%chk=000005734.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005734

0 1
 S   -2.699000      0.3331000     -0.3064000    
 O    1.160500      -2.030600     -0.1297000    
 O   -2.114400       1.498400     -0.9422000    
 O   -3.017300     -0.8583000      -1.069900    
 N  -0.1601000      -1.916900      0.2874000    
 N   -4.076800      0.8133000      0.5733000    
 C   -1.643200     -0.1438000       1.034800    
 C  -0.3334000     -0.6198000      0.5590000    
 C   0.8337000      0.1358000      0.3350000    
 C    1.751000     -0.8047000     -0.1001000    
 C    1.231200       1.476600      0.4420000    
 C    3.067100     -0.5145000     -0.4473000    
 C    2.550800       1.805200      0.1002000    
 C    3.449900      0.8263000     -0.3359000    
 H   -1.525600      0.7281000       1.686900    
 H   -2.161900     -0.9266000       1.599100    
 H   0.5443000       2.246600      0.7787000    
 H    3.756200      -1.279300     -0.7842000    
 H    2.879700       2.838600      0.1757000    
 H    4.466600       1.112700     -0.5936000    
 H   -4.635800      8.0200002E-02   1.026900    
 H   -4.020700       1.685100       1.113800    


%chk=000005734-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005734

0 1
S -2.586281 0.678283 -0.051333
O 1.360574 -2.208159 0.161030
O -2.069680 2.225440 0.003909
O -2.657472 -0.160786 -1.437726
N -0.014362 -2.082406 0.654949
N -4.246246 0.660674 0.761494
C -1.554770 -0.325017 1.312472
C -0.243906 -0.751016 0.781311
C 0.899906 0.045568 0.381525
C 1.880300 -0.908329 0.002690
C 1.184746 1.431462 0.281462
C 3.161662 -0.567638 -0.460600
C 2.464996 1.796938 -0.177880
C 3.435908 0.814506 -0.539275
H -1.510649 0.431190 2.109930
H -2.212406 -1.167026 1.568787
H 0.426156 2.182251 0.521847
H 3.894302 -1.326210 -0.746209
H 2.721887 2.856863 -0.272691
H 4.418624 1.141331 -0.895687
H -4.885246 0.076945 0.195284
H -4.565240 1.640637 0.848209


