%chk=000020074.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020074

0 1
 O    2.286000       1.730200      5.9500001E-02
 O   -2.364900      0.3167000      0.2167000    
 O    1.509800       2.113600      -2.080500    
 O   -3.279200       1.559500       1.931300    
 C  -0.4610000       3.291600      0.2820000    
 C   -1.443600       2.823700     -0.7986000    
 C   0.9176000       3.616500     -0.2873000    
 C   -2.843300       2.566300     -0.2397000    
 C    3.696000     -7.5199999E-02  0.7837000    
 C    2.976200      0.5625000     -0.3961000    
 C    1.590600       2.410900     -0.8955000    
 C    4.469300      -1.322300      0.3648000    
 C   -2.878600       1.449800      0.7806000    
 C    5.221600      -1.931400       1.537200    
 C   -2.304000     -0.8261000       1.075900    
 C   -1.721000      -1.980500      0.3150000    
 C   -2.561400      -2.835600     -0.3892000    
 C  -0.3456000      -2.184500      0.3203000    
 C   -2.019600      -3.908700      -1.096800    
 C   0.1961000      -3.257600     -0.3874000    
 C  -0.6410000      -4.119500      -1.096000    
 H  -0.8592000       4.186500      0.7746000    
 H  -0.3586000       2.517100       1.051400    
 H   -1.516200       3.592800      -1.577100    
 H   -1.069200       1.915800      -1.284100    
 H   0.8480000       4.392500      -1.058700    
 H    1.566400       4.025800      0.4961000    
 H   -3.536400       2.306800      -1.047900    
 H   -3.230500       3.475000      0.2357000    
 H    4.375300      0.6603000       1.232900    
 H    2.966000     -0.3244000       1.564000    
 H    3.699100      0.8494000      -1.168800    
 H    2.252700     -0.1424000     -0.8220000    
 H    5.184400      -1.069500     -0.4267000    
 H    3.778800      -2.067200     -4.7499999E-02
 H    5.766900      -2.824000       1.215000    
 H    4.532200      -2.224100       2.335600    
 H    5.945400      -1.221700       1.950500    
 H   -1.683600     -0.5976000       1.951700    
 H   -3.311200      -1.076400       1.431800    
 H   -3.636600      -2.679200     -0.3985000    
 H   0.3161000      -1.517400      0.8660000    
 H   -2.671200      -4.579400      -1.649200    
 H    1.269900      -3.420700     -0.3877000    
 H  -0.2190000      -4.954500      -1.647500    


%chk=000020074-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020074

0 1
O 2.140183 1.703953 0.051659
O -2.475975 0.328266 0.116861
O 1.892856 2.702020 -2.039914
O -3.518913 1.635238 1.742277
C -0.487973 3.314882 0.387314
C -1.370354 2.913682 -0.816229
C 0.934649 3.783870 -0.029521
C -2.845430 2.646268 -0.416867
C 3.478706 -0.278054 0.515976
C 2.871778 0.574500 -0.598218
C 1.690568 2.717003 -0.803341
C 4.277696 -1.473609 -0.055641
C -3.001728 1.531205 0.605633
C 4.857949 -2.380894 1.050339
C -2.559968 -0.846099 1.057948
C -1.683360 -1.943837 0.510320
C -2.243892 -3.012201 -0.232973
C -0.284038 -1.927115 0.742524
C -1.423547 -4.046456 -0.737443
C 0.538559 -2.958595 0.239559
C -0.029821 -4.021904 -0.501069
H -0.971883 4.141107 0.944275
H -0.395472 2.464723 1.089157
H -1.355610 3.722744 -1.572471
H -0.959979 2.011298 -1.304486
H 0.864072 4.674299 -0.677843
H 1.509943 4.046859 0.876329
H -3.420490 2.369813 -1.320836
H -3.302335 3.551368 0.019446
H 4.141157 0.352449 1.139689
H 2.671947 -0.646401 1.179310
H 3.642975 0.993780 -1.270586
H 2.150558 0.003493 -1.212549
H 5.102614 -1.094259 -0.691725
H 3.622546 -2.071165 -0.722298
H 5.427787 -3.224555 0.620374
H 4.055145 -2.803371 1.684421
H 5.539954 -1.814304 1.711396
H -2.239273 -0.498075 2.055858
H -3.620768 -1.147203 1.119233
H -3.324726 -3.032876 -0.418191
H 0.157611 -1.102956 1.316744
H -1.868679 -4.867981 -1.309385
H 1.617244 -2.941926 0.431579
H 0.607215 -4.825585 -0.887133


