%chk=000020248.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020248

0 1
 Cl   3.832800      -4.508000     -5.4099999E-02
 F    6.649900      0.3388000     -0.6162000    
 O   -3.980800       2.949600     -0.4470000    
 O   -2.432700       4.462800      0.2041000    
 O   -3.061300      0.4803000       1.907600    
 N    4.154900     -0.4982000      0.3038000    
 N   -2.373900      0.8938000     -0.2685000    
 C  -0.5845000       2.410200     -0.9932000    
 C   -1.731500       2.157400     -6.0000001E-03
 C   0.6684000       1.640900     -0.6501000    
 C    2.983900      0.2201000     -1.6300000E-02
 C    4.363400      -1.833100     -0.2209000    
 C    5.158200      8.3700001E-02   1.172900    
 C   0.8663000      0.3620000      -1.170600    
 C    1.628300       2.209200      0.1874000    
 C    2.024100     -0.3484000     -0.8537000    
 C    2.786000       1.498900      0.5044000    
 C   -2.730400       3.303700     -6.5200001E-02
 C    3.592200      -2.864000      0.5883000    
 C    6.042900       1.029600      0.3863000    
 C   -2.993900      0.1509000      0.7262000    
 C   -3.586700      -1.142500      0.2985000    
 C   -4.665900      -1.680800      0.9996000    
 C   -3.064700      -1.818300     -0.8045000    
 C   -5.222700      -2.895100      0.5980000    
 C   -3.621700      -3.032500      -1.206100    
 C   -4.700700      -3.570800     -0.5048000    
 H  -0.3287000       3.478000      -1.019700    
 H  -0.8946000       2.170000      -2.019500    
 H   -1.359900       2.138900       1.026700    
 H    5.432200      -2.082400     -0.1661000    
 H    4.136700      -1.893200      -1.292300    
 H    4.726300      0.5638000       2.057700    
 H    5.794400     -0.7159000       1.574200    
 H   0.1268000     -9.0400003E-02  -1.825900    
 H    1.483100       3.203800      0.6009000    
 H    2.118100      -1.335000      -1.293400    
 H    3.490400       1.996100       1.161700    
 H   -2.456600      0.6098000      -1.239300    
 H    2.515300      -2.677800      0.5962000    
 H    3.930500      -2.869000       1.629800    
 H    6.827800       1.443400       1.026100    
 H    5.498200       1.859100     -7.0500001E-02
 H   -5.089300      -1.166800       1.858500    
 H   -2.207700      -1.447900      -1.359200    
 H   -4.588100       3.719500     -0.4738000    
 H   -6.063300      -3.314000       1.143400    
 H   -3.211400      -3.562500      -2.060700    
 H   -5.133300      -4.516800     -0.8167000    


%chk=000020248-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020248

0 1
Cl 5.071297 -3.646230 -2.498670
F 6.437120 0.173596 1.401115
O -3.968787 2.815772 -1.860740
O -2.927599 4.723374 -1.034521
O -2.084709 1.070541 1.871634
N 3.820514 -0.745667 0.197063
N -2.454402 1.149840 -0.425358
C -0.648815 2.614137 -1.440055
C -1.939724 2.511187 -0.553260
C 0.488571 1.711140 -0.987503
C 2.729301 0.062167 -0.192575
C 4.652175 -1.442173 -0.799686
C 4.232203 -0.838872 1.603627
C 1.224297 0.955093 -1.932240
C 0.892496 1.619031 0.367560
C 2.316144 0.148314 -1.557431
C 1.983760 0.822756 0.761064
C -2.972298 3.480013 -1.125490
C 4.026546 -2.801689 -1.163524
C 5.134535 0.311806 2.067648
C -2.490607 0.504995 0.805039
C -3.052603 -0.891992 0.808213
C -3.533402 -1.400823 2.041695
C -3.095741 -1.715613 -0.347445
C -4.073922 -2.700981 2.115105
C -3.632156 -3.019753 -0.271714
C -4.128931 -3.513012 0.957111
H -0.339183 3.678242 -1.423004
H -0.914430 2.376751 -2.488640
H -1.703358 2.850400 0.471506
H 5.662524 -1.592885 -0.385624
H 4.776039 -0.825662 -1.707657
H 3.346826 -0.892465 2.266007
H 4.787166 -1.783632 1.748530
H 0.940493 0.993616 -2.991869
H 0.340840 2.158278 1.146003
H 2.837493 -0.414787 -2.337033
H 2.239146 0.797734 1.824156
H -2.937666 0.746703 -1.228785
H 3.018559 -2.700992 -1.590932
H 4.014468 -3.496742 -0.310589
H 5.327806 0.261449 3.155572
H 4.736036 1.300177 1.782526
H -3.466959 -0.758414 2.925777
H -2.676635 -1.367217 -1.299083
H -4.598524 3.484122 -2.244197
H -4.450062 -3.082886 3.070471
H -3.653077 -3.653175 -1.165301
H -4.545963 -4.524674 1.013502


