%chk=000019441.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019441

0 1
 Cl   6.244900      0.9526000     -0.8534000    
 N   6.5099999E-02 -0.4042000      0.1948000    
 N   0.7262000      0.1353000       1.094700    
 N   -2.038000      -1.777200      -2.612800    
 N  -0.3052000      -4.008700      0.7164000    
 C   -1.336000     -0.6320000      0.6398000    
 C   -2.250100      0.5175000      0.3800000    
 C   -1.826700      -1.973300      9.8000001E-03
 C   -2.070700       1.308500     -0.7549000    
 C   -3.284800      0.8014000       1.271500    
 C   -2.925600       2.383400     -0.9982000    
 C   -4.139700       1.876300       1.028100    
 C   -3.960200       2.667300     -0.1068000    
 C    2.038600      0.3298000      0.6325000    
 C   -1.943200      -1.864700      -1.459400    
 C  -0.9730000      -3.112500      0.4038000    
 C    2.373300       1.513000     -1.8700000E-02
 C    2.994300     -0.6627000      0.8283000    
 C    3.675900       1.705700     -0.4787000    
 C    4.297000     -0.4700000      0.3684000    
 C    4.637900      0.7144000     -0.2851000    
 H   -1.312400     -0.7972000       1.729900    
 H   -2.835300      -2.173800      0.3981000    
 H   -1.273200       1.110100      -1.465600    
 H   -3.438300      0.1921000       2.158200    
 H   -2.786000       2.999400      -1.881700    
 H   -4.945700       2.097100       1.721700    
 H   -4.626000       3.504100     -0.2963000    
 H    1.630000       2.290600     -0.1735000    
 H    2.737200      -1.588100       1.336700    
 H    3.927100       2.633500     -0.9863000    
 H    5.036100      -1.251300      0.5261000    


%chk=000019441-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019441

0 1
Cl 6.527218 1.079768 -0.915556
N -0.014030 -0.241008 0.234603
N 0.878976 0.207030 1.061959
N -1.858743 -2.665376 -1.858346
N -0.288682 -3.521725 2.183568
C -1.349483 -0.386948 0.890853
C -2.359884 0.580368 0.280386
C -1.802937 -1.894505 0.699689
C -2.391109 0.838175 -1.114349
C -3.292146 1.227418 1.129692
C -3.353866 1.723066 -1.647350
C -4.257030 2.108445 0.592907
C -4.290698 2.356827 -0.798734
C 2.193243 0.383912 0.504941
C -1.816887 -2.316757 -0.719950
C -0.960656 -2.808259 1.505797
C 3.161202 0.889175 1.409110
C 2.553235 0.086804 -0.839678
C 4.487914 1.106048 0.984610
C 3.874079 0.298947 -1.270880
C 4.821432 0.807126 -0.351740
H -1.266919 -0.212637 1.982860
H -2.843352 -1.962004 1.077950
H -1.661885 0.356595 -1.772592
H -3.258915 1.049402 2.211877
H -3.372349 1.917850 -2.725102
H -4.973646 2.603254 1.257443
H -5.036352 3.042073 -1.216616
H 2.855214 1.103821 2.437672
H 1.794838 -0.310109 -1.521270
H 5.243238 1.494787 1.672650
H 4.172480 0.074837 -2.299003


