%chk=000031966.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031966

0 1
 Cl   4.783900       1.422200     -0.2202000    
 N    1.203800     -0.3803000      0.1774000    
 C   0.3984000      0.5104000     -0.6572000    
 C    2.625300     -0.2178000     -0.1256000    
 C   0.7955000      -1.771000     -1.7200001E-02
 C   -1.067900      0.4129000     -0.3290000    
 C    3.059000       1.210700      0.1644000    
 C    1.622600      -2.711600      0.8429000    
 C   -1.857800     -0.5114000     -0.9984000    
 C   -1.608700       1.248200      0.6385000    
 C   -3.216200     -0.6020000     -0.6943000    
 C   -2.967100       1.157400      0.9425000    
 C   -3.770700      0.2323000      0.2761000    
 H   0.5514000      0.3076000      -1.726700    
 H   0.6528000       1.564600     -0.5154000    
 H    2.840400     -0.4804000      -1.170000    
 H    3.245400     -0.8582000      0.5100000    
 H  -0.2316000      -1.927800      0.3236000    
 H   0.8621000      -2.081800      -1.067300    
 H    2.562600       1.959400     -0.4528000    
 H    2.917600       1.470400       1.218400    
 H    2.626500      -2.875800      0.4391000    
 H    1.704400      -2.356000       1.875800    
 H    1.140300      -3.695400      0.8765000    
 H   -1.444500      -1.157500      -1.767700    
 H  -0.9923000       1.970400       1.166300    
 H   -3.842700      -1.319900      -1.215600    
 H   -3.399000       1.806500       1.698600    
 H   -4.828400      0.1622000      0.5124000    


%chk=000031966-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031966

0 1
Cl 4.727404 1.807381 -0.049817
N 1.264453 -0.475589 -0.192085
C 0.287350 0.076627 -1.159739
C 2.661038 -0.069390 -0.468498
C 1.070350 -1.918571 0.104804
C -1.137035 0.158164 -0.613260
C 2.973960 1.190383 0.350061
C 1.649957 -2.332720 1.469910
C -2.244446 -0.066419 -1.467798
C -1.376245 0.506509 0.740045
C -3.567251 0.064549 -0.985334
C -2.696032 0.634532 1.225987
C -3.797380 0.416771 0.364324
H 0.279034 -0.501615 -2.117725
H 0.625784 1.099109 -1.422125
H 2.842218 0.128227 -1.547883
H 3.355588 -0.874135 -0.171465
H -0.018766 -2.105498 0.110993
H 1.504070 -2.559759 -0.702296
H 2.306103 2.029750 0.104628
H 2.963258 0.989448 1.430548
H 2.740680 -2.161536 1.528552
H 1.168638 -1.756247 2.279260
H 1.472471 -3.408947 1.650810
H -2.072066 -0.347308 -2.514851
H -0.514738 0.658788 1.399925
H -4.414042 -0.113343 -1.658031
H -2.867687 0.903657 2.274689
H -4.821566 0.515480 0.741473


