%chk=000014477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014477

0 1
 N   0.4442000      0.8237000     -0.6529000    
 C    1.406200     -8.4200002E-02 -5.7200000E-02
 C  -0.9035000      0.5655000     -0.1168000    
 C    2.520400     -0.3518000      -1.074700    
 C    1.987700      0.5754000       1.197700    
 C   0.7053000      -1.396500      0.3138000    
 C  -0.8643000      0.8759000       1.389400    
 C   -1.893100       1.525200     -0.7986000    
 C   -1.299000     -0.8615000     -0.4499000    
 C   -2.103900      -1.671600      0.2492000    
 H   0.4246000      0.7210000      -1.667700    
 H    3.029400      0.5761000      -1.361400    
 H    3.278900      -1.029600     -0.6664000    
 H    2.129200     -0.8136000      -1.989200    
 H    1.446500      0.3978000       2.127100    
 H    2.118000       1.657000       1.068400    
 H    2.992900      0.1773000       1.391700    
 H   0.5051000      -2.084000     -0.5222000    
 H    1.554700      -1.987200      0.7200000    
 H   0.1116000      -1.485600       1.225400    
 H  -0.5246000      0.1004000       2.073000    
 H  -0.3350000       1.813500       1.601500    
 H   -1.892500       1.068600       1.731300    
 H   -1.914100       1.379900      -1.885900    
 H   -1.624300       2.571800     -0.6115000    
 H   -2.914800       1.375900     -0.4293000    
 H   -1.094800      -1.183400      -1.476500    
 H   -2.404200      -2.630900     -0.1589000    
 H   -2.483200      -1.399500       1.227300    


%chk=000014477-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014477

0 1
N 0.374355 0.560705 -0.576441
C 1.539483 -0.195174 -0.005521
C -1.045161 0.513224 -0.093028
C 2.620493 -0.171766 -1.121004
C 2.117229 0.547730 1.232732
C 1.242318 -1.676758 0.368368
C -1.154215 0.869409 1.405184
C -1.784254 1.612312 -0.916313
C -1.731492 -0.824022 -0.428368
C -2.494017 -1.600182 0.382035
H 0.385616 0.509943 -1.604267
H 2.848011 0.869122 -1.415844
H 3.552710 -0.645910 -0.767267
H 2.278351 -0.725191 -2.017704
H 1.433610 0.506380 2.096391
H 2.294387 1.608353 0.982434
H 3.075790 0.088546 1.540895
H 0.878128 -2.242391 -0.508535
H 2.163765 -2.165670 0.738661
H 0.475613 -1.751201 1.157811
H -0.736667 0.080260 2.054021
H -0.614717 1.810716 1.603631
H -2.214404 1.008013 1.683262
H -1.728935 1.401075 -2.002186
H -1.309665 2.592326 -0.731810
H -2.851014 1.659613 -0.635478
H -1.577920 -1.144248 -1.473788
H -2.946584 -2.530886 0.020067
H -2.687414 -1.338728 1.428760


