%chk=000080723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080723

0 1
 N  -0.1732000     -0.5885000      0.5455000    
 N   0.4285000     -0.5279000     -0.5504000    
 N    5.875700      0.4475000      0.3264000    
 N    2.234300      -2.695400     -0.2413000    
 C   -2.449000      0.2382000      0.1678000    
 C   -3.816600     -5.1300000E-02 -5.3300001E-02
 C   -1.539700     -0.8204000      0.3252000    
 C    3.609200       1.271100     -4.6999998E-02
 C    1.796800     -0.2955000     -0.3294000    
 C    4.501000      0.2097000      0.1066000    
 C    2.684400      -1.357700     -0.1763000    
 C    2.255100       1.018100     -0.2653000    
 C    4.038600      -1.104700      4.1900001E-02
 C   -2.031100       1.577700      0.2249000    
 C   -4.234500      -1.390800     -0.1104000    
 C   -4.726000       1.007400     -0.2107000    
 C   -1.972500      -2.145300      0.2656000    
 C   -3.317300      -2.430000      4.8200000E-02
 C    4.077800       2.688500      1.6700000E-02
 C   -2.948300       2.617000      6.6299997E-02
 C   -4.293200       2.332300     -0.1511000    
 H    1.554800       1.841000     -0.3882000    
 H    4.734300      -1.932800      0.1609000    
 H  -0.9913000       1.843500      0.3987000    
 H   -5.280900      -1.636700     -0.2793000    
 H   -5.781900      0.8082000     -0.3816000    
 H   -1.268200      -2.964300      0.3888000    
 H   -3.653700      -3.461700      2.0999999E-03
 H    4.810200       2.886900     -0.7728000    
 H    3.253100       3.396400     -0.1218000    
 H    4.526000       2.901600      0.9928000    
 H   -2.612500       3.648900      0.1141000    
 H   -5.006800       3.141900     -0.2742000    
 H    6.507100     -0.3351000      0.4378000    
 H    6.239400       1.388500      0.3809000    
 H    2.888200      -3.457800     -0.1238000    
 H    1.253400      -2.887900     -0.3951000    


%chk=000080723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080723

0 1
N -0.278198 -0.084211 -0.000757
N 0.656579 -1.017857 -0.020880
N 6.089134 0.464580 0.120831
N 2.579954 -2.923016 -0.096863
C -2.654474 0.443361 -0.057308
C -4.043773 0.030388 -0.077453
C -1.617297 -0.572274 -0.025040
C 3.742843 1.169996 0.126842
C 1.981371 -0.568566 0.017323
C 4.740965 0.121661 0.086081
C 2.989457 -1.606469 -0.022980
C 2.398805 0.794148 0.091386
C 4.357045 -1.239714 0.012729
C -2.349792 1.843590 -0.071155
C -4.364086 -1.366156 -0.063717
C -5.069343 1.034370 -0.110824
C -1.979816 -1.935885 -0.010001
C -3.345460 -2.326553 -0.029847
C 4.166402 2.625206 0.207255
C -3.370840 2.797353 -0.103605
C -4.743120 2.391519 -0.123795
H 1.609702 1.552769 0.121318
H 5.128089 -2.019870 -0.017642
H -1.296819 2.136661 -0.055214
H -5.417179 -1.671579 -0.078540
H -6.118349 0.714354 -0.125991
H -1.185049 -2.686965 0.020061
H -3.600335 -3.392553 -0.016962
H 4.778248 2.932195 -0.666027
H 3.283603 3.284793 0.231557
H 4.757894 2.839024 1.121390
H -3.123407 3.864964 -0.113341
H -5.534257 3.149364 -0.149119
H 6.808865 -0.252277 0.094217
H 6.379599 1.436002 0.173697
H 3.240773 -3.692627 -0.127851
H 1.573466 -3.089129 -0.120575


