%chk=000000778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000778

0 1
 S    3.371500     -0.5548000      0.3014000    
 O   -1.491100      -1.574400     -0.5671000    
 O   -1.904800     -0.1686000       1.162400    
 N  -0.6146000       1.881800      4.0100001E-02
 C  -0.5530000      0.6208000     -0.7056000    
 C   0.9109000      0.1720000     -0.8193000    
 C    1.656300      8.8000000E-03  0.5086000    
 C   -1.375300     -0.3855000      7.9499997E-02
 H   -1.004400      0.7570000      -1.693900    
 H   0.9421000     -0.7815000      -1.363200    
 H    1.448700      0.8988000      -1.443600    
 H    1.148300     -0.7220000       1.145200    
 H    1.690800      0.9569000       1.053800    
 H   -1.574600       2.224800      5.0500002E-02
 H  -6.6100001E-02   2.591000     -0.4452000    
 H    3.794800      0.4986000     -0.4124000    
 H   -2.032300      -2.215700     -5.9000000E-02


%chk=000000778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000000778

0 1
S 3.440888 -0.586234 0.293636
O -1.350572 -1.592007 -0.443484
O -2.136576 0.019547 1.030364
N -0.566550 1.983082 -0.097832
C -0.529659 0.667971 -0.742132
C 0.928204 0.120477 -0.892695
C 1.618433 -0.079976 0.463333
C -1.414327 -0.288616 0.055850
H -0.967007 0.672613 -1.769566
H 0.910823 -0.827046 -1.459521
H 1.489592 0.862579 -1.492189
H 1.168141 -0.913999 1.028476
H 1.557420 0.836330 1.070546
H -1.297349 2.095448 0.609656
H -0.436582 2.783728 -0.715669
H 3.886833 0.632514 -0.194326
H -1.954510 -2.178411 0.087753


