%chk=000083946.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083946

0 1
 O  -5.7000001E-03  -1.566000     -0.3474000    
 O  -1.4000000E-03 -0.5005000       1.697000    
 C   3.1000001E-03  0.8135000     -0.3342000    
 C    1.272900       1.637700     -5.3700000E-02
 C   -1.260900       1.646200     -5.3599998E-02
 C    2.557800      0.8769000     -0.3951000    
 C   -2.550900      0.8940000     -0.3951000    
 C  -1.2000001E-03 -0.4762000      0.4719000    
 C    3.793200       1.708800     -8.7399997E-02
 C   -3.780800       1.734200     -8.7099999E-02
 C  -1.0800000E-02  -2.835300      0.3132000    
 C  -1.5300000E-02  -3.933400     -0.7287000    
 H   2.3000001E-03  0.5502000      -1.400800    
 H    1.239200       2.566700     -0.6366000    
 H    1.297700       1.926400       1.005000    
 H   -1.221100       2.575100     -0.6364000    
 H   -1.283800       1.934800       1.005200    
 H    2.557800      0.6078000      -1.457600    
 H    2.617400     -5.5700000E-02  0.1765000    
 H   -2.552700      0.6252000      -1.457600    
 H   -2.616800     -3.8300000E-02  0.1764000    
 H    3.794000       2.638500     -0.6653000    
 H    4.699300       1.150100     -0.3418000    
 H    3.839200       1.964600      0.9760000    
 H   -3.825100       1.990000      0.9763000    
 H   -4.690700       1.181600     -0.3417000    
 H   -3.775400       2.663900     -0.6649000    
 H   0.8831000      -2.923800      0.9407000    
 H  -0.9055000      -2.916600      0.9406000    
 H  -1.9300001E-02  -4.920000     -0.2572000    
 H  -0.8945000      -3.847000      -1.375800    
 H   0.8645000      -3.854100      -1.375700    


%chk=000083946-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083946

0 1
O -0.005859 -1.609958 -0.351231
O -0.000480 -0.547980 1.721921
C 0.003128 0.812558 -0.346025
C 1.289485 1.625261 -0.024215
C -1.277870 1.633694 -0.024087
C 2.601102 0.911698 -0.422152
C -2.594118 0.929361 -0.423115
C -0.001129 -0.476060 0.469047
C 3.849848 1.767497 -0.121150
C -3.837204 1.793208 -0.121685
C -0.009824 -2.929568 0.354511
C -0.016629 -4.007185 -0.724632
H 0.002165 0.534055 -1.416950
H 1.225101 2.596067 -0.556115
H 1.302443 1.850429 1.060749
H -1.206730 2.604497 -0.555152
H -1.289714 1.858061 1.061060
H 2.570246 0.660174 -1.501668
H 2.677577 -0.051694 0.120566
H -2.564577 0.678624 -1.502848
H -2.677353 -0.034039 0.118627
H 3.815777 2.727841 -0.669948
H 4.778711 1.244417 -0.413338
H 3.917891 2.000501 0.958064
H -3.904014 2.025662 0.957726
H -4.769440 1.276571 -0.414603
H -3.796623 2.753817 -0.669579
H 0.884939 -2.979960 1.001381
H -0.902113 -2.972571 1.005310
H -0.019530 -5.008128 -0.255569
H -0.912532 -3.920190 -1.362789
H 0.876930 -3.927362 -1.367009


