%chk=000093772.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093772

0 1
 O    2.601100      0.2262000      0.1829000    
 O    1.069500       2.402500     -0.1691000    
 C   -1.567800     -8.4799998E-02  2.6000001E-02
 C  -0.6730000      -1.312900      0.2953000    
 C   0.7122000      -1.212100     -0.3494000    
 C  -0.8754000       1.177100      0.5638000    
 C   -2.903900     -0.2738000      0.7700000    
 C   -1.875600      6.9799997E-02  -1.475300    
 C    1.396900      8.7700002E-02  1.7200001E-02
 C   0.5429000       1.328000      8.3999999E-02
 C    1.573200      -2.407800      5.4699998E-02
 H   -1.173100      -2.221500     -6.5600000E-02
 H  -0.5555000      -1.436500       1.381200    
 H   0.6151000      -1.222400      -1.441300    
 H  -0.8365000       1.159800       1.660100    
 H   -1.435000       2.073400      0.2701000    
 H   -3.434200      -1.162800      0.4104000    
 H   -3.562900      0.5899000      0.6259000    
 H   -2.746000     -0.3942000       1.847700    
 H   -2.324100     -0.8445000      -1.879900    
 H  -0.9798000      0.2903000      -2.063900    
 H   -2.582500      0.8897000      -1.647800    
 H    1.760800      -2.416700       1.134200    
 H    1.086000      -3.350200     -0.2168000    
 H    2.546100      -2.377300     -0.4483000    


%chk=000093772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093772

0 1
O 2.588204 0.169532 0.587320
O 0.970987 2.397362 -0.561247
C -1.589770 -0.079092 0.031431
C -0.675458 -1.311625 0.304168
C 0.754561 -1.216022 -0.311590
C -0.870465 1.210362 0.554777
C -2.922702 -0.256429 0.801667
C -1.895822 0.071152 -1.482885
C 1.420534 0.090609 0.130696
C 0.534150 1.355750 -0.011116
C 1.622282 -2.447951 0.004878
H -1.164394 -2.223334 -0.091058
H -0.576680 -1.453045 1.400707
H 0.633557 -1.134007 -1.414857
H -0.782295 1.135703 1.660276
H -1.451348 2.120813 0.320811
H -3.466514 -1.149905 0.441976
H -3.582376 0.619506 0.659115
H -2.746866 -0.378709 1.886989
H -2.373836 -0.845756 -1.875187
H -0.989241 0.266780 -2.084398
H -2.588633 0.915277 -1.655447
H 1.748744 -2.566892 1.095971
H 1.151797 -3.364347 -0.394575
H 2.630084 -2.348832 -0.432322


