%chk=000214619.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214619

0 1
O 0.433717 0.837368 -0.025130
O -1.162450 -2.966903 0.094044
N 3.692036 -0.798074 0.036884
N 3.140617 1.410397 -0.069683
N 4.779726 0.006531 0.000758
N 4.427374 1.335139 -0.063420
C -1.548780 -0.618894 0.022946
C -0.952602 0.645587 -0.016803
C -2.954497 -0.688834 0.027756
C -3.721136 0.476928 -0.006386
C -0.708994 -1.843088 0.058689
C -1.695410 1.838123 -0.051846
C 1.222483 -0.302962 0.007626
C -3.080219 1.738141 -0.046160
C 0.739781 -1.558628 0.046884
C -5.212791 0.412456 -0.001514
C 2.635191 0.075369 -0.007005
H -3.423643 -1.677230 0.058820
H -1.182611 2.798765 -0.082291
H -3.685927 2.645728 -0.072785
H 1.397206 -2.432798 0.072224
H -5.592775 -0.618175 0.029541
H -5.634361 0.933382 0.870568
H -5.637984 0.881305 -0.900950
H 5.734850 -0.351732 0.019832


%chk=000214619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214619

0 1
O 0.454893 0.892204 -0.026465
O -1.155869 -2.984906 0.096690
N 3.674677 -0.858634 0.033800
N 3.201179 1.398213 -0.062774
N 4.793914 -0.079339 0.000359
N 4.547348 1.297262 -0.058115
C -1.534833 -0.582425 0.022795
C -0.945414 0.707780 -0.018347
C -2.951395 -0.674841 0.028075
C -3.765250 0.474100 -0.006294
C -0.678962 -1.800798 0.058820
C -1.728589 1.880296 -0.053417
C 1.263274 -0.243102 0.006427
C -3.127226 1.753888 -0.047086
C 0.763089 -1.526157 0.046927
C -5.280027 0.374952 -0.001064
C 2.687083 0.090028 -0.006907
H -3.384750 -1.680914 0.060107
H -1.232894 2.855028 -0.084857
H -3.745224 2.659481 -0.074307
H 1.456460 -2.370581 0.070984
H -5.613429 -0.675852 0.030492
H -5.712147 0.895690 0.874462
H -5.714741 0.842916 -0.904652
H 5.737634 -0.466389 0.016946


