%chk=000153568.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153568

0 1
 S   2.8400000E-02  -1.257300       1.230200    
 O   -3.510400      -1.524400      -1.316600    
 O   -1.773900      -2.399200     -0.2976000    
 N    1.505100      0.1029000     -0.5307000    
 N  -0.7337000       1.284700       1.273800    
 N    2.691500      -1.057200       1.216800    
 N   -2.499500      -1.417000     -0.5825000    
 C   -2.164600     -0.1393000     -5.6299999E-02
 C   -1.068800      7.8599997E-02  0.7632000    
 C    2.694500      0.5261000      -1.006300    
 C   -2.968200      0.9506000     -0.3720000    
 C    1.578900     -0.6726000      0.5659000    
 C    3.907900      0.2044000     -0.4330000    
 C   -2.655800       2.207400      0.1343000    
 C    2.662000       1.390200      -2.222100    
 C   -1.538000       2.320400      0.9453000    
 C    3.844700     -0.5983000      0.6875000    
 H   -3.845200      0.8632000      -1.008000    
 H    4.853200      0.5534000     -0.8284000    
 H   -3.267400       3.071500     -9.8399997E-02
 H    1.633100       1.558900      -2.556800    
 H    3.111200       2.365300      -2.008500    
 H    3.210100      0.9151000      -3.041800    
 H   -1.250900       3.278800       1.365100    
 H    4.746800     -0.9038000       1.206700    


%chk=000153568-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000153568

0 1
S -0.073443 -1.541505 -0.497520
O -4.577797 -1.610197 -0.176164
O -2.557166 -2.572468 -0.643858
N 2.020098 -0.007550 -1.411226
N -0.585796 1.015579 0.290759
N 2.098311 -0.645794 0.937046
N -3.288601 -1.567211 -0.273979
C -2.599524 -0.311633 0.049395
C -1.177226 -0.176372 -0.015856
C 3.220425 0.649940 -1.290692
C -3.394924 0.792109 0.437643
C 1.529956 -0.596629 -0.292840
C 3.889319 0.684100 -0.037266
C -2.768278 2.008794 0.752110
C 3.778344 1.312595 -2.526657
C -1.355018 2.068134 0.661163
C 3.293039 0.014346 1.050408
H -4.479211 0.658221 0.479920
H 4.843592 1.206457 0.077948
H -3.345546 2.885483 1.056632
H 3.101065 1.142303 -3.376883
H 3.892626 2.401902 -2.374366
H 4.777280 0.910560 -2.777385
H -0.814663 2.992768 0.892746
H 3.764137 -0.011533 2.038721


