%chk=000033535.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033535

0 1
 S   -2.483900      0.1994000     -0.1213000    
 O    2.684600      0.2809000      0.4456000    
 N   0.6836000     -0.1545000      4.2399999E-02
 N    1.934100     -0.3356000     -0.3172000    
 C  -0.1683000      -1.305600     -0.2898000    
 C   0.1106000       1.123600     -0.4084000    
 C   -1.534500      -1.255500      0.3920000    
 C   -1.226200       1.447300      0.2569000    
 H   0.3177000      -2.231900      4.8700001E-02
 H  -0.2912000      -1.401900      -1.378300    
 H   1.9000000E-03   1.137200      -1.502500    
 H   0.7916000       1.949300     -0.1582000    
 H   -2.110500      -2.149300      0.1313000    
 H   -1.426000      -1.243900       1.482200    
 H   -1.112500       1.519800       1.344200    
 H   -1.589900       2.417100     -9.7900003E-02


%chk=000033535-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033535

0 1
S -2.536822 0.226750 -0.048424
O 2.590831 0.612505 0.565939
N 0.629354 -0.197750 -0.210701
N 1.877980 -0.437796 0.356119
C -0.217725 -1.384432 -0.414536
C 0.119589 1.151593 -0.535559
C -1.517934 -1.304897 0.409013
C -1.150947 1.483766 0.269089
H 0.385495 -2.258566 -0.109782
H -0.467470 -1.478634 -1.488822
H -0.094285 1.202234 -1.619711
H 0.936218 1.858402 -0.294128
H -2.167894 -2.168014 0.190985
H -1.302710 -1.273965 1.490554
H -0.941021 1.507052 1.351481
H -1.561557 2.458152 -0.041817


