@<TRIPOS>MOLECULE
57371614
14 13 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.9675     1.2185    -0.1148	O.3	1	noname	-0.2188
2	O2     3.4833    -1.5026     0.0485	O.3	1	noname	-0.2188
3	O3     1.4229    -2.4110     0.0938	O.2	1	noname	-0.2558
4	O4     0.0929     2.1268    -0.1601	O.2	1	noname	-0.2558
5	C1    -0.0034    -0.2169    -0.0308	C.3	1	noname	0.0427
6	C2     1.5192    -0.0672    -0.0355	C.3	1	noname	0.0427
7	C3    -0.6225     1.1032    -0.1052	C.2	1	noname	0.1350
8	C4     2.1383    -1.3874     0.0389	C.2	1	noname	0.1350
9	H1     1.8326     0.4298    -0.9535	H	1	noname	0.0378
10	H2     1.8284     0.5280     0.8237	H	1	noname	0.0378
11	H3    -0.3126    -0.8122    -0.8900	H	1	noname	0.0378
12	H4    -0.3168    -0.7140     0.8872	H	1	noname	0.0378
13	H5    -2.3938     2.0149     0.2652	H	1	noname	0.2213
14	H6     3.9096    -2.2991    -0.3315	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	7	1
2	1	13	1
3	2	8	1
4	2	14	1
5	3	8	2
6	4	7	2
7	5	6	1
8	5	7	1
9	5	11	1
10	5	12	1
11	6	8	1
12	6	9	1
13	6	10	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
