%chk=000078848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078848

0 1
 O   -2.762000      0.5996000     -0.1927000    
 O    1.795000      0.3096000     -0.1867000    
 O   -2.281100     -0.5631000      0.5393000    
 O    3.243300      0.2164000     -0.3009000    
 C  -0.7167000       1.665600      0.5140000    
 C  -9.5700003E-02   1.630000     -0.8943000    
 C   -2.259700       1.725500      0.5302000    
 C    1.442100       1.490100     -0.9107000    
 C   -2.835000       1.687800       1.947800    
 C   -2.730700       2.994400     -0.1891000    
 C    1.925500       1.318200      -2.355000    
 C    2.148100       2.684700     -0.2653000    
 C   -3.129200      -1.630600      0.1411000    
 C    3.646800     -0.6328000      0.7636000    
 C   -3.058700      -1.796500      -1.389800    
 C    2.931800      -1.992200      0.6330000    
 C   -2.666000      -2.884400      0.8844000    
 C   -4.559200      -1.278500      0.5629000    
 C    5.168600     -0.7661000      0.6908000    
 C    3.249700      4.1700002E-02   2.080600    
 C   -1.664100      -2.090700      -1.930600    
 C    3.207500      -2.728800     -0.6728000    
 H  -0.3306000       2.537900       1.056000    
 H  -0.3704000      0.7882000       1.073400    
 H  -0.3635000       2.540100      -1.442800    
 H  -0.5295000      0.7901000      -1.445000    
 H   -2.463200      0.8331000       2.523200    
 H   -3.927300       1.602400       1.925200    
 H   -2.571100       2.594300       2.503200    
 H   -2.518100       2.959900      -1.262500    
 H   -3.820500       3.091700     -0.1129000    
 H   -2.279700       3.895900      0.2379000    
 H    1.556300      0.3771000      -2.779000    
 H    3.017800       1.289800      -2.435500    
 H    1.575800       2.141400      -2.987700    
 H    1.979100       2.710100      0.8165000    
 H    1.793900       3.628800     -0.6932000    
 H    3.234500       2.652500     -0.4051000    
 H   -3.726400      -2.611400      -1.698100    
 H   -3.428900     -0.8981000      -1.898600    
 H    3.238200      -2.641400       1.463600    
 H    1.845000      -1.877700      0.7283000    
 H   -1.602800      -3.082400      0.7106000    
 H   -2.772700      -2.753400       1.967700    
 H   -3.241600      -3.766500      0.5860000    
 H   -4.956400     -0.4141000      1.9400001E-02
 H   -5.240400      -2.117700      0.3840000    
 H   -4.601000      -1.024600       1.628500    
 H    5.494900      -1.106700     -0.2975000    
 H    5.649400      0.2073000      0.8441000    
 H    5.549900      -1.460200       1.446700    
 H    2.163600      0.1153000       2.203600    
 H    3.638500     -0.5146000       2.940700    
 H    3.640500       1.064600       2.129300    
 H  -0.9253000      -1.367900      -1.580000    
 H   -1.673600      -2.062800      -3.025000    
 H   -1.329500      -3.089100      -1.632500    
 H    2.930600      -2.122300      -1.540400    
 H    2.620400      -3.652500     -0.7097000    
 H    4.261300      -3.007000     -0.7634000    


%chk=000078848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078848

0 1
O -2.695396 0.664361 -0.176371
O 1.578640 0.410646 -0.415930
O -2.083540 -0.491864 0.664290
O 3.091083 0.067197 -0.388195
C -0.719614 2.057599 0.466078
C -0.091599 1.995621 -0.942309
C -2.268327 1.938581 0.476644
C 1.451178 1.794565 -0.972789
C -2.816284 2.013433 1.916700
C -2.959442 2.976507 -0.437098
C 1.967884 1.808396 -2.427106
C 2.210647 2.810335 -0.094778
C -2.811616 -1.739245 0.276163
C 3.295178 -0.917301 0.719950
C -2.604594 -2.036784 -1.234271
C 2.457370 -2.200143 0.460420
C -2.117849 -2.770742 1.194122
C -4.310934 -1.608552 0.616648
C 4.817427 -1.159130 0.609139
C 2.925642 -0.284872 2.077775
C -1.135820 -2.214237 -1.671128
C 2.707462 -2.871800 -0.904773
H -0.451659 3.005434 0.972712
H -0.314007 1.229490 1.074215
H -0.301990 2.925192 -1.507387
H -0.557944 1.161634 -1.500328
H -2.366203 1.225279 2.542557
H -3.912182 1.876036 1.917210
H -2.585496 2.997599 2.364689
H -2.688202 2.822085 -1.494844
H -4.056847 2.902315 -0.345900
H -2.649218 3.994378 -0.139008
H 1.399814 1.088770 -3.042940
H 3.033781 1.526589 -2.458259
H 1.857557 2.815770 -2.869412
H 1.888754 2.744590 0.958101
H 2.024201 3.838899 -0.455643
H 3.294474 2.612310 -0.136915
H -3.189838 -2.944789 -1.485272
H -3.055473 -1.199229 -1.798652
H 2.663910 -2.913578 1.283953
H 1.390100 -1.918867 0.535593
H -1.022534 -2.741944 1.067473
H -2.352751 -2.568577 2.253563
H -2.473776 -3.785858 0.941375
H -4.784633 -0.836609 -0.012333
H -4.828735 -2.570700 0.447726
H -4.439021 -1.322204 1.675678
H 5.097621 -1.476649 -0.408828
H 5.375063 -0.238099 0.852306
H 5.117732 -1.949938 1.320113
H 1.850731 -0.039099 2.104871
H 3.147240 -0.987980 2.901887
H 3.502790 0.642083 2.243855
H -0.518127 -1.362705 -1.334645
H -1.066352 -2.274984 -2.772939
H -0.689714 -3.139519 -1.261656
H 2.562696 -2.140858 -1.719365
H 1.998287 -3.705301 -1.061351
H 3.729958 -3.283534 -0.986579


