%chk=000050867.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050867

0 1
 O    1.198000     -0.3730000     -0.8717000    
 N    4.531700      7.0500001E-02  0.6273000    
 N    5.509400       1.090000      0.4182000    
 C   -1.059500      0.1800000     -0.2137000    
 C   -2.326200     -0.2685000      0.2306000    
 C  -4.0100001E-02 -0.7584000     -0.4427000    
 C    2.300900     -0.6942000     -2.8999999E-02
 C  -0.8497000       1.553700     -0.4161000    
 C   -2.536100      -1.642400      0.4328000    
 C  -0.2663000      -2.119600     -0.2364000    
 C   -3.345500      0.6701000      0.4595000    
 C    3.388500      0.3493000     -0.2290000    
 C   -1.511900      -2.560700      0.2004000    
 C   -1.873800       2.472100     -0.1836000    
 C   -3.119300       2.031200      0.2534000    
 H    1.990300     -0.7101000       1.024500    
 H    2.674400      -1.689100     -0.2991000    
 H   0.1118000       1.931700     -0.7569000    
 H   -3.501800      -2.009800      0.7734000    
 H   0.5159000      -2.850600     -0.4222000    
 H   -4.327000      0.3480000      0.8013000    
 H    3.684900      0.3539000      -1.286300    
 H    2.969300       1.342800     -1.9700000E-02
 H   -1.688100      -3.620700      0.3584000    
 H   -1.698400       3.531900     -0.3439000    
 H   -3.916100       2.746800      0.4342000    
 H    4.244100      7.6099999E-02   1.605400    
 H    5.163500       1.973900      0.7911000    
 H    6.340500      0.8642000      0.9634000    


%chk=000050867-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050867

0 1
O 1.143603 0.282500 0.102615
N 4.817851 -0.124980 0.424023
N 5.969026 0.577748 -0.019731
C -1.252518 0.364616 0.023684
C -2.538111 -0.298518 0.069034
C -0.058790 -0.437832 0.153351
C 2.402333 -0.468761 0.228605
C -1.197014 1.784969 -0.147567
C -2.595840 -1.723083 0.239261
C -0.139300 -1.826855 0.317966
C -3.724569 0.497533 -0.059231
C 3.537906 0.558529 0.134472
C -1.419817 -2.462275 0.359530
C -2.372987 2.531088 -0.269823
C -3.647243 1.882562 -0.225076
H 2.421645 -0.998756 1.205560
H 2.490902 -1.216743 -0.582745
H -0.216948 2.268839 -0.182019
H -3.572874 -2.218162 0.272094
H 0.762194 -2.438154 0.413036
H -4.699504 -0.003517 -0.025105
H 3.607344 0.958767 -0.889265
H 3.312968 1.411842 0.816368
H -1.464071 -3.549554 0.487427
H -2.322281 3.617618 -0.401248
H -4.562457 2.477330 -0.321999
H 4.874722 -0.455575 1.401169
H 6.352198 1.312559 0.586256
H 6.655034 -0.014632 -0.487046


