%chk=000046755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046755

1 1
 Cl  -6.813200      0.8782000      0.4351000    
 O  -0.3374000     -0.3764000      0.6852000    
 O  -0.6307000     -0.7688000      -1.593300    
 N    4.194100       1.097500     -0.2038000    
 C    3.194900     -1.5100000E-02  0.1228000    
 C    4.877400      0.7700000      -1.528500    
 C    5.215600       1.187400      0.9264000    
 C    3.517100       2.459500     -0.3417000    
 C    1.895100      0.3457000      0.2474000    
 C    3.694300      -1.267100      0.2579000    
 C   0.9843000     -0.6683000      0.5438000    
 C    2.783300      -2.281200      0.5546000    
 C    1.428300      -1.981600      0.6976000    
 C   -1.075200     -0.4588000     -0.4982000    
 C   -2.504300     -0.1276000     -0.2651000    
 C   -3.465100     -0.7242000      -1.055300    
 C   -2.826000      0.7681000      0.7340000    
 C   -4.806900     -0.4109000     -0.8371000    
 C   -4.167700       1.081600      0.9519000    
 C   -5.158100      0.4921000      0.1663000    
 H    4.108500      0.6357000      -2.296100    
 H    5.527800       1.610400      -1.791700    
 H    5.487600     -0.1310000      -1.421900    
 H    5.812000      0.2718000      0.9644000    
 H    5.877100       2.035000      0.7196000    
 H    4.682500       1.348300       1.869000    
 H    3.056600       2.740500      0.6112000    
 H    4.294600       3.195400     -0.5769000    
 H    2.805600       2.434600      -1.173700    
 H    1.490000       1.342600      0.1423000    
 H    4.740900      -1.525000      0.1528000    
 H    3.128700      -3.304000      0.6747000    
 H   0.7242000      -2.776100      0.9296000    
 H   -3.204200      -1.430800      -1.837500    
 H   -2.072300       1.250200       1.349300    
 H   -5.568200     -0.8786000      -1.456400    
 H   -4.426600       1.789100       1.735600    


%chk=000046755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046755

1 1
Cl -7.163402 -0.151723 0.178315
O -0.409044 -0.543657 0.545104
O -0.535756 1.335799 -0.879081
N 4.298206 0.918880 -0.538880
C 3.281747 0.002544 0.154201
C 5.191892 0.083153 -1.467360
C 5.161610 1.618113 0.521969
C 3.635826 2.005760 -1.388503
C 1.905755 0.228780 -0.029944
C 3.772201 -1.044373 0.963500
C 0.992122 -0.636975 0.627792
C 2.839343 -1.890278 1.604957
C 1.455034 -1.694734 1.443201
C -1.121284 0.449856 -0.213916
C -2.577612 0.263413 -0.086395
C -3.419621 1.177460 -0.780816
C -3.155468 -0.778292 0.691189
C -4.817798 1.056384 -0.703034
C -4.554149 -0.906375 0.773587
C -5.367596 0.012836 0.074754
H 4.554366 -0.404060 -2.219541
H 5.919885 0.751254 -1.953155
H 5.718608 -0.680927 -0.880292
H 5.697923 0.864589 1.114192
H 5.881369 2.278557 0.013732
H 4.500850 2.201498 1.179771
H 3.012410 2.647449 -0.749855
H 4.434370 2.606444 -1.849609
H 3.023892 1.539631 -2.173702
H 1.497909 1.028424 -0.645523
H 4.841293 -1.225009 1.111852
H 3.200883 -2.707589 2.235297
H 0.727316 -2.344609 1.936111
H -2.965550 1.975552 -1.376319
H -2.511765 -1.480633 1.225618
H -5.471718 1.754093 -1.232804
H -5.009446 -1.703036 1.367889


