%chk=000089500.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089500

0 1
 S    2.586700       2.282600      0.3674000    
 O   -1.795900      0.4048000      0.3038000    
 O   -1.669500      -1.600400     -0.8255000    
 N    1.295200      -3.211300      0.1291000    
 C   0.1534000     -0.8881000      0.6284000    
 C    1.080400      0.2347000      0.2414000    
 C   -1.193100     -0.7662000     -6.5899998E-02
 C    1.525900      0.4449000      -1.080800    
 C    1.565700       1.142700       1.135700    
 C   -3.088400      0.6400000     -0.2637000    
 C    2.361100       1.537600      -1.157800    
 C   -3.614500       1.966600      0.2410000    
 C   0.7930000      -2.188000      0.3469000    
 H  -5.2299999E-02 -0.8527000       1.707200    
 H    1.260700     -0.1558000      -1.941500    
 H    1.381500       1.207300       2.199100    
 H   -3.008100      0.6652000      -1.356200    
 H   -3.769500     -0.1654000      3.2800000E-02
 H    2.849000       1.934500      -2.036800    
 H   -4.603400       2.179100     -0.1746000    
 H   -3.683400       1.963100       1.333800    
 H   -2.933800       2.779800     -3.1900000E-02


%chk=000089500-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089500

0 1
S 3.081053 2.222871 0.061156
O -2.028272 0.384994 0.436188
O -1.260969 -0.808867 -1.418948
N 0.880405 -3.179323 0.595962
C 0.142841 -0.613208 0.630941
C 1.271456 0.303688 0.154023
C -1.110844 -0.392289 -0.252960
C 1.897717 0.191678 -1.146995
C 1.784553 1.337325 0.921054
C -3.270624 0.765519 -0.319592
C 2.883175 1.136915 -1.358223
C -4.119823 1.605641 0.626278
C 0.544089 -2.035769 0.601329
H -0.129876 -0.348594 1.667281
H 1.613069 -0.562652 -1.884568
H 1.505849 1.644850 1.927812
H -2.959962 1.319174 -1.223655
H -3.773519 -0.165527 -0.636104
H 3.515034 1.288224 -2.230977
H -5.048330 1.915461 0.113385
H -4.396993 1.031007 1.526238
H -3.579329 2.513881 0.942274


