%chk=000022799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022799

2 1
 Cl   2.154000     -0.9223000       2.954900    
 Cl   1.907800       1.207200      -2.950200    
 Cl   4.247100      -1.997000      0.8149000    
 Cl   4.122200     -0.9307000      -2.147900    
 N  -0.7894000       1.981800      0.7832000    
 N   -3.116500     -0.9087000     -8.5600004E-02
 C   -2.103100       1.239200      0.5707000    
 C   0.1213000       1.190200       1.769800    
 C   2.4200000E-02   2.024400     -0.5455000    
 C   -1.841500     -0.1655000      6.3400000E-02
 C    1.174800      0.5512000      0.9281000    
 C    1.119800       1.024100     -0.3845000    
 C   -1.075200       3.378700       1.298500    
 C   -4.048500     -0.1998000      -1.078300    
 C   -2.862000      -2.331300     -0.6035000    
 C   -3.846700      -1.015400       1.260600    
 C    2.131000     -0.3721000       1.315700    
 C    2.019700      0.5851000      -1.340600    
 C   -3.353000     -8.0700003E-02  -2.416700    
 C   -2.010000      -3.081000      0.3973000    
 C    3.039600     -0.8263000      0.3575000    
 C    2.984300     -0.3510000     -0.9620000    
 H   -2.668300       1.850800     -0.1380000    
 H   -2.613500       1.256400       1.538600    
 H  -0.4919000      0.4993000       2.354800    
 H   0.5847000       1.922100       2.441000    
 H   0.4516000       3.029500     -0.6346000    
 H  -0.6492000       1.834900      -1.385100    
 H   -1.255600     -0.7113000      0.8022000    
 H   -1.293800     -0.2227000     -0.8789000    
 H  -0.1238000       3.898700       1.444900    
 H   -1.683500       3.902100      0.5553000    
 H   -1.610800       3.292500       2.248200    
 H   -4.953000     -0.8134000      -1.169400    
 H   -4.349500      0.7713000     -0.6758000    
 H   -3.829800      -2.821800     -0.7550000    
 H   -2.317000      -2.282400      -1.548900    
 H   -4.603700      -1.802500       1.187200    
 H   -3.127800      -1.231400       2.055600    
 H   -4.349100     -6.6000000E-02   1.469000    
 H   -4.039600      0.4261000      -3.106700    
 H   -2.455500      0.5404000      -2.399700    
 H   -3.127000      -1.036200      -2.893500    
 H   -1.901700      -4.114900      4.6500001E-02
 H  -0.9900000      -2.695600      0.4760000    
 H   -2.448400      -3.152900       1.395000    


%chk=000022799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022799

2 1
Cl 2.066911 -0.918448 3.109553
Cl 1.940952 1.120245 -2.994379
Cl 4.105454 -2.223398 0.935576
Cl 4.044020 -1.202029 -2.117390
N -0.708594 2.098172 0.781090
N -3.108458 -0.951106 -0.071851
C -2.015780 1.304479 0.549297
C 0.205433 1.396549 1.837814
C 0.148695 2.175252 -0.524731
C -1.797521 -0.150815 0.072034
C 1.176792 0.613306 0.988321
C 1.147008 1.056893 -0.348880
C -1.099536 3.503886 1.254382
C -4.115074 -0.277376 -1.062321
C -2.749159 -2.377008 -0.626029
C -3.817853 -1.101657 1.277217
C 2.069880 -0.390779 1.389610
C 2.013428 0.507493 -1.304954
C -3.596076 -0.036756 -2.482905
C -1.919282 -3.263752 0.307277
C 2.958245 -0.956144 0.437141
C 2.930788 -0.504061 -0.916177
H -2.587394 1.888012 -0.192214
H -2.552969 1.334328 1.512461
H -0.416180 0.801563 2.528456
H 0.705064 2.187404 2.425770
H 0.630018 3.169450 -0.551516
H -0.510837 2.092874 -1.405521
H -1.174150 -0.713455 0.783603
H -1.301893 -0.181920 -0.910607
H -0.183768 4.089945 1.421501
H -1.713485 3.991529 0.481151
H -1.665321 3.427840 2.196111
H -4.991943 -0.947616 -1.076638
H -4.434523 0.666273 -0.586580
H -3.722982 -2.846798 -0.848256
H -2.220716 -2.207584 -1.578234
H -4.605934 -1.863354 1.176589
H -3.099874 -1.421843 2.045849
H -4.285691 -0.147559 1.564041
H -4.407211 0.452365 -3.051390
H -2.725583 0.641565 -2.531488
H -3.354995 -0.965427 -3.024180
H -1.769222 -4.226430 -0.214007
H -0.910361 -2.869241 0.517857
H -2.426626 -3.501768 1.256047


