%chk=000000581.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000581

0 1
 S    1.353000       2.221000      -1.021000    
 O    1.405600      -1.523300      -1.006500    
 O    2.652300     -0.8397000      0.7593000    
 O   -2.389000      9.5600002E-02   1.269100    
 N  -0.7286000     -0.1885000     -0.3382000    
 C   0.4124000      5.4499999E-02  0.5088000    
 C   0.7599000       1.544200      0.5652000    
 C    1.605400     -0.8047000      0.1241000    
 C   -2.037000     -0.1467000      0.1175000    
 C   -3.034000     -0.4125000     -0.9784000    
 H   0.1301000     -0.2700000       1.518800    
 H    1.551500       1.714900       1.302600    
 H  -0.1118000       2.130900      0.8743000    
 H  -0.5577000     -0.3755000      -1.322300    
 H   -4.021200     -0.5904000     -0.5430000    
 H   -3.083800      0.4544000      -1.642900    
 H   -2.740800      -1.295900      -1.552800    
 H   0.2379000       1.966000      -1.721200    
 H    2.189500      -2.064600      -1.240500    


%chk=000000581-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000000581

0 1
S 1.358747 2.211538 -1.072467
O 1.458213 -1.622452 -0.953166
O 2.706487 -0.795868 0.824811
O -2.276786 0.586638 1.088719
N -0.713886 -0.274633 -0.390274
C 0.401157 0.005911 0.519667
C 0.777172 1.511118 0.584289
C 1.639556 -0.820448 0.182205
C -2.017523 0.018014 -0.017363
C -3.099653 -0.383583 -1.012241
H 0.088506 -0.269116 1.549278
H 1.627252 1.652741 1.269774
H -0.092032 2.082771 0.940618
H -0.506347 -0.796764 -1.243516
H -3.785232 -1.100260 -0.527956
H -3.696207 0.506023 -1.277367
H -2.702166 -0.837528 -1.936052
H 0.129095 2.113446 -1.703577
H 2.297347 -2.117849 -1.152482


