%chk=000046538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046538

0 1
 N   0.6529000     -8.8799998E-02 -0.1929000    
 N   -1.348000      -1.270000      0.2526000    
 C   -1.647800      0.1486000     -2.1100000E-02
 C  -0.3345000      0.8528000      0.3308000    
 C   0.1143000      -1.398200      0.1718000    
 C    1.989700      0.1444000      0.3303000    
 C   -2.033900      0.3403000      -1.498000    
 C   -2.792900      0.6168000      0.8773000    
 C    2.454800       1.555900     -1.6400000E-02
 C    2.945500     -0.9017000     -0.2344000    
 H  -0.2711000       1.833700     -0.1523000    
 H  -0.2334000      0.9831000       1.417200    
 H   0.4661000      -1.740200       1.152600    
 H   0.3846000      -2.150700     -0.5767000    
 H   -1.793300      -1.869800     -0.4404000    
 H    2.000400      5.1500000E-02   1.425100    
 H   -2.953800     -0.2048000      -1.740100    
 H   -2.207900       1.399600      -1.718600    
 H   -1.253500     -1.3900000E-02  -2.181000    
 H   -3.718700      7.1500003E-02  0.6606000    
 H   -2.560800      0.4644000       1.937900    
 H   -2.990400       1.684900      0.7331000    
 H    3.502000       1.696100      0.2755000    
 H    2.386000       1.749900      -1.093000    
 H    1.877700       2.323300      0.5096000    
 H    2.709400      -1.913100      0.1123000    
 H    3.973100     -0.6921000      8.4200002E-02
 H    2.936700     -0.9048000      -1.330600    


%chk=000046538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046538

0 1
N 0.707034 -0.126166 -0.241382
N -1.331531 -1.310550 -0.269806
C -1.715214 0.151345 -0.167225
C -0.341932 0.897984 0.044063
C 0.056319 -1.403157 0.213325
C 2.033093 0.163731 0.373593
C -2.415797 0.592384 -1.471060
C -2.646187 0.359702 1.048130
C 2.592957 1.499632 -0.161742
C 3.023603 -0.985079 0.083875
H -0.236321 1.765817 -0.629941
H -0.273447 1.266777 1.098910
H 0.065198 -1.482526 1.329938
H 0.561202 -2.288110 -0.206692
H -1.378649 -1.613291 -1.254240
H 1.920514 0.257444 1.489212
H -3.281151 -0.063143 -1.685026
H -2.790813 1.628121 -1.387157
H -1.716318 0.546461 -2.326707
H -3.613880 -0.145545 0.881471
H -2.193260 -0.069966 1.959626
H -2.832990 1.436314 1.226613
H 3.594980 1.691647 0.263392
H 2.679282 1.457385 -1.262986
H 1.944924 2.353712 0.102704
H 2.709407 -1.935526 0.550780
H 4.023669 -0.732946 0.480539
H 3.108510 -1.143752 -1.006809


