@<TRIPOS>MOLECULE
118796419
9 8 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.7064    -1.3946    -0.6670	O.3	1	noname	-0.3858
2	O2     1.0022    -0.6763     0.0710	O.3	1	noname	-0.2115
3	O3    -0.0304     1.3200     0.2165	O.2	1	noname	-0.2464
4	C1    -1.3999    -0.5744     0.4509	C.3	1	noname	0.1288
5	C2    -0.1082     0.0726     0.2402	C.2	1	noname	0.1482
6	H1    -2.1725     0.1858     0.5665	H	1	noname	0.0673
7	H2    -1.3565    -1.1880     1.3507	H	1	noname	0.0673
8	H3    -2.5735    -1.8289    -0.5255	H	1	noname	0.2107
9	H4     1.7407    -0.3404    -0.4789	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	4	1
2	1	8	1
3	2	5	1
4	2	9	1
5	3	5	2
6	4	5	1
7	4	6	1
8	4	7	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1