%chk=000110016.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110016

0 1
 S    2.343900     -0.7212000      -1.196800    
 O   -3.703800     -0.1219000      0.4752000    
 O   -2.705800      -1.878900     -0.3828000    
 N    2.148900       2.182200     -0.1312000    
 N   -2.680500     -0.6933000      2.7300000E-02
 N    3.243500      -1.791400       1.289200    
 C   0.9491000       1.435400     -0.1032000    
 C   -1.455800      2.4100000E-02 -1.7100001E-02
 C   0.8980000      0.1163000     -0.5537000    
 C  -0.3043000     -0.5894000     -0.5106000    
 C  -0.2024000       2.048800      0.3903000    
 C   -1.404900       1.343300      0.4332000    
 C    2.874200      -1.354100      0.2802000    
 H  -0.3300000      -1.617700     -0.8658000    
 H  -0.1773000       3.076300      0.7447000    
 H   -2.281600       1.853400      0.8241000    
 H    2.995200       1.758400     -0.4873000    
 H    2.161800       3.137200      0.2013000    


%chk=000110016-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110016

0 1
S 2.318464 -0.839916 -1.213487
O -3.863819 0.000055 0.412704
O -2.872362 -1.863222 -0.465794
N 2.167313 2.060494 -0.073333
N -2.831793 -0.645096 -0.029177
N 3.833659 -1.498759 1.239150
C 0.960562 1.398278 -0.060534
C -1.538021 0.050450 -0.035690
C 0.836729 0.041102 -0.510341
C -0.391942 -0.630171 -0.501589
C -0.225917 2.047662 0.413157
C -1.457548 1.387399 0.425904
C 3.191176 -1.219678 0.266769
H -0.483103 -1.664870 -0.842285
H -0.157072 3.082278 0.766600
H -2.365421 1.880123 0.783660
H 3.007547 1.606464 -0.428737
H 2.239749 3.014907 0.270023


