%chk=000084098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084098

0 1
 S  -0.1771000      -2.125600      0.7122000    
 F   -5.180500       1.616000     -0.5698000    
 F   -5.290100     -0.5497000     -0.6104000    
 F   -4.974800      0.4851000       1.276100    
 O    3.818400       1.489100       1.211000    
 O    1.510000     -0.2650000      -1.825600    
 O    1.020200      -1.637700       1.378700    
 O   -1.116200      -2.971400       1.433100    
 N    2.762900       1.873300       2.029200    
 C    4.196600      0.3032000      -1.018000    
 C    5.615300     -9.3400002E-02 -0.7145000    
 C    4.583800      -1.150000     -0.9821000    
 C    3.327400      0.8666000      0.1090000    
 C    1.987800      0.8441000      0.2038000    
 C    1.069200      0.2563000     -0.7913000    
 C    1.663000       1.466700       1.388700    
 C  -0.3730000      0.2883000     -0.5869000    
 C   -1.039700     -0.7389000      8.1100002E-02
 C   -1.088100       1.381300      -1.076600    
 C   -2.421600     -0.6732000      0.2590000    
 C   -3.136700      0.4197000     -0.2308000    
 C   -2.469900       1.446900     -0.8987000    
 C   0.3270000      -3.023000     -0.7368000    
 C   -4.614000      0.4914000     -4.0399998E-02
 H    4.028100      0.7513000      -1.991900    
 H    5.986000     -1.8000000E-03  0.2991000    
 H    6.362700      8.5000001E-02  -1.478400    
 H    4.635600      -1.679600      -1.925600    
 H    4.256100      -1.757400     -0.1470000    
 H   0.7014000       1.658200       1.841700    
 H  -0.5805000       2.188400      -1.598900    
 H   -2.962300      -1.462300      0.7743000    
 H   -3.009400       2.306300      -1.287200    
 H    1.156800      -2.527500      -1.232400    
 H   0.6573000      -4.012600     -0.4102000    
 H  -0.5285000      -3.132200      -1.406100    


%chk=000084098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084098

0 1
S -0.732014 -2.693415 0.465465
F -5.021819 2.153301 -0.454096
F -5.370618 0.012259 -1.123969
F -5.223267 0.494393 1.082044
O 3.990167 1.548345 1.023171
O 1.466856 -1.029585 -1.379754
O 0.618251 -2.489751 1.365082
O -2.072834 -3.406659 1.077958
N 2.883634 2.118082 1.857596
C 4.361630 -0.022335 -0.812928
C 5.664082 0.675830 -1.301741
C 5.767054 -0.460093 -0.302885
C 3.451425 0.673311 0.091152
C 2.050035 0.647305 0.243562
C 1.104518 -0.164669 -0.515894
C 1.783987 1.546024 1.344386
C -0.380414 0.093376 -0.325732
C -1.311913 -0.933492 -0.055729
C -0.902414 1.393324 -0.550717
C -2.691912 -0.725873 0.014654
C -3.184228 0.578151 -0.235433
C -2.292347 1.634472 -0.516844
C -0.279328 -3.626114 -1.140936
C -4.670580 0.812915 -0.183533
H 3.845527 -0.691231 -1.503361
H 5.841879 1.691165 -0.937978
H 5.942347 0.494414 -2.343117
H 6.112777 -1.439640 -0.642533
H 6.009528 -0.210044 0.733045
H 0.821785 1.776865 1.802618
H -0.216188 2.215303 -0.778805
H -3.348254 -1.559869 0.292950
H -2.679915 2.639688 -0.704632
H 0.503169 -3.025225 -1.623681
H 0.069274 -4.609804 -0.795666
H -1.206681 -3.694823 -1.726317


