%chk=000173669.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173669

0 1
 S   -3.051500      0.3724000      0.6799000    
 F   -1.536600      -1.769300      0.8193000    
 F   -2.426200      -1.410500      -1.146200    
 F   -3.654500      -2.159900      0.4876000    
 N    2.063100      -1.066000      1.5400000E-02
 C    2.864300      0.1301000      0.1432000    
 C    2.128400       1.209000      0.9532000    
 C   0.7935000       1.586500      0.3562000    
 C    4.201400     -0.2135000      0.7924000    
 C    2.727300      -2.064800     -0.8182000    
 C  -0.3438000      0.8970000      0.7445000    
 C   0.7314000       2.615900     -0.5693000    
 C   -1.576400       1.246200      0.1928000    
 C    1.878100      -3.309200     -0.9762000    
 C  -0.5010000       2.965000      -1.121200    
 C   -1.655000       2.280200     -0.7401000    
 C   -2.642400      -1.309100      0.1867000    
 H    3.060100      0.5459000     -0.8546000    
 H    2.754200       2.108600       1.029300    
 H    1.979600      0.8737000       1.989200    
 H    1.864900      -1.462300      0.9337000    
 H    4.732600      0.7035000       1.074300    
 H    4.872700     -0.7515000      0.1159000    
 H    4.074400     -0.8047000       1.706700    
 H    2.931200      -1.652300      -1.813200    
 H    3.676400      -2.395700     -0.3861000    
 H  -0.2699000      0.1117000       1.491800    
 H    1.624900       3.153300     -0.8738000    
 H    1.684600      -3.783500     -8.0000004E-03
 H   0.9137000      -3.072800      -1.438600    
 H    2.386900      -4.039500      -1.613700    
 H  -0.5620000       3.769700      -1.848200    
 H   -2.606500       2.566400      -1.181400    


%chk=000173669-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173669

0 1
S -2.828227 -0.214071 0.364928
F -1.261538 -1.870429 -1.194877
F -2.589512 -0.477749 -2.372395
F -3.504156 -2.230898 -1.250587
N 2.303584 -1.210971 0.546051
C 2.911515 0.055777 0.059100
C 2.322540 1.266363 0.849228
C 0.895973 1.629812 0.462160
C 4.462761 0.062882 0.136584
C 2.318934 -2.354861 -0.397398
C -0.154748 0.679658 0.576256
C 0.585439 2.922056 -0.035475
C -1.458572 1.026245 0.171070
C 1.648265 -3.587825 0.232791
C -0.732145 3.263724 -0.418895
C -1.771658 2.311798 -0.322662
C -2.524163 -1.222746 -1.173194
H 2.611194 0.159870 -1.002283
H 2.976451 2.144674 0.689075
H 2.381546 1.021464 1.929720
H 2.688413 -1.475809 1.466381
H 4.890695 0.953402 -0.360699
H 4.885462 -0.833646 -0.352753
H 4.798913 0.069418 1.192063
H 1.752879 -2.052063 -1.299162
H 3.348530 -2.628596 -0.736973
H 0.086681 -0.323364 0.941080
H 1.383855 3.669134 -0.124256
H 2.187819 -3.917944 1.141656
H 0.605769 -3.356109 0.511879
H 1.639430 -4.432904 -0.478662
H -0.950577 4.267526 -0.798912
H -2.793452 2.556682 -0.627539


