@<TRIPOS>MOLECULE
DB02793
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.5165    -1.8489    -1.0528	O.2	1	noname	-0.4642
2	C1    -0.0230    -0.8589    -1.6348	C.2	1	noname	-0.0393
3	O2    -0.0475    -0.7868    -2.9827	O.3	1	noname	-0.4642
4	C2     0.5388     0.1456    -0.9103	C.2	1	noname	-0.0450
5	C3     1.1074    -0.1503     0.2779	C.2	1	noname	-0.0492
6	C4     0.5035     1.5152    -1.4518	C.3	1	noname	0.1051
7	C5     1.6832     0.8106     1.0449	C.2	1	noname	-0.0569
8	O3    -0.7253     1.7238    -2.1321	O.3	1	noname	-0.3859
9	C6     0.6755     2.6044    -0.3381	C.3	1	noname	0.1111
10	C7     1.4998     2.1208     0.7767	C.2	1	noname	-0.0561
11	O4     1.2716     3.7648    -0.8990	O.3	1	noname	-0.2797
12	C8     1.4164     4.6822     0.0390	C.2	1	noname	-0.0524
13	C9     1.9698     5.8862    -0.2671	C.2	1	noname	-0.0221
14	C10     1.0212     4.4291     1.2834	C.2	1	noname	-0.0371
15	O5     2.8166     5.9702    -1.1827	O.2	1	noname	-0.4534
16	O6     1.6047     6.9907     0.4180	O.3	1	noname	-0.4534
17	H1     1.1016    -1.1839     0.6241	H	1	noname	0.0619
18	H2     1.2911     1.5707    -2.2032	H	1	noname	0.0676
19	H3     2.3052     0.5244     1.8930	H	1	noname	0.0620
20	H4    -1.4298     1.8433    -1.4910	H	1	noname	0.2110
21	H5    -0.2768     2.9191     0.0887	H	1	noname	0.0684
22	H6     2.0189     2.7903     1.4625	H	1	noname	0.0604
23	H7     1.7589     4.3254     2.0791	H	1	noname	0.0557
24	H8    -0.0405     4.3254     1.5076	H	1	noname	0.0557
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	5	7	1
7	6	8	1
8	6	9	1
9	7	10	2
10	9	11	1
11	9	10	1
12	11	12	1
13	12	13	1
14	12	14	2
15	13	15	2
16	13	16	1
17	5	17	1
18	6	18	1
19	7	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	14	23	1
24	14	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
