@<TRIPOS>MOLECULE
DB03564
22 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.8612     1.5374     0.1616	O.3	1	noname	-0.3902
2	C1    -0.4450     1.4699     0.0826	C.3	1	noname	0.0617
3	C2    -0.0080     0.0059     0.0003	C.3	1	noname	0.0012
4	C3     0.1666     2.1155     1.3276	C.3	1	noname	-0.0363
5	C4     0.0323     2.2155    -1.1653	C.3	1	noname	-0.0363
6	C5     1.5179    -0.0668    -0.0848	C.3	1	noname	0.0540
7	O2     1.9235    -1.4255    -0.1611	O.3	1	noname	-0.3932
8	C6     1.9952     0.6788    -1.3327	C.3	1	noname	-0.0388
9	H1    -2.1300     1.5502     1.0831	H	1	noname	0.2108
10	H2    -0.2931    -0.4610     0.9431	H	1	noname	0.0322
11	H3    -0.3946    -0.3855    -0.9406	H	1	noname	0.0322
12	H4     0.5030     1.3372     2.0125	H	1	noname	0.0259
13	H5     1.0150     2.7347     1.0362	H	1	noname	0.0259
14	H6    -0.5826     2.7347     1.8210	H	1	noname	0.0259
15	H7     0.3245     1.4952    -1.9294	H	1	noname	0.0259
16	H8    -0.7751     2.8412    -1.5457	H	1	noname	0.0259
17	H9     0.8874     2.8412    -0.9098	H	1	noname	0.0259
18	H10     1.9861     0.3267     0.8175	H	1	noname	0.0598
19	H11     2.0289    -1.7783     0.7255	H	1	noname	0.2104
20	H12     2.2875    -0.0415    -2.0967	H	1	noname	0.0256
21	H13     1.1878     1.3046    -1.7131	H	1	noname	0.0256
22	H14     2.8504     1.3046    -1.0772	H	1	noname	0.0256
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	6	7	1
7	6	8	1
8	1	9	1
9	3	10	1
10	3	11	1
11	4	12	1
12	4	13	1
13	4	14	1
14	5	15	1
15	5	16	1
16	5	17	1
17	6	18	1
18	7	19	1
19	8	20	1
20	8	21	1
21	8	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1