%chk=000076385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076385

0 1
 S    1.421200     -0.8995000     -0.3344000    
 O   0.4727000       1.528100     -0.1748000    
 N   -1.146000     -0.1299000      2.5500000E-02
 C   -2.289300      0.7720000      0.1752000    
 C   -1.472800      -1.550400      6.1700001E-02
 C   0.1673000      0.3380000     -0.1405000    
 C    2.847100     -5.8200002E-02  0.3872000    
 H   -2.764700      0.5818000       1.141700    
 H   -2.998400      0.5805000     -0.6353000    
 H   -1.968600       1.815900      0.1325000    
 H   -1.215800      -2.007200     -0.8987000    
 H   -2.542400      -1.694500      0.2435000    
 H  -0.9151000      -2.037500      0.8669000    
 H    3.111100      0.8232000     -0.2034000    
 H    3.702400     -0.7388000      0.3973000    
 H    2.629900      0.2458000       1.414700    


%chk=000076385-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076385

0 1
S 1.423366 -1.102827 0.257773
O 0.467555 1.494643 0.126227
N -1.171063 -0.173873 0.108394
C -2.259404 0.807476 -0.070222
C -1.554337 -1.594366 0.126777
C 0.130601 0.279842 0.154846
C 2.945557 -0.011213 0.401859
H -2.970270 0.751317 0.775636
H -2.807717 0.610567 -1.011307
H -1.822469 1.816008 -0.110141
H -1.652680 -2.006950 -0.896276
H -2.525655 -1.696405 0.642243
H -0.811435 -2.192383 0.679082
H 2.598794 1.030911 0.293739
H 3.640963 -0.276440 -0.407119
H 3.406793 -0.167008 1.387590


