5850	H	1	noname	0.0591
24	H11    -3.7626    -0.3486    -2.2157	H	1	noname	0.0591
25	H12    -3.1891     1.2363    -3.5220	H	1	noname	0.2101
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	6	8	1
8	8	9	1
9	8	10	1
10	10	11	1
11	10	12	1
12	12	13	1
13	3	14	1
14	4	15	1
15	5	16	1
16	6	17	1
17	7	18	1
18	8	19	1
19	9	20	1
20	10	21	1
21	11	22	1
22	12	23	1
23	12	24	1
24	13	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1