%chk=000006827.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006827

0 1
 O   -5.690000       2.314000     -0.1852000    
 O    6.096500       1.803900     -0.3838000    
 C   8.5199997E-02 -0.3264000     -1.1700000E-02
 C   -1.250800      -1.163800     -1.4800000E-02
 C    1.359200      -1.244800     -7.5900003E-02
 C   0.1466000      0.7165000       1.134900    
 C   -1.321300      -2.282700      -1.083200    
 C   -2.453500     -0.2214000     -6.1000001E-02
 C    2.643200     -0.4183000     -0.1592000    
 C    1.388000      -2.340800      0.9975000    
 C   0.1391000      0.1058000       2.531300    
 C   -2.520800      -3.207000     -0.8945000    
 C   -3.319000     -0.2032000       1.009000    
 C   -2.626200      0.5741000      -1.171000    
 C    3.080500     -2.4999999E-03  -1.396000    
 C    3.312900     -0.1215000       1.005800    
 C   -4.416500      0.6566000      0.9668000    
 C   -3.723600       1.434100      -1.213300    
 C    4.251700      0.7511000      -1.472000    
 C    4.484100      0.6323000      0.9299000    
 C   -4.618900       1.475400     -0.1443000    
 C    4.953600       1.068800     -0.3091000    
 H   0.1031000      0.2636000     -0.9399000    
 H   -1.299300      -1.693800      0.9438000    
 H    1.318300      -1.787300      -1.030400    
 H    1.013700       1.376200       1.026900    
 H  -0.7122000       1.393100       1.054600    
 H   -1.356400      -1.849400      -2.089700    
 H  -0.4369000      -2.922700      -1.054800    
 H   0.5104000      -2.990600      0.9596000    
 H    2.253400      -2.993700      0.8238000    
 H    1.481700      -1.992100       2.023200    
 H  -0.2203000      0.8649000       3.237300    
 H  -0.5247000     -0.7524000       2.641500    
 H    1.134100     -0.1555000       2.886400    
 H   -3.466500      -2.673900      -1.029700    
 H   -2.515600      -3.659400      0.1022000    
 H   -2.489400      -4.015700      -1.632000    
 H   -3.172600     -0.8361000       1.878600    
 H   -1.942800      0.5489000      -2.013600    
 H    2.538600     -0.2424000      -2.305500    
 H    3.000700     -0.4592000       1.983600    
 H   -5.106700      0.6791000       1.805900    
 H   -3.876800       2.068200      -2.082300    
 H    4.606300       1.085600      -2.443200    
 H    5.029900      0.8721000       1.838500    
 H   -6.201600       2.212000      0.6358000    
 H    6.272300       2.019200      -1.315900    


%chk=000006827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006827

0 1
O -5.804342 2.303521 -0.249445
O 6.196753 1.879775 -0.477166
C 0.130311 -0.419195 0.045809
C -1.220579 -1.224864 0.062114
C 1.408187 -1.351368 -0.003586
C 0.169090 0.704075 1.129125
C -1.304739 -2.277456 -1.087381
C -2.430534 -0.285091 0.007061
C 2.689460 -0.514982 -0.114924
C 1.482718 -2.432738 1.103116
C 0.000148 0.298310 2.612512
C -2.598364 -3.120257 -1.062850
C -3.399237 -0.275347 1.039127
C -2.636805 0.588262 -1.096245
C 3.072064 0.006693 -1.377477
C 3.518143 -0.208731 0.997014
C -4.531199 0.570004 0.988197
C -3.756297 1.439228 -1.167466
C 4.225735 0.805053 -1.534515
C 4.675826 0.584395 0.862885
C -4.706560 1.430382 -0.120093
C 5.028876 1.095200 -0.405754
H 0.153346 0.126587 -0.925292
H -1.279649 -1.782931 1.019135
H 1.329286 -1.902768 -0.963562
H 1.120672 1.257377 1.017463
H -0.634309 1.423922 0.880723
H -1.220703 -1.755648 -2.063153
H -0.439300 -2.963474 -1.025049
H 0.597004 -3.092243 1.073930
H 2.376485 -3.066116 0.954656
H 1.537543 -2.009202 2.119146
H -0.092525 1.204657 3.239531
H -0.909868 -0.306858 2.775196
H 0.862314 -0.275274 2.994357
H -3.494526 -2.490055 -1.199256
H -2.705582 -3.651711 -0.097623
H -2.588576 -3.879866 -1.866154
H -3.273673 -0.943963 1.899669
H -1.910528 0.605880 -1.917949
H 2.461107 -0.222510 -2.259994
H 3.263943 -0.597209 1.989056
H -5.266822 0.555429 1.803474
H -3.912315 2.111220 -2.016867
H 4.499527 1.190080 -2.525965
H 5.312344 0.815228 1.722413
H -6.407575 2.225164 0.530684
H 6.354425 2.188315 -1.403724


