%chk=000040457.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040457

0 1
 Cl   2.997000       2.648900      -3.272900    
 Cl   2.020300       2.843900       3.312700    
 O   -2.490400      -2.425400     -0.8560000    
 O   -2.941900       2.234000     -0.2737000    
 O   -5.176000       1.928200     -0.4456000    
 N    2.601100      0.4667000      0.1011000    
 N   -2.397300     -0.3061000      8.2000002E-02
 C    1.782400     -0.6835000      6.1500002E-02
 C    3.193700      0.9856000      -1.114500    
 C    2.868400       1.132000       1.359600    
 C    2.333800      -1.956900      0.2022000    
 C   0.4074000     -0.5351000     -0.1211000    
 C  -0.3853000      -1.663400     -0.1586000    
 C    1.510300      -3.082000      0.1604000    
 C   0.1353000      -2.933600     -2.1900000E-02
 C    2.273800       1.996000      -1.781800    
 C    1.707100       2.028000       1.760400    
 C    3.802900      -2.145400      0.3987000    
 C   -1.849600      -1.506000     -0.3533000    
 C   -3.803500     -1.4600000E-02 -1.5400000E-02
 C   -4.533300     -0.4751000       1.237300    
 C   -4.056000       1.463600     -0.2613000    
 H    3.410900      0.1658000      -1.811600    
 H    4.161400       1.453200     -0.8941000    
 H    3.054800      0.3895000       2.145900    
 H    3.785000       1.730700       1.289000    
 H   5.7000001E-03  0.4628000     -0.2656000    
 H    1.922900      -4.081400      0.2698000    
 H  -0.4926000      -3.819200     -4.6700001E-02
 H    2.073300       2.849300      -1.130000    
 H    1.315900       1.547600      -2.059500    
 H   0.7833000       1.458100       1.890800    
 H    1.519700       2.808700       1.019900    
 H    4.133400      -1.670100       1.327500    
 H    4.069700      -3.205900      0.4667000    
 H    4.364100      -1.727600     -0.4430000    
 H   -4.198900     -0.5487000     -0.8876000    
 H   -1.824400      0.3760000      0.5675000    
 H   -5.608900     -0.2830000       1.161300    
 H   -4.391300      -1.548100       1.405300    
 H   -4.164900      5.2400000E-02   2.124800    
 H   -3.150300       3.178000     -0.4405000    


%chk=000040457-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040457

0 1
Cl 1.175706 3.810196 -2.119270
Cl 4.433522 1.797680 3.474082
O -2.739669 -2.464749 0.678504
O -3.183560 1.524766 -1.965542
O -5.467957 1.094983 -1.895837
N 2.623550 0.483987 -0.037686
N -2.508767 -0.399400 -0.347414
C 1.797540 -0.669902 0.173050
C 2.290630 1.441949 -1.109152
C 3.656619 0.872946 0.939855
C 2.365817 -1.971048 0.381234
C 0.382638 -0.536075 0.119509
C -0.480357 -1.644388 0.286036
C 1.481307 -3.059465 0.596721
C 0.082732 -2.914355 0.556442
C 1.599227 2.733041 -0.619134
C 3.041229 1.391462 2.255979
C 3.857785 -2.234744 0.307551
C -1.982725 -1.542866 0.229456
C -3.962610 -0.211965 -0.444981
C -4.606453 0.185189 0.914477
C -4.316971 0.831678 -1.498133
H 1.636502 0.935511 -1.839262
H 3.216395 1.729872 -1.646389
H 4.321685 0.028031 1.183209
H 4.289861 1.659497 0.490251
H -0.033271 0.469869 -0.005243
H 1.912488 -4.053989 0.762654
H -0.590987 -3.761544 0.715902
H 2.254378 3.359533 0.004723
H 0.643543 2.546553 -0.107044
H 2.424859 0.626951 2.752121
H 2.474171 2.326081 2.132624
H 4.367909 -2.067866 1.277021
H 4.046114 -3.284172 0.023505
H 4.340018 -1.581658 -0.441566
H -4.420582 -1.171378 -0.756664
H -1.918912 0.282868 -0.826133
H -5.698868 0.287758 0.801295
H -4.391654 -0.610757 1.645020
H -4.189706 1.138881 1.282563
H -3.454177 2.208939 -2.634634


