@<TRIPOS>MOLECULE
DB06819
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -5.1423    -2.2700     1.5429	O.2	1	noname	-0.2559
2	C1    -4.2195    -1.4789     1.2512	C.2	1	noname	0.1348
3	O2    -4.3493    -0.1621     1.5191	O.3	1	noname	-0.2189
4	C2    -3.0013    -1.9789     0.6207	C.3	1	noname	0.0338
5	C3    -2.0410    -0.8142     0.3714	C.3	1	noname	-0.0399
6	C4    -0.7644    -1.3382    -0.2893	C.3	1	noname	-0.0274
7	C5     0.1520    -0.2267    -0.5272	C.2	1	noname	-0.0549
8	C6     1.0792     0.1299     0.4451	C.2	1	noname	-0.0572
9	C7     0.0972     0.4748    -1.7259	C.2	1	noname	-0.0572
10	C8     1.9516     1.1880     0.2186	C.2	1	noname	-0.0605
11	C9     0.9696     1.5329    -1.9524	C.2	1	noname	-0.0605
12	C10     1.8968     1.8896    -0.9802	C.2	1	noname	-0.0616
13	H1    -4.3625    -0.0287     2.4697	H	1	noname	0.2213
14	H2    -2.5349    -2.6394     1.3517	H	1	noname	0.0372
15	H3    -3.3049    -2.3690    -0.3508	H	1	noname	0.0372
16	H4    -2.5236    -0.1580    -0.3529	H	1	noname	0.0275
17	H5    -1.7536    -0.4284     1.3495	H	1	noname	0.0275
18	H6    -0.2657    -1.9895     0.4285	H	1	noname	0.0316
19	H7    -1.0357    -1.7190    -1.2739	H	1	noname	0.0316
20	H8     1.1221    -0.4202     1.3851	H	1	noname	0.0625
21	H9    -0.6299     0.1951    -2.4883	H	1	noname	0.0625
22	H10     2.6786     1.4677     0.9810	H	1	noname	0.0622
23	H11     0.9267     2.0831    -2.8924	H	1	noname	0.0622
24	H12     2.5809     2.7194    -1.1578	H	1	noname	0.0622
@<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	1
7	7	8	2
8	7	9	1
9	8	10	1
10	9	11	2
11	10	12	2
12	11	12	1
13	3	13	1
14	4	14	1
15	4	15	1
16	5	16	1
17	5	17	1
18	6	18	1
19	6	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	11	23	1
24	12	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1