%chk=000019171.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019171

0 1
 Cl  -2.730200       4.188500       1.478000    
 N    3.836900       1.901300     -0.5239000    
 C   2.2299999E-02 -7.9899997E-02  0.4955000    
 C    1.226700      0.4592000     -0.2920000    
 C   -1.259000      0.6714000      0.1463000    
 C  -2.4300000E-02  -1.598500      0.5015000    
 C   -2.231800      0.2860000     -0.7973000    
 C  -0.4199000      -2.357500     -0.6112000    
 C   -2.240900     -0.9837000      -1.619200    
 C  -0.9203000      -1.698600      -1.864400    
 C    2.536800     -5.2999998E-03  0.3345000    
 C    3.750200      0.4687000     -0.4586000    
 C   -1.446300       1.898600      0.8320000    
 C   0.4015000      -2.278300       1.660600    
 C   -3.362500       1.117900     -0.9842000    
 C  -0.3847000      -3.762200     -0.5444000    
 C   -2.560500       2.708300      0.6198000    
 C   0.4296000      -3.671600       1.716700    
 C   -3.525400       2.314000     -0.2898000    
 C   3.7500001E-02  -4.414700      0.6116000    
 C    3.811200       2.502500      0.8191000    
 C    5.053000       2.333800      -1.230800    
 H   0.2062000      0.1928000       1.546900    
 H    1.198300      0.1603000      -1.343100    
 H    1.192200       1.555600     -0.2962000    
 H   -2.956200      -1.676500      -1.155100    
 H   -2.643400     -0.7355000      -2.611300    
 H   -1.087800      -2.464700      -2.633200    
 H  -0.1707000      -1.029500      -2.292200    
 H    2.597300      0.2768000       1.391400    
 H    2.583700      -1.100700      0.3222000    
 H    3.689500      5.2400000E-02  -1.472500    
 H    4.650200      3.8100000E-02  1.1000000E-03
 H  -0.6937000       2.225700       1.549900    
 H   0.7255000      -1.721400       2.537500    
 H   -4.137800      0.8267000      -1.691600    
 H  -0.6955000      -4.360800      -1.397500    
 H   0.7618000      -4.172600       2.621000    
 H   -4.407300       2.921400     -0.4733000    
 H   5.7599999E-02  -5.499800      0.6481000    
 H    2.828800       2.414900       1.292800    
 H    3.998600       3.581400      0.7546000    
 H    4.571100       2.070400       1.480400    
 H    5.068500       3.424100      -1.337900    
 H    5.072900       1.918300      -2.244400    
 H    5.965000       2.021200     -0.7097000    


%chk=000019171-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019171

0 1
Cl -2.670965 4.321959 1.433447
N 3.844737 1.988320 -0.360102
C -0.009283 -0.133376 0.545168
C 1.238933 0.395791 -0.249849
C -1.273251 0.649293 0.135998
C -0.086294 -1.662181 0.555721
C -2.236281 0.283821 -0.853978
C -0.427743 -2.430754 -0.595193
C -2.259291 -1.021497 -1.652400
C -0.916031 -1.759868 -1.867742
C 2.584556 -0.108805 0.311401
C 3.797899 0.506303 -0.420328
C -1.436839 1.892289 0.813328
C 0.271112 -2.344292 1.746311
C -3.310701 1.179644 -1.117096
C -0.385891 -3.845196 -0.520815
C -2.511765 2.742826 0.524143
C 0.305834 -3.754823 1.814628
C -3.472386 2.406549 -0.445610
C -0.018970 -4.513240 0.668899
C 4.108139 2.507404 0.996618
C 4.782655 2.553925 -1.350671
H 0.184527 0.160667 1.597242
H 1.162050 0.118234 -1.318269
H 1.236242 1.501306 -0.221105
H -2.959393 -1.726759 -1.158305
H -2.698586 -0.799064 -2.644318
H -1.066623 -2.531337 -2.645892
H -0.171579 -1.047740 -2.269293
H 2.641276 0.109433 1.397652
H 2.651775 -1.209921 0.217523
H 3.745546 0.222625 -1.490241
H 4.739479 0.051710 -0.011284
H -0.708386 2.186684 1.576619
H 0.527724 -1.756918 2.636916
H -4.049571 0.901204 -1.878848
H -0.651631 -4.429689 -1.410663
H 0.583536 -4.252967 2.750178
H -4.309492 3.073312 -0.669770
H 0.006766 -5.608207 0.701520
H 3.324530 2.172419 1.697673
H 4.091353 3.611759 0.978183
H 5.099466 2.181541 1.406248
H 4.726997 3.657308 -1.328086
H 4.500793 2.218424 -2.364744
H 5.849723 2.260383 -1.173113


