@<TRIPOS>MOLECULE
DB03025
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.3289    -1.6317     0.0122	O.3	1	noname	-0.3889
2	C1     1.9411    -1.3359    -0.0410	C.3	1	noname	0.0719
3	C2     1.4089    -1.7701    -1.2953	C.2	1	noname	-0.0763
4	C3     1.7352     0.1731     0.1054	C.3	1	noname	-0.0234
5	C4     0.4349    -2.6751    -1.3270	C.2	1	noname	-0.0876
6	C5     0.2399     0.4918     0.0481	C.3	1	noname	-0.0505
7	C6     0.0341     2.0008     0.1945	C.3	1	noname	-0.0534
8	C7    -1.4613     2.3195     0.1372	C.3	1	noname	-0.0561
9	C8    -1.6671     3.8285     0.2836	C.3	1	noname	-0.0654
10	H1     3.6085    -1.6913     0.9287	H	1	noname	0.2108
11	H2     1.4570    -1.9162     0.7445	H	1	noname	0.0645
12	H3     1.7573    -1.3988    -2.2591	H	1	noname	0.0596
13	H4     2.0760     0.4415     1.1054	H	1	noname	0.0296
14	H5     2.1900     0.6390    -0.7687	H	1	noname	0.0296
15	H6    -0.6068    -2.3545    -1.3400	H	1	noname	0.0535
16	H7     0.6783    -3.7375    -1.3400	H	1	noname	0.0535
17	H8    -0.1009     0.2233    -0.9519	H	1	noname	0.0267
18	H9    -0.2149     0.0259     0.9223	H	1	noname	0.0267
19	H10     0.3749     2.2692     1.1945	H	1	noname	0.0266
20	H11     0.4889     2.4667    -0.6796	H	1	noname	0.0266
21	H12    -1.8021     2.0510    -0.8628	H	1	noname	0.0264
22	H13    -1.9160     1.8536     1.0114	H	1	noname	0.0264
23	H14    -1.7027     4.0894     1.3414	H	1	noname	0.0230
24	H15    -0.8408     4.3559    -0.1931	H	1	noname	0.0230
25	H16    -2.6044     4.1153    -0.1931	H	1	noname	0.0230
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	2
5	4	6	1
6	6	7	1
7	7	8	1
8	8	9	1
9	1	10	1
10	2	11	1
11	3	12	1
12	4	13	1
13	4	14	1
14	5	15	1
15	5	16	1
16	6	17	1
17	6	18	1
18	7	19	1
19	7	20	1
20	8	21	1
21	8	22	1
22	9	23	1
23	9	24	1
24	9	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1