@<TRIPOS>MOLECULE
72941844
15 14 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.8075    -0.7491     0.0091	O.3	1	noname	-0.3820
2	O2     2.2267     1.8412    -1.1530	O.3	1	noname	-0.2104
3	O3     0.5321     0.6071    -1.9764	O.2	1	noname	-0.2450
4	O4    -1.9615    -1.4669    -0.2847	O.3	1	noname	-0.2181
5	O5    -1.0064     0.5559    -0.0230	O.2	1	noname	-0.2549
6	C1     1.5101    -0.1720     0.0125	C.3	1	noname	0.1486
7	C2     0.4615    -1.2737    -0.1539	C.3	1	noname	0.0691
8	C3     1.3971     0.7781    -1.0903	C.2	1	noname	0.1502
9	C4    -0.8725    -0.6803    -0.1504	C.2	1	noname	0.1363
10	H1     1.3455     0.3465     0.9571	H	1	noname	0.0715
11	H2     0.5458    -1.9830     0.6694	H	1	noname	0.0405
12	H3     0.6260    -1.7922    -1.0985	H	1	noname	0.0405
13	H4     2.8833    -1.3868     0.7493	H	1	noname	0.2112
14	H5     1.9247     2.6744    -1.5713	H	1	noname	0.2214
15	H6    -2.7708    -1.1148    -0.7106	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	6	1
2	1	13	1
3	2	8	1
4	2	14	1
5	3	8	2
6	4	9	1
7	4	15	1
8	5	9	2
9	6	7	1
10	6	8	1
11	6	10	1
12	7	9	1
13	7	11	1
14	7	12	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1