%chk=000125330.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125330

0 1
 Cl  -4.207900     -0.6028000      -1.145700    
 N    2.857500      0.6259000     -0.7859000    
 N    2.677200      -1.108600      0.8773000    
 N   0.6061000      -1.558800       1.925700    
 N   -1.243500      -1.111100      -1.312600    
 N    4.726700     -0.6518000     -0.1699000    
 N   -1.207900      -2.265400     -0.8396000    
 N   -1.171600      -3.325300     -0.4177000    
 C   0.7416000      0.1833000      0.2688000    
 C    1.542300      0.8742000     -0.6159000    
 C  -0.6687000      0.4871000      0.4167000    
 C   0.9860000       1.971800      -1.464500    
 C    1.367600     -0.8069000      0.9963000    
 C   -1.632800     -0.1512000     -0.3636000    
 C   -1.053800       1.439400       1.360400    
 C    1.080200       3.332200     -0.7790000    
 C   -2.982100      0.1629000     -0.2000000    
 C    3.352700     -0.3639000     -1.8600000E-02
 C   -2.402800       1.753500       1.523900    
 C   -3.367000       1.115200      0.7438000    
 H    1.563800       2.017700      -2.397200    
 H  -4.3299999E-02   1.776600      -1.781600    
 H  -0.3178000       1.941800       1.984000    
 H   0.4963000       3.376700      0.1426000    
 H   0.7078000       4.114300      -1.448700    
 H    2.118800       3.572900     -0.5262000    
 H   -2.702700       2.493600       2.260000    
 H   -4.414100       1.371300      0.8840000    
 H  -0.1122000      -2.141500       1.508100    
 H   0.2390000      -1.009100       2.697500    
 H    5.275800     -0.1201000     -0.8310000    
 H    5.144300      -1.387000      0.3837000    


%chk=000125330-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125330

0 1
Cl -4.334538 -0.670571 -1.050415
N 2.880064 0.518248 -0.748256
N 2.786886 -0.916744 1.231595
N 0.798512 -1.265270 2.391429
N -1.110502 -1.041394 -1.200988
N 4.782431 -0.581462 0.057376
N -1.744013 -1.762088 -2.027178
N -2.057092 -2.519230 -2.884299
C 0.759241 0.213308 0.423622
C 1.540965 0.775057 -0.620127
C -0.697446 0.483421 0.601196
C 0.970255 1.749738 -1.631875
C 1.451919 -0.650301 1.343502
C -1.670908 -0.169709 -0.232964
C -1.147009 1.361353 1.616785
C 1.234499 3.219793 -1.210127
C -3.049425 0.110361 -0.015662
C 3.437125 -0.318352 0.186300
C -2.521069 1.618005 1.819064
C -3.479137 0.990761 0.993803
H 1.461780 1.557138 -2.601804
H -0.113899 1.587740 -1.759139
H -0.396959 1.853493 2.244545
H 0.725928 3.458615 -0.257975
H 0.863173 3.918636 -1.981387
H 2.317241 3.389852 -1.077356
H -2.848369 2.305510 2.604967
H -4.548557 1.179057 1.125064
H 1.337583 -1.883750 2.993063
H -0.199456 -1.141073 2.536157
H 5.291779 -0.157363 -0.712627
H 5.234501 -1.205877 0.718810


