@<TRIPOS>MOLECULE
90479644
8 7 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.2038    -0.6145    -0.3201	O.3	1	noname	-0.1896
2	O2    -2.2973     0.1605    -0.6618	O.3	1	noname	-0.1896
3	O3     0.0141     1.2197     0.2208	O.2	1	noname	-0.2186
4	O4    -1.1076    -1.6738    -1.2027	O.2	1	noname	-0.2186
5	C1     0.0390     0.0651    -0.2574	C.2	1	noname	0.1864
6	C2    -1.1326    -0.5191    -0.7245	C.2	1	noname	0.1864
7	H1     1.9024    -0.4521     0.3477	H	1	noname	0.2218
8	H2    -3.1426    -0.3244    -0.5584	H	1	noname	0.2218
@<TRIPOS>BOND
1	1	5	1
2	1	7	1
3	2	6	1
4	2	8	1
5	3	5	2
6	4	6	2
7	5	6	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1