%chk=000062818.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062818

0 1
 Cl   1.276000     -0.9002000      -2.378800    
 Cl   4.721000       2.718900     -0.2440000    
 Cl   3.886300       1.546400       2.652500    
 O  -0.4146000      -1.333600      8.2099997E-02
 O    1.127700      -2.687000       1.125600    
 N    2.336500     -5.4200001E-02   1.378200    
 N    3.288700       1.331600      -2.482900    
 C   -3.184900     -0.4642000      0.3774000    
 C   -2.755000      -1.783800     -0.2749000    
 C   -4.491600      5.2400000E-02 -0.2298000    
 C   -1.433400      -2.306200      0.2964000    
 C   -4.953300       1.386300      0.3641000    
 C   -6.218300       1.939200     -0.2932000    
 C   -1.019000      -3.608600     -0.3752000    
 C   -6.593400       3.296900      0.2812000    
 C   0.8221000      -1.654800      0.5489000    
 C    1.788200     -0.5636000      0.2655000    
 C    2.049700     -0.1635000      -1.019700    
 C    2.969300      0.8665000      -1.184000    
 C    3.572900       1.436700     -6.8700001E-02
 C    3.225200      0.9449000       1.179200    
 H   -3.313500     -0.6106000       1.456400    
 H   -2.404300      0.2939000      0.2438000    
 H   -3.542700      -2.534400     -0.1383000    
 H   -2.641500      -1.617200      -1.353900    
 H   -4.361400      0.1714000      -1.312800    
 H   -5.280900     -0.6959000     -8.6400002E-02
 H   -1.558100      -2.466300       1.375100    
 H   -4.144200       2.120000      0.2584000    
 H   -5.126700       1.260500       1.440000    
 H   -6.063000       2.037400      -1.373800    
 H   -7.048600       1.239100     -0.1464000    
 H  -0.2916000      -4.182200      0.2039000    
 H  -0.5871000      -3.430200      -1.365900    
 H   -1.884000      -4.270700     -0.4963000    
 H   -5.794500       4.027100      0.1172000    
 H   -7.501600       3.673500     -0.1996000    
 H   -6.781700       3.228700       1.357400    
 H    2.847300      0.9128000      -3.290700    
 H    3.958500       2.080400      -2.599200    


%chk=000062818-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062818

0 1
Cl 2.046959 -1.559977 -2.269357
Cl 4.776352 2.935867 -0.462323
Cl 3.157858 2.656076 2.391780
O -0.408607 -1.397354 -0.171965
O 0.849266 -2.266770 1.599762
N 1.970230 0.511745 1.270960
N 3.985807 0.762861 -2.429480
C -3.228501 -0.486025 0.285162
C -2.789885 -1.756353 -0.476089
C -4.530261 0.123798 -0.280160
C -1.515275 -2.408046 0.073365
C -4.990933 1.391045 0.475375
C -6.297584 1.994770 -0.087474
C -1.131692 -3.724691 -0.613738
C -6.754345 3.258667 0.673241
C 0.698787 -1.465530 0.652880
C 1.702031 -0.394056 0.282735
C 2.354196 -0.331208 -0.957494
C 3.325304 0.686539 -1.229705
C 3.562080 1.618743 -0.172147
C 2.864077 1.481014 1.040716
H -3.373654 -0.730120 1.358313
H -2.415071 0.263731 0.239537
H -3.597202 -2.515647 -0.428728
H -2.635699 -1.521314 -1.547973
H -4.383323 0.370719 -1.352715
H -5.339217 -0.636533 -0.244540
H -1.575650 -2.547265 1.170023
H -4.187475 2.155805 0.435510
H -5.134111 1.148077 1.549134
H -6.153385 2.238841 -1.159974
H -7.098877 1.228518 -0.048309
H -0.191624 -4.128141 -0.202001
H -1.013097 -3.577539 -1.701619
H -1.926275 -4.475195 -0.448512
H -5.983204 4.050654 0.624585
H -7.689554 3.671332 0.251747
H -6.935352 3.034258 1.741548
H 3.795406 0.077477 -3.157885
H 4.672000 1.498627 -2.585384


