%chk=000128118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128118

0 1
 N   0.6066000     -0.8757000     -0.4057000    
 N  -0.6371000     -0.8280000      0.2413000    
 N   0.8297000      -2.194800     -0.6443000    
 N   -1.084900      -2.126200      0.5450000    
 N  -0.4231000      -5.429000      0.1203000    
 C    1.682100      3.0900000E-02 -0.1880000    
 C   -1.627800      0.1821000      0.1021000    
 C    2.929900     -0.1869000     -0.7895000    
 C    1.510100       1.156000      0.6312000    
 C   -2.817800      9.6299998E-02  0.8249000    
 C   -1.409800       1.259200     -0.7569000    
 C  -0.1704000      -2.863200     -2.2200000E-02
 C    3.800900       1.817200      0.2406000    
 C   -3.571800       2.164400     -0.1706000    
 C    3.983800      0.7016000     -0.5762000    
 C    2.564100       2.044500      0.8444000    
 C   -3.789800       1.087400      0.6883000    
 C   -2.381800       2.250400     -0.8934000    
 C    4.928000       2.766700      0.4694000    
 C   -4.611400       3.223500     -0.3173000    
 C  -0.3097000      -4.276400      5.6499999E-02
 H    1.586700      -2.566300      -1.201900    
 H    3.102700      -1.038700      -1.441700    
 H   0.5821000       1.354800       1.156400    
 H   -3.009300     -0.7254000       1.509800    
 H  -0.5132000       1.345900      -1.362600    
 H    4.942500      0.5146000      -1.052700    
 H    2.413200       2.904500       1.491500    
 H   -4.711200       1.011700       1.259800    
 H   -2.203000       3.081900      -1.570000    
 H    5.510300       2.455000       1.342200    
 H    5.592800       2.807600     -0.4000000    
 H    4.559400       3.784200      0.6386000    
 H   -4.592200       3.659500      -1.321900    
 H   -5.616200       2.814900     -0.1651000    
 H   -4.442000       4.019900      0.4140000    


%chk=000128118-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128118

0 1
N 0.533658 -0.567768 -0.898327
N -0.579362 -0.531846 0.136517
N 0.761542 -1.997908 -1.047124
N -0.681132 -1.756914 0.773488
N 0.526177 -5.110374 0.730708
C 1.725308 0.127357 -0.391615
C -1.700724 0.334868 -0.004228
C 3.002306 -0.272336 -0.848435
C 1.594930 1.269122 0.432619
C -2.852912 0.141144 0.801375
C -1.641241 1.418045 -0.915926
C 0.126446 -2.599443 0.121854
C 4.040474 1.613728 0.360338
C -3.895160 2.141132 -0.210543
C 4.141479 0.467034 -0.468824
C 2.747813 1.996467 0.798873
C -3.926800 1.045207 0.692830
C -2.737525 2.299439 -1.014213
C 5.276759 2.386241 0.786162
C -5.053539 3.118861 -0.297225
C 0.340771 -3.953824 0.477070
H 0.400011 -2.351271 -1.947350
H 3.095348 -1.160974 -1.478116
H 0.613655 1.584407 0.796781
H -2.895597 -0.707098 1.489528
H -0.760614 1.544805 -1.552280
H 5.127651 0.143357 -0.823113
H 2.636352 2.877657 1.442091
H -4.814176 0.890142 1.318365
H -2.689045 3.127306 -1.731646
H 5.703271 1.972799 1.720944
H 6.068103 2.339790 0.017290
H 5.045772 3.449552 0.974100
H -5.109716 3.594038 -1.292290
H -6.019859 2.620757 -0.102429
H -4.948026 3.930599 0.449045


