@<TRIPOS>MOLECULE
DB01927
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.6091    -1.0347     0.9588	O.2	1	noname	-0.2986
2	C1    -0.0644    -0.1064     0.3231	C.2	1	noname	0.0825
3	C2    -0.6572     1.2194     0.1261	C.2	1	noname	0.0593
4	C3     1.2487    -0.2047    -0.3205	C.2	1	noname	0.0593
5	C4    -0.0686     2.2199    -0.5599	C.2	1	noname	0.0593
6	C5    -1.9437     1.4681     0.6988	C.3	1	noname	-0.0355
7	C6     1.8351     0.7973    -1.0061	C.2	1	noname	0.0593
8	C7     1.9540    -1.4441    -0.2144	C.3	1	noname	-0.0355
9	C8     1.2404     2.1174    -1.2001	C.2	1	noname	0.0825
10	C9    -0.7709     3.4609    -0.6678	C.3	1	noname	-0.0355
11	C10     3.1216     0.5521    -1.5802	C.3	1	noname	-0.0355
12	O2     1.7850     3.0457    -1.8359	O.2	1	noname	-0.2986
13	H1    -1.8665     1.4532     1.7859	H	1	noname	0.0281
14	H2    -2.3037     2.4442     0.3734	H	1	noname	0.0281
15	H3    -2.6415     0.6966     0.3734	H	1	noname	0.0281
16	H4     2.0954    -1.6928     0.8374	H	1	noname	0.0281
17	H5     1.3785    -2.2323    -0.6998	H	1	noname	0.0281
18	H6     2.9255    -1.3521    -0.6998	H	1	noname	0.0281
19	H7    -0.9876     3.8436     0.3296	H	1	noname	0.0281
20	H8    -0.1558     4.1808    -1.2075	H	1	noname	0.0281
21	H9    -1.7049     3.3041    -1.2075	H	1	noname	0.0281
22	H10     3.8537     0.4125    -0.7848	H	1	noname	0.0281
23	H11     3.0792    -0.3459    -2.1966	H	1	noname	0.0281
24	H12     3.4125     1.4026    -2.1966	H	1	noname	0.0281
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	2
5	3	6	1
6	4	7	2
7	4	8	1
8	5	9	1
9	5	10	1
10	7	11	1
11	7	9	1
12	9	12	2
13	6	13	1
14	6	14	1
15	6	15	1
16	8	16	1
17	8	17	1
18	8	18	1
19	10	19	1
20	10	20	1
21	10	21	1
22	11	22	1
23	11	23	1
24	11	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1