%chk=000052675.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052675

0 1
 Cl   1.542200       4.244800       2.129100    
 N   0.7060000     -0.9675000     -0.7117000    
 N    3.829400      -1.733000      9.3400002E-02
 C    2.689300      -1.663700     -0.7847000    
 C    2.019800     -0.2822000     -0.7803000    
 C    1.392900      -2.138000     -0.1128000    
 C  -0.1720000     -0.3178000      0.2699000    
 C  -0.1572000       1.194500      0.1281000    
 C   -1.532900      -1.000900      0.3635000    
 C  -0.7954000       1.864600     -0.9287000    
 C   -2.695300     -0.6539000     -0.3546000    
 C   -1.609100       1.113100      -1.943900    
 C   -2.854400      0.5059000      -1.313400    
 C    4.847500     -0.7595000     -0.3027000    
 C    4.391300      -3.084200      9.7700000E-02
 C   0.5684000       1.955600       1.066200    
 C   -1.594400      -2.119700       1.232400    
 C  -0.7017000       3.264400      -1.023700    
 C   -3.873400      -1.410000     -0.1426000    
 C   0.6528000       3.344000      0.9631000    
 C   -2.762900      -2.857200       1.413600    
 C   1.7899999E-02   3.999000     -8.3899997E-02
 C   -3.908800      -2.498200      0.7260000    
 H    2.838700      -2.062800      -1.798000    
 H    2.176200      0.3077000      -1.689500    
 H    2.303200      0.3256000      8.5600004E-02
 H    1.022600      -3.105700     -0.4678000    
 H    1.447400      -2.175600      0.9833000    
 H   0.2586000     -0.4658000       1.273200    
 H   -1.921400       1.795600      -2.744800    
 H  -0.9944000      0.3482000      -2.431800    
 H   -3.421700       1.290600     -0.7942000    
 H   -3.483100      0.1625000      -2.146800    
 H    4.502500      0.2727000     -0.1883000    
 H    5.169500     -0.9017000      -1.341200    
 H    5.730800     -0.8495000      0.3404000    
 H    5.225700      -3.151500      0.8049000    
 H    4.752600      -3.385500     -0.8925000    
 H    3.644300      -3.815500      0.4260000    
 H    1.074700       1.457300       1.891600    
 H  -0.7193000      -2.424200       1.802800    
 H   -1.198000       3.794300      -1.833400    
 H   -4.789100      -1.144400     -0.6691000    
 H   -2.773900      -3.703200       2.093900    
 H   7.1099997E-02   5.080100     -0.1820000    
 H   -4.828500      -3.058600      0.8617000    


%chk=000052675-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052675

0 1
Cl 0.509377 4.848792 2.502083
N 0.839230 -0.588908 -0.535415
N 3.891016 -2.044374 -0.119565
C 2.735295 -1.536370 -0.872793
C 2.266062 -0.084659 -0.530682
C 1.326826 -2.013701 -0.387782
C -0.084842 -0.049564 0.506528
C -0.276335 1.455414 0.303843
C -1.387160 -0.866542 0.547539
C -0.827645 1.976341 -0.902404
C -2.460944 -0.755068 -0.388052
C -1.308939 1.030192 -1.985540
C -2.566073 0.236750 -1.554111
C 5.128691 -1.302731 -0.441212
C 4.056956 -3.504191 -0.282780
C 0.128369 2.338126 1.332057
C -1.496468 -1.811323 1.604809
C -0.949156 3.378814 -1.046161
C -3.587481 -1.607761 -0.219079
C -0.017103 3.726644 1.156729
C -2.620834 -2.646236 1.757777
C -0.547906 4.271571 -0.024506
C -3.680215 -2.543821 0.829033
H 2.851385 -1.673809 -1.976445
H 2.467176 0.724582 -1.251822
H 2.620509 0.207514 0.483353
H 0.773481 -2.750457 -0.992290
H 1.383201 -2.350562 0.671080
H 0.393304 -0.178461 1.511487
H -1.560588 1.604411 -2.897007
H -0.501748 0.315783 -2.228628
H -3.366365 0.963816 -1.301099
H -2.935038 -0.323915 -2.436073
H 4.982895 -0.226870 -0.239995
H 5.447406 -1.415182 -1.508962
H 5.952208 -1.662046 0.201436
H 4.885178 -3.855690 0.358151
H 4.280419 -3.809600 -1.336915
H 3.135277 -4.023119 0.034491
H 0.552027 1.943588 2.261333
H -0.675253 -1.883009 2.328664
H -1.368512 3.786964 -1.973417
H -4.414992 -1.523219 -0.935637
H -2.670207 -3.360754 2.586564
H -0.646983 5.354025 -0.147011
H -4.567003 -3.180683 0.922424


