%chk=000178045.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178045

0 1
 Cl   5.738000      3.9999999E-02   1.233900    
 S   0.1340000      0.3927000      -1.525100    
 O   -1.090300      -1.967500     -0.2121000    
 O   3.2900002E-02   1.686400      -2.155800    
 O  -9.9100001E-02 -0.8271000      -2.260800    
 O  -0.3383000     -0.9946000       1.743600    
 C   -1.003100      0.3777000     -0.1322000    
 C  -0.6226000       1.530800      0.8127000    
 C   -2.448800      0.3852000     -0.6587000    
 C   -1.708100       1.946900       1.806400    
 C   -3.012600       1.764000      -1.005900    
 C   -2.667200       2.988300       1.233700    
 C   -3.649700       2.462100      0.1941000    
 C  -0.7630000     -0.9211000      0.5985000    
 C    1.711800      0.2936000     -0.7501000    
 C    2.273700     -0.9506000     -0.5031000    
 C    2.372100       1.460900     -0.3946000    
 C   -1.558700      -3.141700      0.4587000    
 C    3.522700      -1.029200      0.1128000    
 C    3.621200       1.382200      0.2213000    
 C   -2.791700      -2.792200       1.277800    
 C   -1.849800      -4.223600     -0.5702000    
 C    4.196500      0.1372000      0.4750000    
 H  -0.3395000       2.424900      0.2442000    
 H   0.2672000       1.278000       1.402800    
 H   -3.118900     -8.7700002E-02  7.0299998E-02
 H   -2.525500     -0.2387000      -1.559000    
 H   -1.210600       2.406700       2.670200    
 H   -2.255900       1.080200       2.192700    
 H   -3.806200       1.617400      -1.750200    
 H   -2.270600       2.413500      -1.477700    
 H   -2.096700       3.822300      0.8062000    
 H   -3.248800       3.413100       2.061600    
 H   -4.364500       1.785400      0.6788000    
 H   -4.239100       3.311500     -0.1736000    
 H    1.768900      -1.871700     -0.7777000    
 H    1.947500       2.441600     -0.5859000    
 H  -0.7642000      -3.507800       1.120900    
 H    3.959100      -2.006200      0.3041000    
 H    4.135300       2.299400      0.4971000    
 H   -3.202300      -3.687400       1.756900    
 H   -2.585500      -2.066500       2.069500    
 H   -3.572900      -2.360000      0.6431000    
 H   -2.193400      -5.146600     -9.3699999E-02
 H  -0.9501000      -4.444600      -1.154600    
 H   -2.612200      -3.889600      -1.282500    


%chk=000178045-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178045

0 1
Cl 5.521903 -2.283256 0.467829
S 0.281505 1.094410 -1.234188
O -1.278079 -1.594380 0.226181
O 0.698864 2.682129 -1.158278
O -0.217518 0.429040 -2.650393
O -0.263594 -0.474803 2.004688
C -1.372490 0.814007 0.221666
C -1.249725 2.064664 1.075166
C -2.548059 0.642744 -0.735385
C -2.579979 2.495281 1.765501
C -3.176102 1.944842 -1.286065
C -3.494741 3.373648 0.880268
C -4.155726 2.645617 -0.312450
C -0.915614 -0.450674 0.928574
C 1.801169 0.104948 -0.705683
C 1.974987 -1.171629 -1.265219
C 2.716934 0.695283 0.180090
C -0.878817 -2.926635 0.826668
C 3.125501 -1.907980 -0.904141
C 3.865348 -0.043858 0.542697
C -1.862982 -3.279378 1.950368
C -0.892789 -3.909274 -0.345113
C 4.043408 -1.332704 -0.000867
H -0.886914 2.904603 0.447190
H -0.478562 1.880905 1.844108
H -3.324973 0.048193 -0.211098
H -2.213219 0.006383 -1.578996
H -2.301481 3.077114 2.665365
H -3.134955 1.608796 2.132851
H -3.729752 1.676153 -2.205998
H -2.382632 2.649225 -1.606185
H -2.896817 4.226691 0.498586
H -4.292900 3.809463 1.514523
H -4.875435 1.891202 0.070379
H -4.755197 3.384757 -0.880339
H 1.248851 -1.558398 -1.987482
H 2.554527 1.708841 0.559271
H 0.139530 -2.794887 1.238188
H 3.307196 -2.901663 -1.322900
H 4.604263 0.375720 1.230470
H -1.597643 -4.261787 2.381834
H -1.824055 -2.529518 2.757471
H -2.893837 -3.340639 1.558674
H -0.589925 -4.912430 0.005108
H -0.194593 -3.590546 -1.137326
H -1.903881 -3.982622 -0.782207


