%chk=000131342.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131342

0 1
 Cl   2.897700       1.687000       1.614000    
 S   0.1097000      0.1399000       1.218000    
 O  -0.3635000      -1.070100       1.860300    
 O   0.3715000       1.352100       1.969700    
 O   -2.503600      -1.603400       1.295800    
 O   -4.220600      -1.249900     -2.5599999E-02
 N  -0.9667000       1.671400     -0.8010000    
 N   -2.986100      0.8489000      -1.222300    
 N   -3.059300     -0.9455000      0.3702000    
 C   -1.148100      0.6282000      3.9900001E-02
 C    1.538900     -0.2840000      0.2877000    
 C    1.460700      -1.317900     -0.6454000    
 C   -2.382900      0.1294000     -0.2211000    
 C    2.741100      0.3981000      0.4739000    
 C   -2.106800       1.769700      -1.549200    
 C   0.1880000       2.530100     -0.9183000    
 C    2.585100      -1.669500      -1.392400    
 C   0.1921000      -2.073500     -0.8749000    
 C    3.865400      4.6399999E-02 -0.2731000    
 C    3.787400     -0.9873000      -1.206400    
 H   -2.241500       2.523700      -2.312800    
 H  -4.3699998E-02   3.339400      -1.617500    
 H   0.4182000       2.970100      5.2200001E-02
 H    1.021400       1.952200      -1.318600    
 H    2.543800      -2.470900      -2.125300    
 H  -0.2224000      -2.508100      3.4200002E-02
 H  -0.5390000      -1.474200      -1.417400    
 H   0.3840000      -2.939900      -1.522000    
 H    4.810300      0.5677000     -0.1413000    
 H    4.662600      -1.260600      -1.788500    


%chk=000131342-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000131342

0 1
Cl 3.046131 1.965880 1.280785
S 0.052434 0.146394 1.210229
O -0.488559 -1.180004 1.971060
O 0.248860 1.518674 2.064017
O -2.661619 -2.109561 0.074368
O -4.455739 -0.786127 0.580429
N -1.087538 1.828221 -0.827226
N -3.203189 1.087795 -1.201571
N -3.263514 -0.970584 0.142446
C -1.225826 0.625393 -0.118517
C 1.660555 -0.309005 0.193241
C 1.599855 -1.502305 -0.585790
C -2.546861 0.208820 -0.355589
C 2.849923 0.447634 0.296386
C -2.296744 2.048816 -1.473031
C 0.091263 2.716996 -0.871534
C 2.783723 -1.883149 -1.272118
C 0.367843 -2.372788 -0.723477
C 4.010097 0.036803 -0.395750
C 3.971263 -1.131079 -1.180761
H -2.467588 2.902082 -2.124764
H -0.189609 3.637385 -1.405766
H 0.407891 2.963416 0.154569
H 0.923829 2.230111 -1.406104
H 2.758037 -2.793987 -1.879108
H -0.003679 -2.717612 0.254980
H -0.477003 -1.835935 -1.189025
H 0.594517 -3.248937 -1.351509
H 4.923844 0.630545 -0.304542
H 4.871102 -1.454391 -1.713530


