%chk=000001646.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001646

0 1
 S    1.521100      0.1519000     -1.6400000E-02
 O    2.511300      -1.124500      0.2091000    
 O    1.590500       1.008600       1.153600    
 O    1.733400      0.6755000      -1.353700    
 N   -3.641500      0.3660000     -3.5000001E-03
 C   -1.196100      0.2137000     -2.6000000E-03
 C  -5.2999998E-03 -0.7334000      1.1900000E-02
 C   -2.513400     -0.5579000      1.7000000E-03
 H   -1.153000      0.8784000      0.8694000    
 H   -1.143200      0.8576000     -0.8899000    
 H  -1.8500000E-02  -1.399000     -0.8569000    
 H  -1.6600000E-02  -1.339200      0.9240000    
 H   -2.574100      -1.209400     -0.8770000    
 H   -2.575900      -1.192000      0.8925000    
 H   -4.511100     -0.1629000     -5.2800000E-02
 H   -3.609700      0.9423000     -0.8436000    
 H    2.498500      -1.517000       1.113600    


%chk=000001646-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001646

0 1
S 1.544048 0.127814 0.219316
O 2.517189 -1.464485 0.107190
O 1.885325 0.862930 1.620012
O 1.679988 0.956012 -1.163481
N -3.726980 0.398768 -0.317115
C -1.288353 0.186362 0.026141
C -0.148849 -0.794302 0.290578
C -2.643329 -0.565844 -0.095975
H -1.377398 0.929364 0.837721
H -1.096423 0.737311 -0.915304
H -0.029149 -1.568108 -0.485031
H -0.138399 -1.237530 1.298734
H -2.550218 -1.342773 -0.893770
H -2.849841 -1.101792 0.849912
H -4.660801 0.090820 -0.041037
H -3.709415 0.879767 -1.219411
H 3.489005 -1.235613 0.160920


