%chk=000146826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146826

0 1
 O   0.9252000     -0.7894000       2.318900    
 N    4.178100      0.7110000      0.3078000    
 N   -2.487900     -0.3540000     -0.4352000    
 N   -2.152500      -1.628700     -0.7730000    
 C    1.722200      0.3229000      -1.112500    
 C    3.073800      0.4014000      -1.847000    
 C    1.898900      2.6500000E-02  0.3500000    
 C    4.116100       1.202100      -1.056600    
 C  -0.4940000     -0.6850000      0.4220000    
 C   0.7784000     -0.4951000       1.129200    
 C   -1.467000      0.2476000      0.3085000    
 C    3.078100      0.2146000      0.9574000    
 C  -0.9415000      -1.808900     -0.2441000    
 C   -1.655300       1.588900      0.7458000    
 C  -0.2654000      -3.107200     -0.4203000    
 C   -3.669100      0.3270000     -0.7509000    
 C   -2.795200       2.234500      0.4365000    
 C   -3.842900       1.591800     -0.3366000    
 H    1.194700       1.278100      -1.223500    
 H    1.131900     -0.4449000      -1.621600    
 H    2.935100      0.8413000      -2.840900    
 H    3.451500     -0.6186000      -2.000000    
 H    3.844000       2.263700      -1.046400    
 H    5.099700       1.113300      -1.529000    
 H    3.270800      2.7000001E-03   2.001800    
 H    5.018200      0.8646000      0.8548000    
 H  -0.8812000       2.082200       1.323800    
 H  -0.9552000      -3.880600     -0.7746000    
 H   0.1621000      -3.454300      0.5261000    
 H   0.5460000      -3.019200      -1.149900    
 H   -4.411900     -0.2077000      -1.330200    
 H   -2.959600       3.256800      0.7590000    
 H   -4.744400       2.148200     -0.5629000    


%chk=000146826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146826

0 1
O 1.323145 -1.871876 1.613470
N 4.188709 0.889250 0.395493
N -2.560599 -0.461132 -0.323376
N -2.516469 -1.856527 -0.378181
C 1.724281 0.747378 -1.118818
C 3.086881 0.997780 -1.815822
C 1.933835 -0.017312 0.187247
C 4.084090 1.676428 -0.849685
C -0.434772 -0.992780 0.250147
C 0.972354 -0.993793 0.738383
C -1.313377 0.110066 0.059740
C 3.157009 0.092289 0.831707
C -1.229024 -2.162855 -0.006527
C -1.269232 1.525937 0.231865
C -0.800294 -3.599298 0.063302
C -3.692043 0.283312 -0.581474
C -2.410467 2.291369 -0.021438
C -3.631783 1.664796 -0.445094
H 1.222697 1.722592 -0.956629
H 1.059514 0.173381 -1.790187
H 2.956164 1.639204 -2.706488
H 3.512242 0.034136 -2.153346
H 3.744025 2.708656 -0.622879
H 5.086104 1.749456 -1.311887
H 3.331740 -0.504407 1.733880
H 5.050003 0.934740 0.937498
H -0.343315 1.984012 0.588499
H -1.669724 -4.261752 -0.077002
H -0.320711 -3.801329 1.035069
H -0.052281 -3.829292 -0.718333
H -4.579237 -0.282612 -0.869376
H -2.381217 3.377068 0.113570
H -4.526546 2.258715 -0.646926


