%chk=000131717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131717

0 1
 Cl   8.503000      -1.966900     -0.1482000    
 S    2.816600      0.6145000      0.4976000    
 O   -6.941500      -1.860400       1.733600    
 O   -5.389400      -3.479800       1.387600    
 O    2.313200      0.2653000       1.812200    
 O    2.937300       2.006500      0.1086000    
 N    1.921300     -0.2141000     -0.6872000    
 N   -1.600900       3.597300       1.659700    
 C   -3.337000      -1.562900     -0.3823000    
 C   -2.063400      -2.028100      -1.129200    
 C   -3.424600     -3.0500000E-02 -0.2052000    
 C   -4.571800      -2.182000      -1.084900    
 C  -0.7545000      -1.557500     -0.4863000    
 C   -3.511400      0.7687000      -1.510500    
 C   0.4603000      -2.135800      -1.220600    
 C   -5.921800      -1.926700     -0.4105000    
 C   -3.669900       2.268600      -1.227400    
 C    1.786500      -1.684100     -0.6173000    
 C   -2.550500       2.942200     -0.4649000    
 C   -6.021400      -2.515800      0.9786000    
 C   -1.472600       3.514200      -1.131500    
 C   -2.567300       3.010000      0.9188000    
 C    4.418000     -0.1118000      0.3163000    
 C  -0.4587000       4.127700     -0.4040000    
 C  -0.5691000       4.142400      0.9771000    
 C    5.341500      0.4472000     -0.5671000    
 C    4.757900      -1.244500       1.056200    
 C    6.604700     -0.1264000     -0.7107000    
 C    6.021100      -1.818100      0.9125000    
 C    6.944500      -1.259100      2.9200001E-02
 H   -3.279900      -1.989200      0.6282000    
 H   -2.058900      -3.125600      -1.161300    
 H   -2.097900      -1.691200      -2.172600    
 H   -4.295100      0.2056000      0.4187000    
 H   -2.558200      0.2943000      0.3793000    
 H   -4.626500      -1.824800      -2.120400    
 H   -4.424400      -3.268400      -1.151800    
 H  -0.7025000     -0.4644000     -0.5134000    
 H  -0.7280000      -1.862800      0.5663000    
 H   -4.369100      0.4388000      -2.105700    
 H   -2.609900      0.6072000      -2.111600    
 H   0.4160000      -3.231300      -1.196900    
 H   0.4207000      -1.835700      -2.275300    
 H   -6.718400      -2.380800      -1.011000    
 H   -6.119900     -0.8513000     -0.3616000    
 H   -3.796400       2.789600      -2.185900    
 H   -4.612100       2.437400     -0.6886000    
 H    2.611800      -2.137900      -1.176000    
 H    1.842300      -2.025700      0.4212000    
 H    1.857200      0.1954000      -1.627600    
 H   -1.411300       3.485300      -2.215800    
 H   -3.383100       2.586200       1.496400    
 H   -7.020800      -2.248400       2.631100    
 H   0.3921000       4.578300     -0.9021000    
 H    5.095500       1.324400      -1.158600    
 H    4.053600      -1.697700       1.747900    
 H   0.1960000       4.607000       1.590200    
 H    7.313700      0.3188000      -1.404000    
 H    6.271900      -2.701000       1.494800    


%chk=000131717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131717

0 1
Cl 9.061448 -1.284885 -0.773315
S 2.949890 0.493368 0.393338
O -7.453616 -2.234867 1.473825
O -5.681837 -3.673051 1.056923
O 2.613240 0.047212 1.917373
O 2.797581 2.015582 -0.161940
N 1.823853 -0.497995 -0.656114
N -2.120818 4.419082 1.576324
C -3.576188 -1.502398 -0.403082
C -2.272195 -2.077781 -1.022745
C -3.555920 0.049775 -0.272968
C -4.801294 -2.030278 -1.203990
C -0.974378 -1.693874 -0.278031
C -3.259311 0.823961 -1.579007
C 0.264031 -2.393869 -0.877931
C -6.166432 -1.814014 -0.519320
C -3.382410 2.364301 -1.415841
C 1.605636 -1.913122 -0.274132
C -2.427369 2.975555 -0.399019
C -6.356865 -2.677051 0.715027
C -1.026193 2.753680 -0.442215
C -2.909318 3.817665 0.636799
C 4.743887 -0.027234 0.049553
C -0.187018 3.360324 0.517390
C -0.776588 4.183895 1.504632
C 5.457423 0.661316 -0.946415
C 5.291221 -1.064885 0.823169
C 6.791686 0.271059 -1.198748
C 6.625421 -1.453868 0.566495
C 7.346985 -0.784117 -0.444084
H -3.654393 -1.916982 0.624444
H -2.361994 -3.184131 -1.041625
H -2.192889 -1.757846 -2.083487
H -4.529156 0.396779 0.132143
H -2.805327 0.338475 0.487382
H -4.829959 -1.551892 -2.202648
H -4.667976 -3.115873 -1.375440
H -0.812959 -0.600866 -0.308073
H -1.067575 -1.968745 0.792720
H -3.955392 0.507504 -2.381572
H -2.241055 0.574857 -1.936744
H 0.198779 -3.488601 -0.712000
H 0.281600 -2.248155 -1.978531
H -6.991809 -2.069185 -1.214610
H -6.334473 -0.759846 -0.235140
H -3.211247 2.836726 -2.405179
H -4.422486 2.615412 -1.126913
H 2.435107 -2.576145 -0.604755
H 1.550006 -1.946174 0.829159
H 2.050429 -0.316829 -1.647457
H -0.586983 2.109789 -1.213796
H -3.985104 4.022349 0.721104
H -7.568042 -2.833827 2.261378
H 0.893485 3.186331 0.497447
H 4.998332 1.496928 -1.484651
H 4.706646 -1.533386 1.621449
H -0.163367 4.673084 2.270174
H 7.387789 0.782401 -1.959356
H 7.093959 -2.253440 1.146727


