%chk=000129054.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129054

0 1
 S   0.3214000       1.149400      -1.680500    
 O    1.633300      -2.717600     -0.7318000    
 N  -0.3665000      -1.686600     -0.3375000    
 N   -4.722100     -0.3163000       1.192500    
 C   -1.285400     -0.6225000     -0.2072000    
 C   -1.085900      0.6771000     -0.6942000    
 C    1.809700     -0.5155000     -2.5400000E-02
 C    1.603400      0.7746000     -0.5179000    
 C    1.013900      -1.693600     -0.4355000    
 C   -2.515600     -0.9440000      0.3916000    
 C   -2.091200       1.642800     -0.5167000    
 C   -3.504900      2.3000000E-02  0.5672000    
 C    2.859400     -0.7572000      0.8756000    
 C    2.447900       1.813300     -9.8399997E-02
 C   -3.288400       1.320400      0.1212000    
 C    3.688400      0.2834000       1.292200    
 C    3.482600       1.569300      0.8048000    
 H  -0.7832000      -2.614300     -0.2931000    
 H   -2.695400      -1.958400      0.7455000    
 H   -1.962200       2.656400     -0.8916000    
 H    3.039600      -1.755600       1.267700    
 H    2.310400       2.827000     -0.4690000    
 H   -4.049500       2.086500      0.2444000    
 H    4.494700      8.9100003E-02   1.993100    
 H    4.128000       2.382200       1.124100    
 H   -4.877100      -1.260100       1.521000    
 H   -5.437200      0.3869000       1.323600    


%chk=000129054-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129054

0 1
S 0.332371 1.174965 -1.721177
O 1.556674 -2.860251 -0.400154
N -0.385639 -1.647997 -0.504169
N -4.766168 -0.360774 1.207890
C -1.339432 -0.610488 -0.277619
C -1.145226 0.718936 -0.731071
C 1.811648 -0.505848 0.055132
C 1.642051 0.801011 -0.473881
C 1.000804 -1.718856 -0.315537
C -2.546197 -0.961631 0.374990
C -2.155224 1.679376 -0.501858
C -3.576859 -0.003212 0.574613
C 2.894613 -0.742529 0.945297
C 2.531529 1.839914 -0.117782
C -3.363086 1.334888 0.129830
C 3.776055 0.293514 1.310793
C 3.597704 1.589861 0.773748
H -0.777607 -2.581488 -0.673377
H -2.672747 -1.985583 0.748370
H -1.993158 2.706593 -0.844371
H 3.036549 -1.762207 1.316729
H 2.381338 2.838425 -0.540154
H -4.139233 2.093692 0.280773
H 4.601916 0.090647 2.000673
H 4.282307 2.401022 1.044748
H -4.922619 -1.310276 1.532279
H -5.494262 0.327996 1.370985


