@<TRIPOS>MOLECULE
DB02938
23 22 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     4.1250    -2.5250     0.0000	O.2	1	noname	-0.2559
2	C1     3.5000    -1.4425     0.0000	C.2	1	noname	0.1348
3	O2     4.1750    -0.2734     0.0000	O.3	1	noname	-0.2189
4	C2     2.0400    -1.4425     0.0000	C.3	1	noname	0.0335
5	C3     1.5300     0.0000     0.0000	C.3	1	noname	-0.0439
6	C4     0.0000     0.0000     0.0000	C.3	1	noname	-0.0528
7	C5    -0.5100     1.4425     0.0000	C.3	1	noname	-0.0535
8	C6    -2.0400     1.4425     0.0000	C.3	1	noname	-0.0561
9	C7    -2.5500     2.8850     0.0000	C.3	1	noname	-0.0654
10	H1     4.3350     0.0038     0.9051	H	1	noname	0.2213
11	H2     1.7402    -1.8977    -0.9440	H	1	noname	0.0372
12	H3     1.7402    -1.8977     0.9440	H	1	noname	0.0372
13	H4     1.8447     0.4450     0.9440	H	1	noname	0.0272
14	H5     1.8447     0.4450    -0.9440	H	1	noname	0.0272
15	H6    -0.3147    -0.4450    -0.9440	H	1	noname	0.0267
16	H7    -0.3147    -0.4450     0.9440	H	1	noname	0.0267
17	H8    -0.1953     1.8875     0.9440	H	1	noname	0.0266
18	H9    -0.1953     1.8875    -0.9440	H	1	noname	0.0266
19	H10    -2.3547     0.9975    -0.9440	H	1	noname	0.0264
20	H11    -2.3547     0.9975     0.9440	H	1	noname	0.0264
21	H12    -2.6711     3.2275     1.0277	H	1	noname	0.0230
22	H13    -1.8320     3.5242    -0.5138	H	1	noname	0.0230
23	H14    -3.5102     2.9309    -0.5138	H	1	noname	0.0230
@<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	1
8	8	9	1
9	3	10	1
10	4	11	1
11	4	12	1
12	5	13	1
13	5	14	1
14	6	15	1
15	6	16	1
16	7	17	1
17	7	18	1
18	8	19	1
19	8	20	1
20	9	21	1
21	9	22	1
22	9	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1