%chk=000080850.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080850

0 1
 Cl   4.377000     -9.5600002E-02   1.260200    
 S   -1.226600      -1.876100     -0.8993000    
 O   -1.397100      -1.276500      -2.210400    
 O   -1.279400      -3.320600     -0.7672000    
 O    2.036600       2.112500      -1.614300    
 O    3.813500       1.822400     -0.3585000    
 N   -2.331000      -1.147800      0.2345000    
 N    2.693300       1.449400     -0.7782000    
 C   0.3575000      -1.358300     -0.2956000    
 C   -2.299800      0.2759000      0.3368000    
 C   0.8995000     -0.1758000     -0.7610000    
 C   -2.586500      -1.913100       1.495100    
 C    1.015500      -2.151000      0.6251000    
 C    2.147300      0.2297000     -0.2875000    
 C   -1.364800      0.8952000       1.166300    
 C   -3.203600       1.047500     -0.3934000    
 C    2.263200      -1.745500       1.098900    
 C    2.829100     -0.5550000      0.6426000    
 C   -1.333800       2.286200       1.265300    
 C   -3.172400       2.438500     -0.2945000    
 C   -2.237500       3.058000      0.5349000    
 H   0.3519000      0.4199000      -1.485600    
 H   -1.682700      -1.975900       2.106700    
 H   -3.374700      -1.423700       2.077200    
 H   -2.939400      -2.920000       1.254200    
 H   0.5884000      -3.077100      0.9967000    
 H  -0.6705000      0.3170000       1.769100    
 H   -3.935800      0.5744000      -1.042500    
 H    2.780400      -2.367900       1.824800    
 H  -0.6096000       2.768200       1.915700    
 H   -3.876100       3.039300     -0.8631000    
 H   -2.213900       4.140900      0.6130000    


%chk=000080850-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080850

0 1
Cl 4.606896 -0.154985 0.937475
S -1.354533 -1.979164 -0.856750
O -1.662513 -1.329964 -2.312906
O -1.414501 -3.584226 -0.576274
O 2.098594 2.008605 -1.972808
O 3.284994 2.313065 -0.045787
N -2.649507 -1.113612 0.469537
N 2.544496 1.612556 -0.828944
C 0.387928 -1.415381 -0.358059
C -2.427349 0.295146 0.521294
C 0.845039 -0.170063 -0.801739
C -2.556697 -1.907974 1.715005
C 1.155926 -2.271268 0.451191
C 2.124080 0.256254 -0.377860
C -1.922299 0.971729 1.671428
C -2.780139 1.052351 -0.637009
C 2.446100 -1.849199 0.831247
C 2.930671 -0.582512 0.433273
C -1.786490 2.375526 1.661101
C -2.609164 2.449621 -0.644351
C -2.114930 3.119040 0.503133
H 0.253600 0.463164 -1.470363
H -1.642896 -1.740548 2.325247
H -3.441012 -1.654342 2.327495
H -2.618635 -2.975266 1.446200
H 0.766559 -3.252583 0.741555
H -1.658283 0.413264 2.575231
H -3.186526 0.527410 -1.505879
H 3.087098 -2.500150 1.432055
H -1.415943 2.889932 2.554602
H -2.876469 3.021024 -1.539467
H -1.996094 4.207650 0.497130


