%chk=000166145.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166145

0 1
 N  -0.5086000     -0.1945000      3.0500000E-02
 N   -3.338400     -0.7515000      0.2325000    
 C   -1.444400      0.7992000      0.5705000    
 C   -1.001400      -1.553600      0.2856000    
 C   0.8264000     -1.1700000E-02  0.5963000    
 C   -2.844900      0.6076000     -2.1800000E-02
 C   -2.402200      -1.746100     -0.3055000    
 C    1.402500       1.363200      0.2914000    
 C    1.782000      -1.127000      0.1988000    
 C   -4.672700     -0.9339000     -0.3353000    
 C    2.280200       1.933700       1.190800    
 C    1.873400      -2.245600       1.002000    
 C    1.029600       1.999300     -0.8752000    
 C    2.529200     -0.9868000     -0.9531000    
 C   -5.659300      2.6200000E-02  0.2548000    
 C    2.807900       3.194400      0.9115000    
 C    2.749800      -3.268000      0.6377000    
 C    1.557400       3.259900      -1.154700    
 C    3.405400      -2.009200      -1.317400    
 C    2.446500       3.857400     -0.2613000    
 C    3.515700      -3.149700     -0.5219000    
 C   -6.334100      0.9366000     -0.4564000    
 H   -1.158400       1.832500      0.3570000    
 H   -1.505500      0.7145000       1.665000    
 H   -1.029300      -1.776600       1.360600    
 H  -0.3893000      -2.310000     -0.2151000    
 H   0.7303000     -5.5599999E-02   1.693800    
 H   -3.488700       1.358200      0.4504000    
 H   -2.821700      0.8236000      -1.098800    
 H   -2.352100      -1.683400      -1.401400    
 H   -2.748400      -2.755600     -5.2000001E-02
 H   -5.030700      -1.946400     -0.1099000    
 H   -4.649200     -0.8436000      -1.429700    
 H    2.568700       1.424600       2.105500    
 H    1.294700      -2.346000       1.915100    
 H   0.3632000       1.552600      -1.606800    
 H    2.458500     -0.1310000      -1.613400    
 H   -5.839000     -3.2699998E-02   1.325700    
 H    3.500900       3.659300       1.606600    
 H    2.837800      -4.154800       1.258600    
 H    1.281400       3.773600      -2.070900    
 H    3.998100      -1.920100      -2.223200    
 H    2.858800       4.838200     -0.4797000    
 H    4.197500      -3.945900     -0.8060000    
 H   -7.039100       1.601400      3.0500000E-02
 H   -6.196000       1.036200      -1.527200    


%chk=000166145-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166145

0 1
N -0.536074 -0.196799 0.094897
N -3.412904 -0.665614 0.038600
C -1.504355 0.808512 0.618156
C -1.109868 -1.558903 0.274727
C 0.812485 -0.050198 0.723433
C -2.848231 0.696454 -0.116045
C -2.452286 -1.676295 -0.463226
C 1.424558 1.329663 0.424496
C 1.778515 -1.150188 0.251919
C -4.759677 -0.805673 -0.567464
C 2.242645 1.957841 1.394117
C 2.508781 -1.907944 1.198130
C 1.240443 1.964400 -0.829811
C 1.984621 -1.398590 -1.129204
C -5.805075 -0.001547 0.178491
C 2.874166 3.191723 1.118454
C 3.433393 -2.892640 0.778465
C 1.865451 3.199463 -1.107015
C 2.900578 -2.384971 -1.551832
C 2.688699 3.817093 -0.135890
C 3.632571 -3.134404 -0.599369
C -6.718339 0.816102 -0.401702
H -1.090928 1.820635 0.472768
H -1.678085 0.659809 1.713484
H -1.273569 -1.785835 1.358292
H -0.405779 -2.305583 -0.128257
H 0.730378 -0.143546 1.838747
H -3.561998 1.428175 0.303279
H -2.692629 0.951260 -1.196388
H -2.265255 -1.559676 -1.561782
H -2.874048 -2.684978 -0.292948
H -5.029796 -1.880688 -0.509414
H -4.772441 -0.525500 -1.652317
H 2.390829 1.476061 2.369048
H 2.351486 -1.729535 2.269354
H 0.588398 1.487442 -1.570162
H 1.414363 -0.821768 -1.865238
H -5.796280 -0.136503 1.270227
H 3.505411 3.664428 1.879548
H 3.991695 -3.470746 1.523640
H 1.711594 3.681351 -2.079573
H 3.048350 -2.568388 -2.622356
H 3.175592 4.774708 -0.352485
H 4.347232 -3.897390 -0.928099
H -7.473828 1.344980 0.190121
H -6.738287 0.976700 -1.487314


