%chk=000112154.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112154

0 1
 O   -4.705900       1.236100     -6.5700002E-02
 O    1.526200       1.242900      0.2610000    
 O    1.289200     -0.8824000     -0.6690000    
 C    7.567200     -0.9311000     -0.3524000    
 C    7.111600      0.4435000      0.2105000    
 C    7.401600      -2.044300      0.7034000    
 C    9.016200     -0.8299000     -0.8431000    
 C    5.635400      0.6551000      0.2239000    
 C   -7.877000     -0.7660000     -0.2950000    
 C   -9.242600     -0.6962000      0.3942000    
 C    7.814400      -3.424200      0.2090000    
 C   -6.902100      0.3112000      0.1779000    
 C   -10.21000      -1.789500     -6.1299998E-02
 C    5.002700       1.227400     -0.8797000    
 C    4.887000      0.2805000       1.340000    
 C   -5.571500      0.2223000     -0.5578000    
 C    3.621800       1.425400     -0.8671000    
 C    3.506200      0.4788000       1.352700    
 C    2.909800       1.046100      0.2488000    
 C   -11.57250      -1.633300      0.5969000    
 C   -3.360900      0.9749000     -0.1074000    
 C  -0.6330000      0.4443000     -0.1905000    
 C   -2.851000      0.1492000      -1.102600    
 C   -2.521700       1.537800      0.8469000    
 C   0.7939000      0.1668000     -0.2348000    
 C   -1.482200     -0.1169000      -1.144300    
 C   -1.153000       1.271500      0.8053000    
 H    6.945100      -1.181300      -1.222200    
 H    7.559400       1.249000     -0.3880000    
 H    7.520300      0.5893000       1.219600    
 H    7.980400      -1.800600       1.602500    
 H    6.351500      -2.105700       1.008300    
 H    9.330000      -1.742700      -1.358100    
 H    9.128500     -7.4000000E-03  -1.557900    
 H    9.703800     -0.6506000     -9.8999999E-03
 H   -8.020300     -0.6744000      -1.378900    
 H   -7.437100      -1.755100     -0.1166000    
 H   -9.101900     -0.7687000       1.479800    
 H   -9.688300      0.2871000      0.1984000    
 H    8.894300      -3.488400      4.7300000E-02
 H    7.550400      -4.182300      0.9538000    
 H    7.304400      -3.676600     -0.7259000    
 H   -7.335800       1.307400      2.6799999E-02
 H   -6.731200      0.2183000       1.257600    
 H   -9.797800      -2.775100      0.1834000    
 H   -10.33040      -1.748500      -1.150000    
 H    5.573400       1.521100      -1.756700    
 H    5.366600     -0.1603000       2.209800    
 H   -5.725900      0.3724000      -1.632600    
 H   -5.160400     -0.7808000     -0.3846000    
 H    3.129200       1.870400      -1.725900    
 H    2.923900      0.1893000       2.221800    
 H   -12.24860      -2.425600      0.2604000    
 H   -11.49090      -1.696300       1.686800    
 H   -12.02430     -0.6697000      0.3406000    
 H   -3.472800     -0.2835000      -1.880200    
 H   -2.923200       2.180000       1.625600    
 H   -1.091900     -0.7562000      -1.932100    
 H  -0.5184000       1.712100       1.569800    


%chk=000112154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000112154

0 1
O -4.690011 0.391622 -0.185866
O 1.618513 0.093903 0.589912
O 1.075646 -1.842742 1.822879
C 8.070947 -0.082501 -0.519884
C 7.392123 0.359251 0.817709
C 7.837372 -1.591507 -0.796930
C 9.574727 0.277935 -0.488113
C 5.874138 0.260008 0.805671
C -8.340234 -0.693493 0.097846
C -9.654136 -0.091799 -0.449473
C 8.302394 -2.061333 -2.192913
C -7.094938 0.134825 -0.295229
C -10.905973 -0.911999 -0.062788
C 5.095993 1.186150 0.059698
C 5.187948 -0.758342 1.511588
C -5.804588 -0.479575 0.248636
C 3.692510 1.090910 0.016821
C 3.778969 -0.878607 1.486323
C 3.038785 0.057008 0.726618
C -12.214693 -0.305604 -0.613360
C -3.391127 0.033602 0.174758
C -0.677428 -0.509541 0.786612
C -3.056851 -1.110735 0.948183
C -2.368451 0.904398 -0.288489
C 0.722698 -0.852076 1.137465
C -1.706796 -1.370452 1.246607
C -1.026387 0.634203 0.013801
H 7.592727 0.490697 -1.343735
H 7.693785 1.406080 1.024380
H 7.805011 -0.259252 1.639541
H 8.358973 -2.181027 -0.013060
H 6.757611 -1.811150 -0.687113
H 10.074165 0.029222 -1.441235
H 9.722096 1.358939 -0.303804
H 10.092612 -0.275648 0.319479
H -8.231480 -1.732392 -0.278449
H -8.406330 -0.766442 1.203705
H -9.767210 0.946807 -0.074741
H -9.592165 -0.018446 -1.555212
H 9.395806 -1.963117 -2.320413
H 8.043275 -3.123409 -2.357766
H 7.814197 -1.469520 -2.990649
H -7.021033 0.207019 -1.397195
H -7.190733 1.168165 0.089531
H -10.967025 -0.984917 1.042376
H -10.791635 -1.949934 -0.437062
H 5.595269 1.993990 -0.489155
H 5.764548 -1.482357 2.099956
H -5.648519 -1.502205 -0.153213
H -5.821621 -0.529503 1.357145
H 3.089304 1.803837 -0.553725
H 3.271217 -1.672739 2.033494
H -13.094101 -0.909631 -0.323996
H -12.368430 0.720608 -0.229429
H -12.191785 -0.249692 -1.718104
H -3.829959 -1.791636 1.314590
H -2.655857 1.777961 -0.880965
H -1.426487 -2.246442 1.840964
H -0.235578 1.299225 -0.341723


