%chk=000005586.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005586

0 1
 Cl   5.785700      -1.876200     -0.2343000    
 S    5.196700       1.293000      2.8200001E-02
 O  -2.4499999E-02   1.166200      0.9451000    
 O    4.721800       2.480800      0.7196000    
 O    6.431900      0.6507000      0.4480000    
 N   -2.110000     -0.3341000     -7.1699999E-02
 N  -0.7927000     -0.7243000     -0.1591000    
 N    5.285900       1.622200      -1.644700    
 C   -4.226600     -0.2594000      -1.132900    
 C   -4.361600      -1.015400      0.2084000    
 C   -4.927900       1.089300     -0.8332000    
 C   -5.121900      2.2000000E-03   1.095500    
 C   -4.596800       1.361200      0.6338000    
 C   -6.444300      0.8221000     -0.7422000    
 C   -6.578700      6.9899999E-02  0.5931000    
 C   -2.721700     -0.1834000      -1.392300    
 C   -2.925500      -1.324100      0.6328000    
 C   0.1838000      9.4899997E-02  0.3807000    
 C    1.583200     -0.3825000      0.2279000    
 C    2.604000      0.5444000      0.2016000    
 C    1.815100      -1.737400      0.1176000    
 C    3.917000      9.5799997E-02  5.8400001E-02
 C    3.128100      -2.186200     -2.5400000E-02
 C    4.179000      -1.269500     -5.4900002E-02
 H   -4.722100     -0.7876000      -1.955600    
 H   -4.929000      -1.947100      0.1014000    
 H   -4.670300       1.890000      -1.529500    
 H   -5.042000     -0.1934000       2.166900    
 H   -3.537300       1.529000      0.8350000    
 H   -5.162800       2.202200       1.050900    
 H   -6.822600      0.2360000      -1.585600    
 H   -7.004500       1.763200     -0.7023000    
 H   -7.204400      0.6429000       1.286900    
 H   -7.029300     -0.9194000      0.4655000    
 H   -2.434200      -1.009600      -2.056800    
 H   -2.430300      0.7564000      -1.872500    
 H   -2.791400      -1.265900       1.717900    
 H   -2.671200      -2.343400      0.3116000    
 H  -0.5882000      -1.572800     -0.6770000    
 H    2.386700       1.605800      0.2759000    
 H    1.029600      -2.484000      0.1698000    
 H    3.315800      -3.254100     -0.1053000    
 H    4.942500       2.533900      -1.970800    
 H    6.110000       1.281900      -2.155000    


%chk=000005586-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005586

0 1
Cl 5.972871 -1.777587 -0.062746
S 5.215060 1.541801 -0.175167
O -0.124181 1.297997 0.712759
O 4.380768 2.922113 -0.378583
O 6.331602 1.391744 0.991227
N -2.207411 -0.437058 -0.133825
N -0.836815 -0.748089 -0.195361
N 5.944011 1.174594 -1.816735
C -4.347645 -0.116724 -1.168265
C -4.498624 -1.090829 0.085442
C -5.033833 1.192723 -0.668064
C -5.228715 -0.191756 1.132679
C -4.644000 1.221296 0.839181
C -6.568958 0.926018 -0.591768
C -6.705089 -0.023165 0.658697
C -2.825379 -0.012385 -1.426946
C -3.055890 -1.509697 0.455379
C 0.130828 0.146615 0.263827
C 1.550842 -0.371172 0.167770
C 2.585177 0.588053 0.039350
C 1.890786 -1.744583 0.261578
C 3.915668 0.156347 -0.021494
C 3.236726 -2.164858 0.201296
C 4.257326 -1.205189 0.048573
H -4.860487 -0.506115 -2.065911
H -5.104787 -1.984392 -0.148415
H -4.762493 2.082844 -1.259945
H -5.130096 -0.556966 2.168826
H -3.557735 1.294464 1.008640
H -5.164563 2.020183 1.397976
H -6.956398 0.464309 -1.518970
H -7.119946 1.871227 -0.437300
H -7.314894 0.447033 1.451244
H -7.176160 -0.991698 0.408279
H -2.519157 -0.690308 -2.261147
H -2.494911 1.011432 -1.674142
H -2.884563 -1.566829 1.544634
H -2.815543 -2.509147 0.011631
H -0.539792 -1.578073 -0.735101
H 2.344795 1.657115 -0.001220
H 1.112708 -2.499200 0.419701
H 3.498503 -3.224066 0.276881
H 6.006984 2.063994 -2.339202
H 6.848410 0.692183 -1.693857


