%chk=000072455.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072455

0 1
 Cl   3.103100      -2.530900     -0.2303000    
 F    1.317800       2.218500     -0.7488000    
 O   -4.558500       1.588100      0.5352000    
 N  -6.0600001E-02 -0.8690000     -0.7929000    
 N   -1.540400      -2.182700      0.2526000    
 N   -1.265600       1.237800     -0.8512000    
 N   -3.392300      0.9276000      0.1983000    
 N   -4.154600      -1.187100       1.147400    
 C    1.160200     -0.4790000      -1.456300    
 C   -1.142500     -8.0700003E-02 -0.5293000    
 C   -2.039700     -0.9191000      0.1161000    
 C    2.182900      2.3600001E-02 -0.4733000    
 C  -0.3475000      -2.120000     -0.3048000    
 C   -3.323300     -0.4085000      0.5494000    
 C    3.093400     -0.8411000      0.1222000    
 C    2.193800       1.381300     -0.1753000    
 C   -2.429300       1.681900     -0.4525000    
 C    4.028300     -0.3413000       1.028700    
 C    3.128700       1.881100      0.7314000    
 C    4.045900       1.019800       1.333400    
 H    1.519400      -1.325900      -2.050700    
 H   0.9142000      0.2961000      -2.193000    
 H   0.3282000      -2.956800     -0.4005000    
 H   -2.719400       2.731700     -0.6219000    
 H    4.749900     -0.9992000       1.506500    
 H    3.142300       2.940800      0.9682000    
 H    4.773800       1.409000       2.039200    
 H   -5.001300     -0.6554000       1.377500    
 H   -4.355300       1.913700       1.429000    


%chk=000072455-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072455

0 1
Cl 3.405256 -2.419014 -1.157203
F 1.337968 2.176766 0.203847
O -5.112320 1.368775 -0.052929
N -0.073885 -0.663124 -0.476878
N -1.401370 -1.856088 0.957924
N -1.661734 1.078986 -1.219121
N -3.760955 0.856867 -0.100363
N -4.407825 -1.031080 1.357324
C 1.090978 -0.228422 -1.277386
C -1.317611 -0.030213 -0.461961
C -2.123706 -0.778999 0.428829
C 2.312841 0.062534 -0.421686
C -0.179220 -1.754507 0.396017
C -3.518655 -0.400951 0.643889
C 3.417811 -0.812261 -0.284647
C 2.410146 1.272023 0.307276
C -2.907541 1.481144 -1.005222
C 4.541762 -0.512957 0.510551
C 3.499541 1.623459 1.117226
C 4.575048 0.712694 1.212517
H 1.331727 -1.008561 -2.018465
H 0.767065 0.681353 -1.811547
H 0.651417 -2.430640 0.584225
H -3.324379 2.339557 -1.537588
H 5.369212 -1.223362 0.581074
H 3.498491 2.577775 1.650176
H 5.441218 0.955235 1.835533
H -5.354407 -0.605285 1.314071
H -5.155273 1.922596 0.778820


