%chk=000099773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099773

0 1
 S    3.441900      5.6899998E-02  -1.140600    
 S    2.468700       2.517900      0.2678000    
 O   0.5376000      -2.174500      1.1700000E-02
 N    1.270900      3.7400000E-02  0.2454000    
 C   0.1676000      0.4837000       1.093700    
 C   -1.167100      0.3378000      0.3902000    
 C   0.1951000     -0.2776000       2.421100    
 C    1.341400      -1.274400     -0.2168000    
 C    2.558000      -1.506100      -1.067700    
 C    2.285500      0.9037000     -0.1287000    
 C   -1.617400       1.364700     -0.4193000    
 C   -1.902700     -0.8186000      0.5750000    
 C   -2.845800       1.230500      -1.066300    
 C   -3.131000     -0.9529000     -7.2400004E-02
 C   -3.602600      7.1599998E-02 -0.8930000    
 H   0.2643000       1.538600       1.365400    
 H  -0.6496000      4.6999999E-03   3.060300    
 H    1.110900     -2.1500001E-02   2.968600    
 H   0.2018000      -1.367200       2.328500    
 H    3.184400      -2.275400     -0.6093000    
 H    2.250400      -1.815200      -2.069800    
 H   -1.035900       2.270400     -0.5621000    
 H   -1.590700      -1.638600       1.210300    
 H   -3.213000       2.028200      -1.705500    
 H   -3.722200      -1.853800      6.4400002E-02
 H   -4.559200     -3.2600001E-02  -1.396500    


%chk=000099773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099773

0 1
S 3.457717 0.203208 -1.287883
S 2.247182 2.618531 0.173707
O 0.716571 -2.276059 0.177401
N 1.291441 0.016709 0.263124
C 0.142174 0.404022 1.173975
C -1.196416 0.269144 0.436179
C 0.252608 -0.331134 2.524009
C 1.456490 -1.323837 -0.167772
C 2.649017 -1.487896 -1.108481
C 2.213942 0.973165 -0.190787
C -1.592663 1.315565 -0.437876
C -2.055922 -0.843576 0.607066
C -2.820459 1.249274 -1.131567
C -3.288414 -0.907461 -0.080182
C -3.674456 0.136025 -0.952491
H 0.322118 1.480850 1.351755
H -0.549100 0.026451 3.193394
H 1.222854 -0.103675 2.999147
H 0.161350 -1.422899 2.417853
H 3.365984 -2.207848 -0.684836
H 2.302262 -1.845486 -2.090607
H -0.936211 2.184651 -0.569670
H -1.758163 -1.665197 1.264540
H -3.113759 2.065158 -1.801507
H -3.944167 -1.773815 0.061045
H -4.630684 0.083831 -1.485135


