%chk=000031136.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031136

0 1
 Cl  -4.030800       3.524600     -0.2611000    
 Cl  -6.083800       1.865400      -2.132300    
 S   -2.029500      -1.129800       1.585900    
 O    3.459700       2.189500       1.778900    
 O    3.799200       2.911700     -0.8815000    
 O   -1.698300     -0.2352000       2.681600    
 O   -2.582400      -2.445600       1.858000    
 N    1.391500      -3.097500     -0.7022000    
 C    1.743900      -2.241400      0.4627000    
 C    2.297400     -0.8621000      9.5100001E-02
 C   0.4838000      -2.076800       1.334100    
 C    2.314300      -2.914500      -1.828700    
 C    2.220200      -1.481700      -2.343100    
 C    2.521400     -0.5033000      -1.245300    
 C  -0.5989000      -1.343600      0.5752000    
 C    1.352900      -4.519400     -0.3390000    
 C    2.643900      5.7200000E-02   1.100700    
 C    3.009000      0.7729000      -1.562700    
 C    3.144600       1.319800      0.7788000    
 C    3.318100       1.681000     -0.5530000    
 C   -3.166800     -0.2672000      0.5423000    
 C   -3.165200       1.116800      0.5386000    
 C   -4.037900     -0.9931000     -0.2513000    
 C   -4.063000       1.796400     -0.2847000    
 C   -4.935600     -0.3134000      -1.074500    
 C    2.426500       3.065100       2.225800    
 C    5.214100       3.043000      -1.006900    
 C   -4.948300       1.081200      -1.091200    
 H    2.531400      -2.737000       1.047600    
 H   0.7225000      -1.536400       2.258200    
 H   0.1135000      -3.049900       1.676000    
 H    2.043900      -3.584800      -2.654100    
 H    3.345400      -3.155100      -1.535700    
 H    1.216200      -1.278400      -2.736000    
 H    2.933900      -1.356500      -3.166100    
 H  -0.2877000     -0.3401000      0.2706000    
 H  -0.9211000      -1.899100     -0.3112000    
 H    1.062400      -5.127200      -1.203800    
 H   0.6044000      -4.721800      0.4322000    
 H    2.324500      -4.878500      1.9200001E-02
 H    2.528600     -0.2096000       2.148700    
 H    3.157700       1.053300      -2.603200    
 H   -2.470700       1.676000       1.159600    
 H   -4.037800      -2.078600     -0.2574000    
 H   -5.617400     -0.8866000      -1.697900    
 H    2.831400       3.694200       3.023200    
 H    1.584100       2.491600       2.625600    
 H    2.087900       3.710000       1.408800    
 H    5.589800       2.395700      -1.805700    
 H    5.709200       2.799600     -6.1600000E-02
 H    5.440300       4.081700      -1.262700    


%chk=000031136-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031136

0 1
Cl -5.939968 2.639023 0.056561
Cl -6.838265 0.718364 -2.447883
S -2.265994 -1.231519 1.700429
O 4.230504 2.035686 1.815492
O 4.606353 2.792701 -0.998945
O -2.457749 -0.318981 3.046714
O -2.346153 -2.872649 1.745489
N 1.032851 -2.682616 -0.705098
C 1.641848 -1.979793 0.458391
C 2.414538 -0.714659 0.046638
C 0.528272 -1.653567 1.506883
C 1.894140 -2.675171 -1.913557
C 2.058575 -1.234547 -2.420299
C 2.602748 -0.347708 -1.313306
C -0.561529 -0.784726 0.881374
C 0.551348 -4.042181 -0.364206
C 2.972673 0.106506 1.058100
C 3.342565 0.818973 -1.623323
C 3.689667 1.277492 0.749213
C 3.896405 1.631045 -0.616045
C -3.577522 -0.650347 0.457190
C -4.164933 0.602035 0.685015
C -3.953239 -1.510797 -0.586702
C -5.168010 1.028219 -0.210288
C -4.959522 -1.069606 -1.472515
C 3.678721 3.406514 1.934491
C 6.033847 2.807870 -0.598573
C -5.556668 0.197192 -1.287204
H 2.365446 -2.659922 0.981409
H 0.967839 -1.163108 2.389850
H 0.082248 -2.603779 1.855944
H 1.401505 -3.295732 -2.683866
H 2.899601 -3.124934 -1.715355
H 1.071158 -0.865291 -2.761270
H 2.735513 -1.212758 -3.295316
H -0.472563 0.298691 1.050081
H -0.700845 -1.042162 -0.182938
H 0.146048 -4.517658 -1.274354
H -0.265142 -3.998566 0.376503
H 1.360528 -4.699491 0.039290
H 2.861701 -0.141578 2.119262
H 3.517820 1.105333 -2.666410
H -3.870646 1.207574 1.548895
H -3.500257 -2.502052 -0.685713
H -5.290254 -1.701167 -2.301819
H 4.232141 3.874292 2.762810
H 2.600875 3.361233 2.180858
H 3.825665 3.975315 0.998584
H 6.581887 2.001851 -1.122487
H 6.140603 2.684212 0.493975
H 6.416025 3.789444 -0.917467


