%chk=000151277.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151277

0 1
 S    1.080900      0.6079000      0.5445000    
 O   -2.496200       1.535500      0.5843000    
 O   -2.036000      0.6116000      -1.435700    
 O    2.819600      -1.067600     -0.5360000    
 N   -2.207600      -1.808100      0.2320000    
 N    3.587800       1.006400      0.1218000    
 C   -1.416700     -0.6183000      0.5526000    
 C   5.1899999E-02 -0.8536000      0.1945000    
 C   -2.015100      0.5477000     -0.2120000    
 C    2.631300      3.8400002E-02 -4.6000000E-02
 H   -1.507900     -0.4244000       1.628500    
 H   0.4479000      -1.701800      0.7646000    
 H   0.1482000      -1.088700     -0.8722000    
 H   -3.162300      -1.684300      0.5678000    
 H   -1.833200      -2.612700      0.7336000    
 H   -2.861200       2.281500      6.2199999E-02
 H    3.364400       1.905100      0.5363000    
 H    4.549400      0.8541000     -0.1634000    


%chk=000151277-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151277

0 1
S 1.268036 0.633627 -0.990957
O -3.065486 0.791760 0.883815
O -2.040347 1.383697 -1.113112
O 2.141159 -1.073678 1.016591
N -1.782952 -1.652123 0.630342
N 3.547185 0.709904 0.479139
C -1.053818 -0.408924 0.311323
C -0.062228 -0.691646 -0.834223
C -2.059800 0.671072 -0.090762
C 2.405839 -0.048073 0.337749
H -0.481734 0.002330 1.177749
H 0.468478 -1.634831 -0.631066
H -0.569085 -0.736615 -1.809137
H -2.640637 -1.500488 1.169720
H -1.178162 -2.372993 1.035442
H -3.709525 1.498643 0.607625
H 3.725726 1.526646 -0.102927
H 4.232548 0.430389 1.180089


