%chk=000117278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117278

0 1
 O  -0.4866000     -0.8802000     -2.7100001E-02
 O   0.8486000      -2.390100      -1.148500    
 O    3.106400      -2.887400      0.6041000    
 O    4.202500      -1.012900     -4.3499999E-02
 C    1.819600     -0.8733000      0.4895000    
 C    1.919800      0.6236000      0.2460000    
 C   0.6984000      -1.488000     -0.3344000    
 C   -1.630400      -1.365100     -0.7371000    
 C    2.213700       1.456100       1.308000    
 C    1.714600       1.109200      -1.030400    
 C   -2.843300     -0.6026000     -0.2907000    
 C    3.165400      -1.562100      0.3048000    
 C    2.305900       2.829800       1.084500    
 C    1.806900       2.483000      -1.253700    
 C    2.102600       3.343200     -0.1962000    
 C   -3.592800      -1.069100      0.7835000    
 C   -3.206600      0.5636000     -0.9549000    
 C   -4.720200     -0.3604000       1.198600    
 C   -4.333800       1.272300     -0.5396000    
 C   -5.090600      0.8103000      0.5372000    
 H    1.545700      -1.040000       1.541700    
 H   -1.762100      -2.436400     -0.5399000    
 H   -1.477900      -1.236800      -1.816100    
 H    2.375800       1.065000       2.307900    
 H    1.501200      0.4587000      -1.872900    
 H    2.537000       3.499600       1.907700    
 H    1.652600       2.882800      -2.251800    
 H    2.175600       4.412800     -0.3705000    
 H   -3.312000      -1.978600       1.307400    
 H   -2.622600      0.9340000      -1.793000    
 H   -5.309200     -0.7196000       2.037500    
 H   -4.622000       2.184400      -1.054100    
 H   -5.968100       1.362500      0.8607000    
 H    3.977800      -3.324900      0.4966000    


%chk=000117278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117278

0 1
O -0.676712 -0.671576 -0.045261
O 0.796302 -1.541153 -1.635131
O 2.193758 -2.770817 1.168132
O 3.924815 -1.572546 0.189097
C 1.661895 -0.542756 0.474209
C 2.198321 0.831528 0.074851
C 0.583030 -0.998080 -0.529136
C -1.829509 -0.980736 -0.976710
C 1.928431 1.951478 0.898120
C 2.933940 1.007614 -1.123930
C -3.102366 -0.618155 -0.257694
C 2.740139 -1.629274 0.563564
C 2.394445 3.235101 0.534899
C 3.398689 2.290484 -1.485379
C 3.132067 3.407074 -0.658570
C -3.789387 -1.585757 0.518005
C -3.628397 0.695720 -0.344666
C -4.979420 -1.246570 1.198965
C -4.817946 1.038330 0.335082
C -5.496118 0.067091 1.108429
H 1.173097 -0.482065 1.461360
H -1.769756 -2.053192 -1.231189
H -1.672310 -0.390200 -1.896367
H 1.351281 1.820769 1.821508
H 3.143748 0.145544 -1.764741
H 2.183515 4.094651 1.180698
H 3.970665 2.419108 -2.410900
H 3.496032 4.401108 -0.941786
H -3.388481 -2.604050 0.590244
H -3.102165 1.449884 -0.942202
H -5.503036 -2.002031 1.794985
H -5.216646 2.056036 0.260831
H -6.420911 0.331097 1.633573
H 2.880891 -3.490258 1.198410


