%chk=000166087.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166087

0 1
 O   -1.333300       2.229400      8.1200004E-02
 O   -3.946900      -2.429700      9.9999997E-05
 N   0.9069000       1.116400      0.8254000    
 N    4.899000      -1.408100      -1.243900    
 N   -1.839300      -3.781500      0.7362000    
 C   -1.203700     -0.1120000      0.4247000    
 C   -1.886600      -1.329800      0.4030000    
 C   0.1500000     -7.6899998E-02  0.7801000    
 C   -3.327500       1.092100     -0.2976000    
 C   -4.010600     -0.1257000     -0.3190000    
 C   -1.899100       1.143500      7.4900001E-02
 C   -3.315200      -1.381100      3.0600000E-02
 C   -1.215800      -2.512700      0.7361000    
 C   0.8148000      -1.257900       1.111500    
 C    2.270300       1.385900      0.6116000    
 C   0.1333000      -2.473200       1.089400    
 C    4.365000      0.8646000     -0.4822000    
 C    5.153700      2.2000000E-02  -1.426400    
 C    3.012200      0.5974000     -0.2713000    
 C   -3.998400       2.275000     -0.6309000    
 C   -5.364500     -0.1608000     -0.6737000    
 C    2.889700       2.443300       1.282400    
 C    4.979900       1.921400      0.1893000    
 C   -5.347700       2.235600     -0.9836000    
 C   -6.029200       1.020300      -1.005100    
 C    4.242400       2.710700       1.071500    
 C    5.253600      -1.819500      0.1134000    
 C    5.647000      -2.188600      -2.227900    
 H   0.3692000       1.930200       1.108300    
 H    1.856000      -1.266200       1.422000    
 H   0.6671000      -3.382000       1.357000    
 H    4.871600      0.3220000      -2.444400    
 H    6.227100      0.2325000      -1.323200    
 H    2.529900     -0.2014000     -0.8293000    
 H   -3.491700       3.236300     -0.6226000    
 H   -5.920600      -1.094000     -0.6988000    
 H    2.326500       3.065500       1.973500    
 H    6.032600       2.142800      3.4699999E-02
 H   -5.867600       3.153500      -1.241900    
 H   -7.079600      0.9924000      -1.280100    
 H    4.721200       3.533400       1.594400    
 H   -1.306900      -4.604700      0.9860000    
 H   -2.814100      -3.879300      0.4909000    
 H    4.618300      -1.362000      0.8779000    
 H    6.300200      -1.596700      0.3533000    
 H    5.109800      -2.900800      0.2280000    
 H    6.730400      -2.055600      -2.127400    
 H    5.357500      -1.904600      -3.245900    
 H    5.420200      -3.255800      -2.125500    


%chk=000166087-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166087

0 1
O -1.398038 2.329756 0.117760
O -4.144470 -2.485499 -0.022974
N 0.835555 1.112130 0.358606
N 5.266077 -1.501104 -0.902019
N -1.957306 -3.794763 0.356418
C -1.285992 -0.093248 0.202317
C -2.014120 -1.346441 0.193023
C 0.149409 -0.092101 0.359070
C -3.473629 1.148863 -0.141084
C -4.183132 -0.086528 -0.172099
C -2.006241 1.176866 0.061661
C -3.468573 -1.374838 0.001930
C -1.306054 -2.585062 0.368949
C 0.817471 -1.349257 0.577004
C 2.229629 1.360582 0.303447
C 0.116054 -2.543509 0.584694
C 4.529026 0.846445 -0.417629
C 5.488440 -0.061273 -1.181991
C 3.153837 0.519474 -0.370678
C -4.181133 2.369229 -0.302068
C -5.588937 -0.085399 -0.365662
C 2.698194 2.569214 0.895507
C 4.985972 2.038593 0.192871
C -5.574462 2.360683 -0.495239
C -6.281551 1.128350 -0.527388
C 4.064339 2.901286 0.833366
C 5.634330 -1.871893 0.480216
C 5.911570 -2.374699 -1.902085
H 0.169271 1.930997 0.335957
H 1.891348 -1.358828 0.775868
H 0.649164 -3.483990 0.769061
H 5.335042 0.084503 -2.270260
H 6.542383 0.252319 -0.964802
H 2.827221 -0.385724 -0.890746
H -3.610040 3.301876 -0.271141
H -6.104792 -1.050171 -0.383653
H 1.986496 3.226436 1.407759
H 6.051619 2.294797 0.162187
H -6.115984 3.304633 -0.621063
H -7.366689 1.124823 -0.677735
H 4.415591 3.829097 1.298332
H -1.441100 -4.662369 0.486864
H -2.985049 -3.753730 0.212145
H 5.084955 -1.237093 1.196536
H 6.729101 -1.756659 0.686237
H 5.359879 -2.925519 0.667908
H 7.028909 -2.299961 -1.905335
H 5.548177 -2.117851 -2.913314
H 5.645332 -3.427842 -1.700030


