%chk=000124593.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124593

0 1
 O    5.028600     -0.8597000      0.4626000    
 O    8.415700     -0.5525000     -0.3337000    
 O   -3.704100      -1.291800     -0.5347000    
 O   0.6203000      0.6507000     -0.6352000    
 O   -5.361600       2.167600      0.8902000    
 C    6.324700      -1.490800      0.4864000    
 C    7.213700     -0.4502000     -0.1444000    
 C    5.214800      0.3873000     -0.1200000    
 C    6.278200      -2.762200     -0.3490000    
 C    6.724000      -1.761500       1.930000    
 C    6.439800      0.7287000     -0.5100000    
 C    4.030600       1.210300     -0.2475000    
 C    2.843300      0.7482000      0.1878000    
 C   -3.427100       1.026600      0.1810000    
 C    4.273400       2.549300     -0.8833000    
 C   -2.928400     -0.1827000     -0.3024000    
 C    1.516000       1.437600      0.1482000    
 C   -5.680300     -6.3400000E-02  0.2071000    
 C   -4.866600       1.134900      0.4630000    
 C  -0.7089000      0.7741000     -0.3673000    
 C   -5.050500      -1.209300     -0.2779000    
 C   -1.565000     -0.3077000     -0.5768000    
 C   -2.573700       2.112700      0.3925000    
 C   -1.212500       1.981800      0.1165000    
 C   -7.057300     -5.6400001E-02  0.4444000    
 C   -5.803900      -2.358300     -0.5277000    
 C   -7.804400      -1.207300      0.1928000    
 C   -7.179200      -2.356200     -0.2923000    
 H    5.983400      -2.543700      -1.382100    
 H    7.252200      -3.261800     -0.3758000    
 H    5.534900      -3.462100      4.8099998E-02
 H    5.998200      -2.421800       2.417500    
 H    7.715700      -2.221500       1.993600    
 H    6.745300     -0.8335000       2.513100    
 H    6.824100       1.617900     -0.9745000    
 H    2.778500     -0.2415000      0.6384000    
 H    3.367400       3.152100     -0.9754000    
 H    4.978000       3.144000     -0.2905000    
 H    4.669000       2.436400      -1.899400    
 H    1.168900       1.518100       1.186900    
 H    1.574300       2.439700     -0.2817000    
 H   -1.167600      -1.246900     -0.9537000    
 H   -2.949300       3.062000      0.7637000    
 H  -0.5844000       2.854000      0.2704000    
 H   -7.561400      0.8287000      0.8220000    
 H   -5.326900      -3.258700     -0.9056000    
 H   -8.875200      -1.209100      0.3749000    
 H   -7.764000      -3.250500     -0.4871000    


%chk=000124593-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124593

0 1
O 5.232148 -0.851152 0.441863
O 8.727620 -0.500039 -0.505906
O -3.883693 -1.387171 -0.269782
O 0.571921 0.223195 0.045106
O -5.551401 2.393648 0.556376
C 6.624221 -1.461232 0.418198
C 7.487364 -0.373780 -0.288428
C 5.309870 0.404930 -0.171185
C 6.557401 -2.753845 -0.406700
C 7.066391 -1.676953 1.872091
C 6.586174 0.727092 -0.606909
C 4.066344 1.187188 -0.263002
C 2.913726 0.644524 0.238145
C -3.585579 1.016910 0.244686
C 4.185462 2.556377 -0.907257
C -3.055264 -0.275987 -0.037165
C 1.562914 1.297064 0.284383
C -5.880042 0.046492 0.053514
C -5.045777 1.250635 0.306496
C -0.784197 0.554638 0.124673
C -5.280377 -1.212218 -0.222346
C -1.673401 -0.518322 -0.098840
C -2.663449 2.072398 0.462891
C -1.278274 1.863566 0.407238
C -7.298405 0.123290 0.079937
C -6.054735 -2.366900 -0.466749
C -8.084207 -1.015334 -0.161055
C -7.457700 -2.262393 -0.434975
H 6.140506 -2.561586 -1.410033
H 7.580625 -3.151617 -0.526105
H 5.931522 -3.508311 0.099803
H 6.433442 -2.435097 2.364144
H 8.115321 -2.021931 1.876059
H 7.008232 -0.736761 2.446698
H 6.886235 1.646491 -1.105209
H 2.957138 -0.356069 0.685273
H 3.205860 3.042787 -1.036858
H 4.814145 3.229442 -0.294633
H 4.659681 2.482804 -1.902865
H 1.378537 1.736951 1.289394
H 1.440027 2.094027 -0.473939
H -1.290370 -1.517826 -0.315767
H -3.079178 3.062498 0.677266
H -0.597643 2.701536 0.577814
H -7.743878 1.100414 0.294198
H -5.549683 -3.314400 -0.675016
H -9.176429 -0.946544 -0.138954
H -8.068444 -3.151826 -0.623465


