%chk=000076502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076502

0 1
 S    1.907000      0.4434000     -0.3046000    
 O    2.363200     -0.2073000      -1.526100    
 O    2.206900       1.853200     -9.2900001E-02
 O   -3.933200     -0.2394000      0.1420000    
 N    2.485400     -0.4448000       1.036100    
 C   0.1777000      0.2409000     -0.1723000    
 C  -0.5766000       1.153000      0.5657000    
 C  -0.4493000     -0.8327000     -0.8045000    
 C   -1.958100      0.9914000      0.6717000    
 C   -1.830800     -0.9943000     -0.6987000    
 C   -2.585100     -8.2199998E-02  3.9400000E-02
 C    2.192700      -1.881200       1.144200    
 H  -0.1090000       1.992300       1.072500    
 H   0.1187000      -1.557100      -1.381300    
 H    2.632300      5.0900001E-02   1.924000    
 H   -2.540400       1.704100       1.249400    
 H   -2.307300      -1.835300      -1.195300    
 H    2.972300      -2.354400       1.748100    
 H    2.186700      -2.364300      0.1642000    
 H    1.232000      -2.031900       1.642600    
 H   -4.196700      -1.032200     -0.3561000    


%chk=000076502-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076502

0 1
S 1.925997 0.385897 -0.277800
O 2.387322 -0.475050 -1.576476
O 2.277485 1.952886 -0.034102
O -4.106808 -0.093229 0.129743
N 2.692129 -0.475930 1.150181
C 0.045899 0.209454 -0.158584
C -0.672858 1.174823 0.572965
C -0.569599 -0.860030 -0.829921
C -2.071949 1.047943 0.654475
C -1.972427 -0.984358 -0.744436
C -2.715513 -0.033870 0.001990
C 2.520919 -1.938979 1.194224
H -0.151717 2.019546 1.035401
H 0.029724 -1.555441 -1.426337
H 2.479179 0.058441 2.006358
H -2.679877 1.773221 1.201934
H -2.480538 -1.806811 -1.262959
H 3.248901 -2.337140 1.923052
H 2.785347 -2.345846 0.203723
H 1.502873 -2.285374 1.475353
H -4.486088 -0.858053 -0.370684


