%chk=000037596.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037596

0 1
 Cl  0.7285000      -4.406200      0.8946000    
 O  -0.7575000       2.870900      0.6722000    
 N  -0.3215000      0.6033000      0.2496000    
 N    2.472800      0.9822000     -0.8903000    
 N    2.831800       3.285200     -0.6597000    
 C   0.6531000     -0.4533000      9.0000004E-02
 C    1.961600     -0.2367000     -0.4037000    
 C   1.5500000E-02   1.909900      0.6425000    
 C    1.460800       2.130200       1.015400    
 C   -1.702300      0.2753000     -1.8400000E-02
 C    2.302900       2.092100     -0.2352000    
 C   0.3069000      -1.763400      0.4991000    
 C    2.843400      -1.331000     -0.5080000    
 C   -2.007700     -0.7064000     -0.9544000    
 C   -2.713100      0.9439000      0.6629000    
 C    1.201800      -2.828600      0.3962000    
 C    2.471700      -2.613100     -0.1128000    
 C   -3.341300      -1.023700      -1.212400    
 C   -4.046600      0.6266000      0.4051000    
 C   -4.360700     -0.3572000     -0.5326000    
 H    1.797300       1.383300       1.741600    
 H    1.552700       3.106100       1.505400    
 H  -0.6614000      -1.960600      0.9575000    
 H    3.844900      -1.180800     -0.9083000    
 H   -1.252900      -1.210100      -1.551200    
 H   -2.523700       1.665300       1.450400    
 H    3.184700      -3.427500     -0.2078000    
 H   -3.586800      -1.780700      -1.951600    
 H   -4.840700       1.134100      0.9452000    
 H   -5.399000     -0.6047000     -0.7330000    
 H    3.393500       3.334500      -1.502900    
 H    2.679800       4.152500     -0.1562000    


%chk=000037596-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037596

0 1
Cl 0.633174 -4.433487 1.264940
O -0.794057 2.878086 0.833493
N -0.268858 0.632434 0.345455
N 2.496693 0.914709 -0.903085
N 2.659650 3.244498 -0.911265
C 0.702342 -0.438126 0.262123
C 1.995153 -0.278927 -0.354016
C 0.052245 1.945028 0.755876
C 1.541816 2.178279 1.027616
C -1.650616 0.314061 0.008378
C 2.264239 2.069918 -0.310455
C 0.305389 -1.713886 0.750126
C 2.818664 -1.437784 -0.482115
C -1.921951 -0.358217 -1.207676
C -2.707808 0.665452 0.879701
C 1.163986 -2.810415 0.618827
C 2.426793 -2.697467 -0.003335
C -3.251991 -0.686297 -1.545708
C -4.036727 0.340863 0.529311
C -4.314581 -0.337986 -0.679263
H 1.941248 1.408612 1.713095
H 1.648489 3.170806 1.490097
H -0.674992 -1.829689 1.219863
H 3.783159 -1.306732 -0.981312
H -1.096850 -0.618825 -1.878470
H -2.495218 1.198819 1.809418
H 3.077354 -3.569482 -0.111353
H -3.457296 -1.207647 -2.486912
H -4.854212 0.617114 1.204017
H -5.346817 -0.590909 -0.944655
H 3.076347 3.201748 -1.840076
H 2.473734 4.146850 -0.483438


