%chk=000062578.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062578

0 1
 O   -1.874700      0.4152000      0.4161000    
 O   -3.420900       1.696400     -0.7186000    
 C   -4.749700      -1.066900      0.4872000    
 C   -4.116900      0.2047000       1.073400    
 C   0.5023000      0.3770000      6.4700000E-02
 C    1.672600      0.9530000     -0.7307000    
 C  -0.8240000      0.9825000     -0.3731000    
 C   -5.479200     -0.7747000     -0.8264000    
 C   -3.673100      -2.128900      0.2555000    
 C    2.982100      0.3232000     -0.3307000    
 C   -3.132400      0.8673000      0.1334000    
 C    3.727000      0.8906000      0.6928000    
 C    3.421900     -0.8141000     -0.9919000    
 C    4.938900      0.3078000       1.063200    
 C    4.633800      -1.397100     -0.6212000    
 C    5.392200     -0.8361000      0.4064000    
 H   -5.474600      -1.453900       1.213500    
 H   -3.619800     -1.0200000E-02   2.027300    
 H   -4.894300      0.9435000       1.304600    
 H   0.6445000      0.5505000       1.139300    
 H   0.4555000     -0.7137000     -5.1100001E-02
 H    1.508600      0.8031000      -1.805700    
 H    1.727600       2.039900     -0.5873000    
 H  -0.8089000       2.068800     -0.2266000    
 H   -1.007900      0.7622000      -1.431100    
 H   -4.792000     -0.4798000      -1.625900    
 H   -6.015900      -1.666400      -1.168500    
 H   -6.215300      2.5000000E-02 -0.6929000    
 H   -2.972600      -1.844700     -0.5364000    
 H   -3.102000      -2.315400       1.171100    
 H   -4.135100      -3.076200     -4.3900002E-02
 H    3.381600       1.780100       1.211800    
 H    2.837600      -1.259700      -1.791900    
 H    5.529300      0.7442000       1.863600    
 H    4.986600      -2.288100      -1.132200    
 H    6.335600      -1.290100      0.6950000    


%chk=000062578-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062578

0 1
O -1.757471 0.316542 0.408746
O -3.373735 1.376991 -0.889770
C -4.940161 -1.057426 0.519491
C -4.046358 0.081220 1.115114
C 0.635506 0.327174 -0.000544
C 1.813705 0.851201 -0.869612
C -0.709750 0.836556 -0.518560
C -5.962254 -0.522366 -0.510070
C -4.082825 -2.199938 -0.074781
C 3.159680 0.341114 -0.373512
C -3.079602 0.671838 0.105305
C 3.823004 0.982224 0.705051
C 3.761254 -0.807780 -0.947886
C 5.050744 0.488108 1.199434
C 4.989651 -1.306709 -0.457169
C 5.638574 -0.660658 0.620046
H -5.505296 -1.466899 1.382537
H -3.468851 -0.308635 1.970326
H -4.702687 0.896719 1.472967
H 0.773144 0.651869 1.047639
H 0.637434 -0.778641 0.003020
H 1.654653 0.539375 -1.920379
H 1.799836 1.959342 -0.858261
H -0.764791 1.941721 -0.527211
H -0.930660 0.477042 -1.541128
H -5.452287 -0.065548 -1.376141
H -6.605014 -1.344264 -0.876589
H -6.615189 0.249634 -0.062056
H -3.534054 -1.856595 -0.972068
H -3.340150 -2.572984 0.654279
H -4.723752 -3.047569 -0.379314
H 3.376776 1.877785 1.156307
H 3.266087 -1.312275 -1.787282
H 5.550187 0.998837 2.030750
H 5.441015 -2.193801 -0.916160
H 6.592035 -1.044204 1.000279


