%chk=000087584.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087584

0 1
 O  -0.3254000     -0.7386000      -1.355100    
 O   -4.313600       1.685600     -0.3648000    
 O   0.4756000     -0.1910000      0.7744000    
 O   -6.218500       2.861200      0.1030000    
 C    5.628300      0.2419000      0.3019000    
 C    7.037600      0.1926000     -0.2971000    
 C    4.529400     -7.6600000E-02 -0.7149000    
 C    8.139900      0.4325000      0.7373000    
 C    3.121000     -8.5500002E-02 -0.1073000    
 C    9.528700      0.3007000      0.1115000    
 C    2.008400     -0.4852000      -1.072600    
 C    10.62500      0.5006000       1.146000    
 C   0.6510000     -0.4358000     -0.4126000    
 C   -4.194000     -0.6808000      0.2296000    
 C   -1.618000     -0.7154000     -0.8267000    
 C   -3.614100      0.4629000     -0.3212000    
 C   -5.557600     -0.5886000      0.7684000    
 C   -2.324000      0.4620000     -0.8547000    
 C   -3.432900      -1.857400      0.2345000    
 C   -2.138100      -1.874000     -0.2967000    
 C   -6.199000      0.5873000      0.7138000    
 C   -6.208900      -1.800600       1.367600    
 C   -5.601000       1.802500      0.1357000    
 H    5.450800       1.236500      0.7289000    
 H    5.566700     -0.4745000       1.130400    
 H    7.117200      0.9403000      -1.095800    
 H    7.190800     -0.7883000     -0.7644000    
 H    4.565000      0.6554000      -1.530900    
 H    4.728300      -1.058700      -1.161400    
 H    8.021800       1.431400       1.174200    
 H    8.036600     -0.2918000       1.554500    
 H    3.111300     -0.7717000      0.7498000    
 H    2.908300      0.9117000      0.2996000    
 H    9.647700       1.039900     -0.6891000    
 H    9.641400     -0.6908000     -0.3422000    
 H    2.179300      -1.504700      -1.434600    
 H    2.001100      0.2015000      -1.926100    
 H    10.55320     -0.2461000       1.943300    
 H    11.60970      0.4042000      0.6781000    
 H    10.55990       1.495000       1.599200    
 H   -1.897500       1.365800      -1.277800    
 H   -3.825400      -2.782700      0.6482000    
 H   -1.562500      -2.794700     -0.2855000    
 H   -7.207600      0.6916000       1.102500    
 H   -5.633600      -2.168100       2.224100    
 H   -6.294500      -2.602700      0.6267000    
 H   -7.221200      -1.584700       1.727700    


%chk=000087584-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000087584

0 1
O -0.335249 0.109112 -0.408667
O -4.836232 1.222418 -1.383826
O 0.733573 -1.413006 1.044863
O -6.972361 1.877769 -1.959954
C 5.905898 -0.176662 0.369270
C 7.183723 0.393396 -0.286443
C 4.608183 0.223427 -0.368084
C 8.478028 0.008321 0.465069
C 3.340779 -0.356456 0.297096
C 9.758192 0.578792 -0.187071
C 2.052097 0.079288 -0.427221
C 11.044784 0.195995 0.576050
C 0.797416 -0.518834 0.180121
C -4.480942 -0.577821 0.269995
C -1.693173 -0.195082 -0.113133
C -3.981974 0.404138 -0.640338
C -5.927694 -0.719891 0.418670
C -2.603339 0.599504 -0.836034
C -3.524960 -1.357785 0.977625
C -2.141742 -1.185976 0.804826
C -6.760623 0.096680 -0.322717
C -6.496347 -1.746484 1.372376
C -6.286553 1.108937 -1.260807
H 5.849383 0.170198 1.422242
H 5.977738 -1.283530 0.410931
H 7.107044 1.499857 -0.338928
H 7.249419 0.036571 -1.335780
H 4.536816 1.330819 -0.404942
H 4.665332 -0.120550 -1.422246
H 8.413111 0.365402 1.514398
H 8.557264 -1.097851 0.518464
H 3.396624 -1.461436 0.315919
H 3.293937 -0.033702 1.355385
H 9.675766 1.683532 -0.244684
H 9.825988 0.217626 -1.233702
H 2.083006 -0.220356 -1.494842
H 1.944087 1.180606 -0.433201
H 11.166851 -0.902874 0.620840
H 11.945010 0.616356 0.091056
H 11.014459 0.571667 1.616396
H -2.247952 1.356884 -1.538106
H -3.872334 -2.119183 1.683141
H -1.425995 -1.791821 1.359013
H -7.848326 0.021093 -0.239115
H -6.158145 -1.557945 2.408677
H -6.166162 -2.767345 1.103131
H -7.597806 -1.729695 1.363686


