%chk=000004109.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004109

0 1
 S    3.319700     -9.2900001E-02  0.2665000    
 O  -0.5105000      0.5986000     -2.4400000E-02
 O   -1.532500      -1.449800      0.2289000    
 N   -2.749300      0.4929000     -0.1194000    
 N   0.6577000     -0.1557000      0.1448000    
 C    1.709700      0.5982000      8.5299999E-02
 C    1.685000       2.089300     -0.1369000    
 C   -4.073100     -8.5500002E-02 -9.7900003E-02
 C   -1.590800     -0.2377000      4.5800000E-02
 C    3.084100      -1.757400     -0.3927000    
 H    1.201700       2.305000      -1.094600    
 H    2.687600       2.525300     -0.1508000    
 H    1.112700       2.565900      0.6649000    
 H   -2.667300       1.494800     -0.2629000    
 H   -4.033000      -1.166500      5.4299999E-02
 H   -4.558100      0.1375000      -1.051300    
 H   -4.636600      0.3829000      0.7126000    
 H    4.045600      -2.277300     -0.4127000    
 H    2.691200      -1.712500      -1.412100    
 H    2.395900      -2.327200      0.2374000    


%chk=000004109-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004109

0 1
S 3.452617 -0.015409 -0.199396
O -0.505845 0.585233 -0.114821
O -1.603220 -1.551265 -0.161945
N -2.761061 0.495690 -0.071813
N 0.773791 -0.172651 -0.156178
C 1.770869 0.683711 -0.148503
C 1.702877 2.190699 -0.106203
C -4.113635 -0.066973 -0.065625
C -1.641088 -0.307473 -0.120114
C 3.082414 -1.862075 -0.254606
H 1.149441 2.568504 -0.984483
H 2.708933 2.639429 -0.095497
H 1.151809 2.519022 0.793176
H -2.621342 1.505515 -0.039850
H -4.023825 -1.163780 -0.112108
H -4.696572 0.277461 -0.939838
H -4.658470 0.203818 0.857807
H 4.063921 -2.358459 -0.292898
H 2.484656 -2.090366 -1.147987
H 2.523430 -2.152731 0.645683