%chk=000123925.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123925

0 1
 S   -3.833300     -0.6568000     -0.5570000    
 O    1.860900     -0.6444000      0.5674000    
 N    1.798600       1.271700     -0.7796000    
 C   -1.188100     -5.5999998E-03 -0.1469000    
 C  -0.1035000      0.6901000      0.6752000    
 C   -2.580300      0.1856000      0.4530000    
 C    1.265500      0.4786000      8.9299999E-02
 C    2.780200      -1.319200     -0.3013000    
 H   -1.162200      0.3853000      -1.172500    
 H  -0.9520000      -1.075700     -0.2143000    
 H  -0.2958000       1.768600      0.7195000    
 H  -0.1076000      0.3210000       1.707400    
 H   -2.833400       1.249300      0.5048000    
 H   -2.620700     -0.2224000       1.467900    
 H   -4.889300     -0.3165000      0.1963000    
 H    2.441200      -1.292300      -1.341900    
 H    2.834900      -2.364600      1.4900000E-02
 H    3.773200     -0.8722000     -0.2022000    
 H    2.737200      0.9573000      -1.037400    


%chk=000123925-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123925

0 1
S -3.947379 -0.722419 -0.458852
O 1.586586 -0.921247 0.192646
N 1.942964 1.372145 -0.579688
C -1.250024 -0.045982 -0.135109
C -0.117480 0.712032 0.610808
C -2.617417 0.237976 0.507218
C 1.245409 0.446260 0.009588
C 2.876377 -1.367772 -0.352573
H -1.265095 0.268451 -1.195857
H -1.039857 -1.130543 -0.110875
H -0.285852 1.800678 0.570298
H -0.105619 0.397368 1.672292
H -2.861201 1.312925 0.461535
H -2.636469 -0.099787 1.557556
H -5.030628 -0.297053 0.294693
H 2.920147 -1.225102 -1.449688
H 2.928426 -2.439668 -0.115179
H 3.720930 -0.836453 0.127555
H 2.861681 1.075993 -0.963766


