%chk=000081647.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081647

0 1
 O  -2.3200000E-02   1.793700      0.3683000    
 C   -2.542800      0.4544000      0.2616000    
 C    2.517600      0.5201000      8.2500003E-02
 C   -3.594700     -0.4361000      0.9462000    
 C   -3.066400      0.9919000      -1.081800    
 C    3.292400      0.4275000      -1.243800    
 C    3.387400      5.1700000E-02   1.262300    
 C   -1.213500     -0.2612000      0.1049000    
 C    1.199300     -0.2296000      1.9400001E-02
 C   -4.925800      0.2960000       1.108400    
 C   -4.399800       1.718100     -0.9111000    
 C    4.612800       1.193000      -1.173600    
 C    4.707300      0.8187000       1.322000    
 C   -5.437700      0.8356000     -0.2240000    
 C    5.468800      0.7326000      2.4999999E-03
 C  -1.3000000E-02  0.4448000      0.1657000    
 C   -1.204600      -1.639800     -0.1021000    
 C    1.209600      -1.608800     -0.1880000    
 C   7.7000000E-03  -2.313900     -0.2488000    
 C   1.8700000E-02  -3.788700     -0.4705000    
 H   -2.406500       1.301200      0.9478000    
 H    2.317000       1.586400      0.2501000    
 H   -3.238900     -0.7683000       1.929300    
 H   -3.815300      -1.333800      0.3589000    
 H   -3.194200      0.1638000      -1.791400    
 H   -2.339900       1.676800      -1.534800    
 H    2.683800      0.8299000      -2.063200    
 H    3.507200     -0.6176000      -1.499100    
 H    3.608900      -1.020000       1.183600    
 H    2.845600      0.1895000       2.206300    
 H   -4.802300       1.125600       1.815500    
 H   -5.669900     -0.3826000       1.540900    
 H   -4.245600       2.629500     -0.3204000    
 H   -4.775300       2.032600      -1.891500    
 H    4.407800       2.266500      -1.078300    
 H    5.167400       1.056300      -2.108800    
 H    5.328200      0.4202000       2.132300    
 H    4.507800       1.870600       1.560800    
 H   -5.696400     -2.9000000E-03 -0.8822000    
 H   -6.357400       1.408400     -6.0300000E-02
 H    5.791900     -0.3023000     -0.1649000    
 H    6.375700       1.344900      5.9999999E-02
 H   -2.113600      -2.224100     -0.1850000    
 H    2.148400      -2.144700     -0.3015000    
 H  -0.8654000       2.179800      8.3400004E-02
 H  -7.3899999E-02  -4.312900      0.4858000    
 H  -0.8078000      -4.092400      -1.122100    
 H   0.9449000      -4.113900     -0.9564000    


%chk=000081647-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081647

0 1
O -0.019258 1.729584 0.441149
C -2.596160 0.347761 0.331593
C 2.516806 0.494765 0.152987
C -3.797209 -0.514322 0.798217
C -2.947196 1.040231 -1.024901
C 3.177851 0.540882 -1.257745
C 3.537218 -0.031035 1.202529
C -1.265580 -0.404057 0.236963
C 1.222218 -0.313982 0.133327
C -5.082512 0.337528 0.924606
C -4.234746 1.890697 -0.917316
C 4.470736 1.389901 -1.250919
C 4.827613 0.822617 1.211126
C -5.426388 1.044904 -0.408471
C 5.477138 0.878241 -0.192561
C -0.038008 0.320988 0.275834
C -1.194869 -1.804543 0.053520
C 1.229149 -1.717139 -0.058546
C 0.040201 -2.482048 -0.094303
C 0.083266 -3.991991 -0.263582
H -2.502393 1.157432 1.099098
H 2.258949 1.534821 0.429220
H -3.559548 -1.005622 1.761362
H -3.978758 -1.320560 0.058585
H -3.087582 0.246479 -1.786159
H -2.099514 1.660676 -1.375401
H 2.453765 0.946051 -1.990631
H 3.416285 -0.493692 -1.581961
H 3.802555 -1.083519 0.971483
H 3.069122 -0.033140 2.205949
H -4.941336 1.101013 1.718281
H -5.927297 -0.302096 1.245946
H -4.062426 2.735263 -0.216862
H -4.474236 2.337746 -1.901535
H 4.210406 2.444926 -1.024836
H 4.934440 1.382707 -2.257033
H 5.545775 0.416289 1.950388
H 4.580340 1.854145 1.537946
H -5.679765 0.279739 -1.171324
H -6.323284 1.682060 -0.283442
H 5.817391 -0.139784 -0.476484
H 6.377031 1.523933 -0.174197
H -2.122536 -2.387196 0.025427
H 2.192801 -2.227848 -0.180058
H -0.931396 2.061930 0.630927
H 0.030188 -4.510628 0.714102
H -0.764203 -4.357091 -0.871823
H 1.017258 -4.316522 -0.755575


