@<TRIPOS>MOLECULE
DB02803
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.8495    -1.4841     0.8760	O.3	1	noname	-0.3903
2	C1    -1.4617    -1.2773     0.6581	C.3	1	noname	0.0812
3	C2    -1.0771     0.1299     1.1192	C.3	1	noname	0.0695
4	C3    -1.1514    -1.4283    -0.8325	C.3	1	noname	0.0225
5	O2    -1.3650     0.2700     2.5026	O.3	1	noname	-0.3935
6	C4     0.2755    -1.2157    -1.0565	C.2	1	noname	-0.0558
7	C5     1.1552    -2.2906    -1.0024	C.2	1	noname	-0.0618
8	C6     0.7544     0.0615    -1.3240	C.2	1	noname	-0.0618
9	C7     2.5138    -2.0882    -1.2157	C.2	1	noname	-0.0624
10	C8     2.1129     0.2638    -1.5373	C.2	1	noname	-0.0624
11	C9     2.9926    -0.8110    -1.4832	C.2	1	noname	-0.0668
12	H1    -3.0249    -1.5102     1.8195	H	1	noname	0.2105
13	H2    -0.9570    -2.0417     1.2491	H	1	noname	0.0627
14	H3     0.0053     0.2285     1.0360	H	1	noname	0.0590
15	H4    -1.7296     0.8412     0.6129	H	1	noname	0.0590
16	H5    -1.3466    -2.4651    -1.1060	H	1	noname	0.0343
17	H6    -1.6610    -0.6207    -1.3582	H	1	noname	0.0343
18	H7    -1.4481    -0.5991     2.9018	H	1	noname	0.2101
19	H8     0.7797    -3.2921    -0.7927	H	1	noname	0.0625
20	H9     0.0646     0.9044    -1.3664	H	1	noname	0.0625
21	H10     3.2036    -2.9311    -1.1733	H	1	noname	0.0622
22	H11     2.4885     1.2654    -1.7470	H	1	noname	0.0622
23	H12     4.0580    -0.6524    -1.6504	H	1	noname	0.0622
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	8	10	2
10	9	11	2
11	10	11	1
12	1	12	1
13	2	13	1
14	3	14	1
15	3	15	1
16	4	16	1
17	4	17	1
18	5	18	1
19	7	19	1
20	8	20	1
21	9	21	1
22	10	22	1
23	11	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1