%chk=000118569.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118569

0 1
 S   -2.626600     -0.6066000     -0.1320000    
 O   -3.228900      -1.550500      0.7890000    
 O   -2.019900      -1.060900      -1.368600    
 N   -1.499500      0.3718000      0.6967000    
 C   0.4252000       1.920800      0.5475000    
 C  -0.9763000       1.582000      3.7900001E-02
 C    1.402100      0.8085000      0.2606000    
 C    1.579300     -0.2005000       1.195200    
 C    2.107800      0.8130000     -0.9332000    
 C   -3.857700      0.6038000     -0.5580000    
 C    2.483300      -1.229100      0.9300000    
 C    3.011800     -0.2157000      -1.198500    
 C    3.199500      -1.236700     -0.2667000    
 H   0.3977000       2.115600       1.627500    
 H   0.7724000       2.851500      8.1699997E-02
 H  -0.9438000       1.437800      -1.047700    
 H   -1.649300       2.418700      0.2536000    
 H   -1.656500      0.4919000       1.706200    
 H    1.030800     -0.2034000       2.132900    
 H    1.967000       1.602500      -1.665800    
 H   -3.438000       1.329700      -1.255700    
 H   -4.687600      7.9099998E-02  -1.037400    
 H   -4.210400       1.087900      0.3546000    
 H    2.630200      -2.023600       1.655800    
 H    3.569100     -0.2220000      -2.130600    
 H    3.903500      -2.037600     -0.4733000    


%chk=000118569-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118569

0 1
S -2.384936 -0.113218 -0.965134
O -2.223748 -1.706289 -0.675807
O -1.784041 0.577427 -2.322130
N -1.725529 0.808440 0.562598
C 0.503276 1.962568 0.890018
C -0.883487 1.992671 0.204589
C 1.371801 0.745490 0.570550
C 2.239003 0.226586 1.567156
C 1.362512 0.127171 -0.707778
C -4.225898 0.333615 -0.872702
C 3.087117 -0.870206 1.295307
C 2.204082 -0.975178 -0.978969
C 3.072359 -1.475835 0.017737
H 0.371857 2.040725 1.986697
H 1.030428 2.888460 0.580192
H -0.765318 2.045057 -0.898050
H -1.426168 2.902399 0.519348
H -1.161078 0.062899 1.022458
H 2.251226 0.687427 2.563359
H 0.692559 0.488402 -1.497524
H -4.286991 1.427014 -0.949606
H -4.699104 -0.175190 -1.723966
H -4.579425 -0.039315 0.097008
H 3.750309 -1.254443 2.078643
H 2.172614 -1.446372 -1.967459
H 3.721779 -2.332305 -0.194834


