@<TRIPOS>MOLECULE
FDBF00045
 16 15 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         7.4260    3.4200   -0.0480 C.3     1  FRG1       -0.0038
      2  C1         6.9160    3.4200    1.4090 C.3     1  FRG1        0.0545
      3  O2         7.1250    4.6970    2.0160 O.3     1  FRG1       -0.3920
      4  C3         5.4210    3.0490    1.4670 C.3     1  FRG1       -0.0389
      5  C1         6.6530    4.4430   -0.9030 C.3     1  FRG1        0.0465
      6  O2         7.0770    5.7690   -0.5760 O.3     1  FRG1       -0.3949
      7 H           8.4657    3.6726   -0.0549 H       1  FRG1        0.0312
      8 H           7.2746    2.4452   -0.4625 H       1  FRG1        0.0312
      9 H           7.4719    2.6843    1.9517 H       1  FRG1        0.0591
     10 H           6.6246    5.3715    1.5307 H       1  FRG1        0.2098
     11 H           4.8517    3.7769    0.9277 H       1  FRG1        0.0254
     12 H           5.0981    3.0278    2.4869 H       1  FRG1        0.0254
     13 H           5.2755    2.0847    1.0267 H       1  FRG1        0.0254
     14 H           6.8428    4.2551   -1.9391 H       1  FRG1        0.0558
     15 H           5.6058    4.3487   -0.7045 H       1  FRG1        0.0558
     16 H           8.0262    5.8583   -0.7547 H       1  FRG1        0.2094
@<TRIPOS>BOND
     1     5     6    1
     2     5     1    1
     3     1     2    1
     4     2     4    1
     5     2     3    1
     6     1     7    1
     7     1     8    1
     8     2     9    1
     9     3    10    1
    10     4    11    1
    11     4    12    1
    12     4    13    1
    13     5    14    1
    14     5    15    1
    15     6    16    1