%chk=000097335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097335

0 1
 S    3.918600      1.1100000E-02  0.6618000    
 O  -0.7678000      4.4100001E-02  1.7000001E-02
 O   -3.017800      -1.291200      0.6869000    
 N    1.898500     -0.8017000     -0.7315000    
 N   -2.039600      0.5802000     -0.2551000    
 N   -4.319900      0.3959000     -0.1636000    
 C   0.2142000      0.9609000     -0.4460000    
 C    1.577800      0.4027000     -0.1626000    
 C    2.521200       1.004300      0.6197000    
 C    3.121800      -1.111400     -0.3629000    
 C   -3.107100     -0.1949000      0.1361000    
 H   8.5500002E-02   1.927400      5.7000000E-02
 H   0.1070000       1.107200      -1.527900    
 H    2.474800       1.942000       1.155000    
 H    3.605900      -2.023200     -0.6848000    
 H   -2.104700       1.483600     -0.7106000    
 H   -5.197700     -5.8800001E-02  6.4300001E-02
 H   -4.370800       1.301000     -0.6187000    


%chk=000097335-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097335

0 1
S 3.688370 -0.441683 1.084172
O -0.763360 -0.343387 -0.407977
O -2.432465 1.056758 1.341745
N 2.406724 0.016154 -1.209265
N -2.109895 0.054741 -0.764211
N -4.276265 0.575478 -0.015221
C 0.143289 0.860892 -0.497689
C 1.519105 0.370112 -0.171444
C 2.020142 0.197856 1.111898
C 3.561563 -0.414324 -0.744970
C -2.912087 0.573858 0.277074
H -0.220877 1.601934 0.233169
H 0.103523 1.263712 -1.524358
H 1.513607 0.389412 2.055476
H 4.406362 -0.738200 -1.351478
H -2.487487 -0.593803 -1.461634
H -4.887242 1.021386 0.664584
H -4.673108 0.228303 -0.885771


