%chk=000078589.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078589

0 1
 S   -3.196000     -0.5610000      0.9856000    
 O  -0.9093000       2.055700     -0.1317000    
 O    3.172300     -4.5800000E-02  0.3362000    
 N    1.137000       1.017300      0.1063000    
 N    1.294600      -1.307400     -8.3700001E-02
 C  -0.8495000     -0.3116000     -0.3389000    
 C  -0.2343000       1.029500     -0.1155000    
 C  -5.2000001E-02  -1.386600     -0.3090000    
 C   -2.322100     -0.3789000     -0.5840000    
 C    1.959300     -0.1111000      0.1347000    
 H  -0.4304000      -2.390600     -0.4632000    
 H   -2.568000      -1.241300      -1.213500    
 H   -2.688100      0.5081000      -1.110700    
 H    1.585700       1.915600      0.2618000    
 H    1.825800      -2.173100     -7.8100003E-02
 H   -2.843200      0.6254000       1.502500    


%chk=000078589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078589

0 1
S -3.326957 -0.276417 1.077511
O -0.959067 2.023734 0.112763
O 3.257652 -0.015962 0.307821
N 1.126053 0.976866 0.192534
N 1.375450 -1.322479 -0.195845
C -0.845898 -0.364175 -0.333311
C -0.283967 0.958713 -0.002756
C 0.006166 -1.442017 -0.413516
C -2.326903 -0.458212 -0.546377
C 2.017515 -0.105663 0.118668
H -0.354089 -2.447575 -0.647545
H -2.626172 -1.438891 -0.947329
H -2.683775 0.336714 -1.218707
H 1.543551 1.884542 0.422870
H 1.993340 -2.133556 -0.258850
H -3.031098 1.068578 1.230869