%chk=000008196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008196

0 1
 S   -2.815000      -1.016800      0.5398000    
 O    1.644300      0.9356000      0.1340000    
 O   -1.092600       1.450800     -0.1373000    
 N   -4.994600      -2.549000     -0.4712000    
 C    3.343100     -0.7496000      0.2217000    
 C    2.902000      0.5622000     -0.4118000    
 C    4.699900      -1.203600     -0.3091000    
 C    1.176900       2.158100     -0.4202000    
 C  -0.1749000       2.489600      0.1821000    
 C    5.156400      -2.491400      0.3576000    
 C   -2.380600       1.709600      0.4036000    
 C   -3.355100      0.6249000     -2.7500000E-02
 C   -4.109800      -1.920600     -6.1700001E-02
 H    3.383000     -0.6290000       1.311700    
 H    2.584000      -1.519000      3.3300001E-02
 H    3.638800       1.346800     -0.2035000    
 H    2.810700      0.4420000      -1.497700    
 H    5.449700     -0.4239000     -0.1318000    
 H    4.642800      -1.358500      -1.392800    
 H    1.889300       2.961600     -0.2037000    
 H    1.078600       2.042300      -1.505900    
 H  -0.5364000       3.443300     -0.2179000    
 H  -8.7099999E-02   2.562200       1.272400    
 H    5.256700      -2.359000       1.439600    
 H    4.443300      -3.301600      0.1748000    
 H    6.129200      -2.799100     -3.8500000E-02
 H   -2.743000       2.677100      3.5999998E-02
 H   -2.320600       1.760400       1.497800    
 H   -4.351000      0.8422000      0.3725000    
 H   -3.415800      0.6008000      -1.121100    


%chk=000008196-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008196

0 1
S -2.554814 -0.999373 -0.230598
O 1.708438 1.037238 0.246708
O -1.210124 1.694874 -0.317090
N -4.953653 -2.698925 -0.059499
C 3.412960 -0.691402 0.314086
C 2.901692 0.534634 -0.447791
C 4.668170 -1.308444 -0.344706
C 1.151741 2.229453 -0.392541
C -0.174342 2.550922 0.280702
C 5.195670 -2.538830 0.424710
C -2.475049 1.729018 0.412665
C -3.401728 0.733990 -0.269782
C -3.995417 -1.979477 -0.129191
H 3.639514 -0.396501 1.357041
H 2.601910 -1.443178 0.362309
H 3.684410 1.328261 -0.483723
H 2.639850 0.264913 -1.496435
H 5.467931 -0.541994 -0.407345
H 4.431484 -1.599450 -1.388543
H 1.853038 3.087306 -0.278851
H 0.981032 2.058558 -1.477950
H -0.442607 3.618701 0.124185
H -0.087747 2.355386 1.370339
H 5.469876 -2.269436 1.462049
H 4.426973 -3.332479 0.477184
H 6.091171 -2.966641 -0.062125
H -2.935168 2.743382 0.367369
H -2.319055 1.460254 1.479657
H -4.361449 0.642320 0.260905
H -3.562508 0.985318 -1.328539


