%chk=000047445.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047445

0 1
 Cl  -5.218300      -1.792500      -1.824600    
 F    5.755000     -0.1888000      -1.663500    
 F    7.538200     -0.6189000     -0.4758000    
 F    6.831300       1.443000     -0.6324000    
 O    5.643900     -6.0199998E-02  0.6173000    
 O   -3.400000      -1.922900      0.7328000    
 O  -0.6274000      -1.723500      0.8141000    
 N   0.1345000      0.4088000      0.1892000    
 N   -2.121000     -4.6200000E-02  0.2170000    
 C    1.539600      0.2889000      0.2978000    
 C    2.338300       1.380100     -2.6000000E-03
 C    2.088200     -0.9171000      0.7025000    
 C   -4.555400      1.7000001E-02  0.1065000    
 C    4.291900      5.4499999E-02  0.5109000    
 C    3.724100       1.262100      0.1047000    
 C    3.473900      -1.035100      0.8100000    
 C   -3.336000     -0.7378000      0.3687000    
 C  -0.8319000     -0.5697000      0.4459000    
 C   -5.473100     -0.3784000     -0.8666000    
 C   -4.791700       1.165200      0.8624000    
 C   -6.627200      0.3744000      -1.083700    
 C   -5.945700       1.918100      0.6452000    
 C   -6.863400       1.522700     -0.3278000    
 C    6.432200      0.1562000     -0.5479000    
 H    1.906200       2.325700     -0.3183000    
 H    1.524500      -1.803800      0.9512000    
 H  -0.2051000       1.318900     -0.1117000    
 H    4.349100       2.120800     -0.1243000    
 H    3.912000      -1.977800       1.126900    
 H   -4.090900       1.485700       1.629400    
 H   -2.169600      0.9226000     -8.7399997E-02
 H   -7.352500      8.0100000E-02  -1.838100    
 H   -6.130500       2.811300       1.234700    
 H   -7.762100       2.108800     -0.4966000    


%chk=000047445-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047445

0 1
Cl -5.524106 -1.300084 -2.287462
F 6.718589 0.406933 -1.420971
F 7.914142 0.170448 0.497840
F 6.486326 1.923412 0.251368
O 5.723625 -0.264555 0.590236
O -3.431385 -2.056375 0.032816
O -0.733075 -1.532836 1.231103
N 0.124095 0.097743 -0.244477
N -2.187227 -0.057902 0.073232
C 1.526133 -0.017145 -0.025214
C 2.377442 0.831084 -0.780679
C 2.093935 -0.930984 0.903754
C -4.620862 0.078618 -0.000568
C 4.311056 -0.114572 0.317141
C 3.776387 0.789579 -0.621271
C 3.490771 -0.969730 1.072819
C -3.393207 -0.805698 0.032134
C -0.898511 -0.594426 0.417589
C -5.669129 -0.090425 -0.937756
C -4.779129 1.073615 1.002905
C -6.837932 0.694369 -0.888258
C -5.947748 1.860761 1.072800
C -6.978310 1.669781 0.124521
C 6.666364 0.532263 -0.001313
H 1.950013 1.536912 -1.503397
H 1.445278 -1.599874 1.470853
H -0.155002 0.708302 -1.015952
H 4.409883 1.450249 -1.217199
H 3.948281 -1.663389 1.783593
H -3.991134 1.195620 1.755046
H -2.262675 0.944933 -0.118858
H -7.624185 0.543892 -1.633525
H -6.056722 2.608492 1.864691
H -7.890881 2.273188 0.168361


