%chk=000019028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019028

0 1
 N    1.716700      -1.057900     -8.6000003E-02
 N   -4.716100       1.228000      -1.700700    
 C   -1.214500      -1.033800     -0.1384000    
 C  -0.3671000     -0.3114000      -1.191100    
 C  -0.4121000      -2.190400      0.4673000    
 C   0.9925000      0.1016000     -0.6236000    
 C   0.9488000      -1.714800      0.9802000    
 C   -2.527100      -1.531100     -0.7375000    
 C    3.034300     -0.6555000      0.4056000    
 C   -3.541200     -0.4385000     -0.8721000    
 C    3.892100     -8.9800000E-02 -0.7268000    
 C   -4.492100     -6.6799998E-02  0.1022000    
 C   -3.690400      0.3614000      -1.967400    
 C   -5.224500      0.9894000     -0.4437000    
 C    5.261900      0.3083000     -0.2376000    
 C   -4.813100     -0.5160000       1.398600    
 C   -6.266200       1.621400      0.2448000    
 C   -5.852700      0.1066000       2.099100    
 C    5.470900       1.598100      0.2268000    
 C    6.290200     -0.6217000     -0.2605000    
 C   -6.566700       1.158800       1.529100    
 C    6.738000       1.966700      0.6790000    
 C    7.557300     -0.2534000      0.1917000    
 C    7.781100       1.040900      0.6614000    
 H   -1.430100     -0.3245000      0.6736000    
 H  -0.8802000      0.5879000      -1.548800    
 H  -0.2136000     -0.9604000      -2.063500    
 H  -0.2641000      -2.977300     -0.2841000    
 H  -0.9717000      -2.642100       1.295100    
 H    1.519500      0.5622000      -1.462900    
 H   0.8548000      0.8727000      0.1457000    
 H   0.8050000      -1.038400       1.833200    
 H    1.497200      -2.590500       1.348300    
 H   -2.952700      -2.317500     -0.1003000    
 H   -2.354800      -2.004000      -1.713300    
 H    2.943900      7.8500003E-02   1.218100    
 H    3.547400      -1.529800      0.8275000    
 H    3.456400      0.8039000      -1.184300    
 H    3.990400     -0.8256000      -1.536200    
 H   -3.169900      0.4012000      -2.914200    
 H   -5.052200       1.940000      -2.334300    
 H   -4.265800      -1.333700       1.858700    
 H   -6.822700       2.440700     -0.1981000    
 H   -6.104400     -0.2355000       3.099500    
 H    4.664700       2.326000      0.2472000    
 H    6.125300      -1.632500     -0.6228000    
 H   -7.370100       1.628100       2.091100    
 H    6.912200       2.974200       1.045400    
 H    8.369500     -0.9743000      0.1786000    
 H    8.767700       1.327500       1.013800    


%chk=000019028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019028

0 1
N 1.660205 -0.901752 -0.123164
N -5.075156 0.860739 -1.932079
C -1.289380 -1.219666 -0.141878
C -0.557360 -0.187088 -1.029535
C -0.324610 -2.387594 0.171135
C 0.772381 0.259423 -0.390831
C 0.996011 -1.876584 0.780579
C -2.605149 -1.735200 -0.797223
C 2.997568 -0.500775 0.373749
C -3.665222 -0.676740 -0.980335
C 3.906688 0.082857 -0.743109
C -4.456888 -0.050389 0.069175
C -4.075387 -0.095359 -2.179878
C -5.330990 0.909410 -0.557161
C 5.299366 0.400041 -0.220808
C -4.520650 -0.214652 1.479381
C -6.245364 1.695860 0.178230
C -5.431345 0.564798 2.218869
C 5.589675 1.662123 0.359972
C 6.329070 -0.576108 -0.258873
C -6.283299 1.511696 1.575480
C 6.870736 1.943266 0.886575
C 7.611959 -0.300943 0.266078
C 7.887502 0.961091 0.842274
H -1.551780 -0.720607 0.816472
H -1.202275 0.695499 -1.199896
H -0.342745 -0.644682 -2.016576
H -0.097531 -2.935789 -0.765037
H -0.799061 -3.103299 0.872193
H 1.292649 0.958829 -1.069793
H 0.555682 0.819434 0.558958
H 0.779969 -1.419255 1.783920
H 1.689218 -2.722371 0.947711
H -3.005754 -2.557194 -0.167771
H -2.352111 -2.187463 -1.777286
H 2.928546 0.238723 1.213330
H 3.493528 -1.401093 0.784477
H 3.444353 0.998770 -1.156685
H 3.949094 -0.660377 -1.560280
H -3.729866 -0.294753 -3.193073
H -5.545959 1.418318 -2.640570
H -3.874580 -0.941087 1.985517
H -6.904375 2.422285 -0.310951
H -5.491519 0.446509 3.306608
H 4.807176 2.431111 0.391207
H 6.123220 -1.555142 -0.710140
H -6.980488 2.104432 2.178358
H 7.077367 2.925663 1.326855
H 8.395996 -1.065807 0.222170
H 8.882586 1.177792 1.247055


