%chk=000080209.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080209

0 1
 N   0.3125000     -0.1411000      0.5531000    
 C  -0.6450000      0.7800000     -7.4600004E-02
 C   -1.186900      0.1468000      -1.356700    
 C   -1.757100       1.100800      0.9246000    
 C   -2.113200      -1.038100      -1.084600    
 C   -2.680800     -8.9199997E-02   1.183400    
 C   -3.231800     -0.6683000     -0.1157000    
 C    1.557700     -8.9000002E-02  0.2205000    
 C    2.658500     -0.9728000      0.7811000    
 C    1.957000      0.9423000     -0.8209000    
 C    2.816200      -2.230200     -5.5100001E-02
 C    2.312900       2.258800     -0.1550000    
 H  -0.2198000       1.755000     -0.3168000    
 H  -0.3849000     -0.1965000      -2.018200    
 H   -1.749400      0.9069000      -1.914200    
 H   -2.360200       1.930700      0.5337000    
 H   -1.327900       1.440600       1.874900    
 H   -1.533700      -1.873600     -0.6732000    
 H   -2.546900      -1.388300      -2.028300    
 H   -3.510600      0.2243000       1.827000    
 H   -2.134800     -0.8688000       1.728500    
 H   -3.897300      6.4400002E-02 -0.5887000    
 H   -3.837500      -1.554800      0.1036000    
 H    2.391500      -1.242200       1.808700    
 H    3.597800     -0.4121000      0.8143000    
 H    2.855600      0.5649000      -1.326100    
 H    1.240600       1.086600      -1.627600    
 H    3.093300      -1.985600      -1.085700    
 H    1.880000      -2.797500     -8.9599997E-02
 H    3.593800      -2.874300      0.3662000    
 H    2.553800       3.012300     -0.9114000    
 H    1.513400       2.652100      0.4786000    
 H    3.193800       2.138500      0.4855000    


%chk=000080209-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080209

0 1
N 0.250461 -0.057415 0.443298
C -0.765689 0.829536 -0.184939
C -1.385031 0.121382 -1.426741
C -1.869200 1.130654 0.864086
C -2.190121 -1.142883 -1.043913
C -2.667461 -0.136801 1.248217
C -3.284553 -0.811637 -0.000554
C 1.518334 0.026897 0.138548
C 2.468324 -0.962815 0.808180
C 2.168182 1.022964 -0.832607
C 2.817551 -2.154394 -0.123733
C 2.685783 2.289863 -0.096372
H -0.329395 1.796866 -0.522645
H -0.582070 -0.135214 -2.145849
H -2.057703 0.845800 -1.931381
H -2.557478 1.889024 0.435172
H -1.404175 1.577915 1.763418
H -1.500030 -1.895607 -0.616495
H -2.643679 -1.586315 -1.952055
H -3.459521 0.123292 1.977359
H -1.977825 -0.847272 1.742137
H -4.033648 -0.129747 -0.457047
H -3.825020 -1.733548 0.290414
H 1.982094 -1.342187 1.723539
H 3.402946 -0.444597 1.103346
H 3.020228 0.525778 -1.334719
H 1.461887 1.324483 -1.627082
H 3.303184 -1.815894 -1.057999
H 1.901553 -2.708734 -0.395014
H 3.508558 -2.854335 0.380210
H 3.190256 2.974263 -0.802528
H 1.853846 2.839042 0.379974
H 3.410013 2.024237 0.695074


