%chk=000052416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052416

0 1
 S    2.232200       3.610000       1.733900    
 O  -0.3175000       2.376600      -1.676100    
 O   0.3229000      0.4124000      -2.578000    
 C   4.8000002E-03  0.5148000     -0.1163000    
 C   0.4594000       1.693300      0.8289000    
 C   -1.455800      3.4600001E-02  8.6900003E-02
 C    1.053000     -0.6262000      5.7000000E-02
 C   5.0400000E-02   1.069700      -1.579900    
 C    1.867900       2.255600      0.5753000    
 C   -1.927500     -0.9424000     -0.7435000    
 C   0.7455000      -1.639100      0.9147000    
 C   -2.185800      0.6158000       1.084600    
 C    2.207300     -0.5357000     -0.6611000    
 C   -3.241000      -1.374600     -0.5608000    
 C    1.683000      -2.660100       1.069600    
 C   -3.499400      0.1835000       1.267400    
 C    3.144800      -1.557000     -0.5062000    
 C   -4.026900     -0.8118000      0.4446000    
 C    2.882500      -2.619100      0.3592000    
 H   0.4244000       1.338600       1.869800    
 H  -0.2528000       2.527100      0.7590000    
 H    2.643100       1.512500      0.7665000    
 H    1.985300       2.638600     -0.4412000    
 H   -1.328900      -1.397300      -1.525200    
 H  -0.1619000      -1.684500       1.505100    
 H   -1.821300       1.383400       1.754100    
 H    2.458300      0.2811000      -1.327000    
 H   -3.651200      -2.151100      -1.200000    
 H    1.482700      -3.483400       1.749100    
 H   -4.111400      0.6196000       2.051500    
 H    4.081500      -1.522900      -1.055100    
 H   -5.049300      -1.149100      0.5876000    
 H    3.613800      -3.412600      0.4820000    
 H  -0.3090000       2.689900      -2.605500    
 H    3.473400       3.858800       1.291200    


%chk=000052416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052416

0 1
S 2.195675 3.560319 1.998449
O -0.374347 2.535190 -1.597651
O 0.152527 0.565103 -2.678072
C 0.056940 0.599011 -0.172109
C 0.465162 1.700209 0.863854
C -1.406797 0.101847 0.062078
C 1.054853 -0.580654 -0.062649
C -0.008550 1.181516 -1.601908
C 1.898120 2.222212 0.676769
C -1.876600 -0.997253 -0.705604
C 0.921624 -1.470242 1.035662
C -2.288539 0.713315 0.985630
C 2.157614 -0.749595 -0.937023
C -3.192473 -1.477218 -0.547705
C 1.860166 -2.500491 1.255223
C -3.607832 0.228701 1.147580
C 3.096580 -1.784196 -0.720705
C -4.065965 -0.866286 0.382985
C 2.955166 -2.663637 0.375207
H 0.370338 1.265011 1.876309
H -0.232827 2.551107 0.785126
H 2.641570 1.423710 0.820199
H 2.027226 2.685704 -0.314988
H -1.205136 -1.472037 -1.429747
H 0.070074 -1.361052 1.717392
H -1.964080 1.566895 1.586749
H 2.279688 -0.096068 -1.804979
H -3.536362 -2.325684 -1.149590
H 1.734832 -3.175717 2.109104
H -4.275195 0.711239 1.870490
H 3.937029 -1.902946 -1.413867
H -5.089019 -1.238137 0.508080
H 3.683150 -3.465804 0.539927
H -0.504285 2.832407 -2.539099
H 3.546173 3.732522 1.740983


