%chk=000240649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240649

0 1
O -0.476455 2.286807 -0.969798
O 2.502047 1.220582 1.411586
N 0.736602 0.627503 0.016970
N 1.980410 2.715018 -0.230243
N -3.835078 1.430189 -0.134319
N 3.139281 -1.223770 -2.166470
C -1.559838 -1.224713 -0.227778
C 0.840675 -0.814122 0.475122
C -0.098814 -1.681956 -0.385798
C -1.968753 -1.267023 1.261536
C 0.442222 -0.896163 1.966289
C -1.638995 0.210015 -0.848243
C -1.019111 -0.490084 2.177699
C -2.491889 -2.145635 -1.029057
C 2.299193 -1.327471 0.295646
C -0.436144 1.125748 -0.595925
C 1.788589 1.541655 0.471239
C -2.857054 0.900728 -0.444867
C 2.764776 -1.266828 -1.073904
H -0.001014 -2.742285 -0.079775
H 0.205403 -1.663161 -1.451232
H -2.006659 -2.326143 1.588745
H -3.002858 -0.890804 1.390357
H 1.108820 -0.240336 2.570456
H 0.609050 -1.922625 2.342536
H -1.669677 0.090480 -1.978154
H -1.140765 0.600192 2.019880
H -1.301192 -0.661491 3.236121
H -2.477989 -3.171493 -0.640973
H -3.534859 -1.805575 -0.986012
H -2.214079 -2.206169 -2.087574
H 2.370918 -2.373093 0.675722
H 2.997474 -0.741119 0.959060
H 2.648820 3.381507 0.137182
H 1.305342 3.068735 -0.911025


%chk=000240649-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240649

0 1
O -0.439358 2.276317 -1.169777
O 2.613719 1.184726 1.403149
N 0.754990 0.634916 0.023023
N 1.822980 2.801450 -0.056761
N -3.841806 1.495347 -0.297503
N 3.128223 -1.215884 -2.268507
C -1.566412 -1.231925 -0.216567
C 0.862085 -0.816401 0.481417
C -0.100682 -1.687791 -0.361071
C -1.972011 -1.215735 1.287127
C 0.469099 -0.915171 1.984147
C -1.597156 0.181728 -0.891105
C -0.987614 -0.452677 2.203683
C -2.513250 -2.174852 -0.996097
C 2.314453 -1.361187 0.264154
C -0.365937 1.108441 -0.676084
C 1.800635 1.558527 0.508096
C -2.825542 0.935500 -0.571783
C 2.766517 -1.283128 -1.133265
H -0.000466 -2.730100 -0.003922
H 0.205248 -1.677235 -1.425911
H -2.023697 -2.272651 1.619290
H -2.992167 -0.800944 1.391743
H 1.171825 -0.317969 2.588318
H 0.575034 -1.974901 2.293534
H -1.606777 0.017783 -1.990201
H -1.066601 0.638788 2.034250
H -1.269679 -0.615626 3.260203
H -2.493055 -3.190135 -0.560000
H -3.556899 -1.812529 -0.956966
H -2.218507 -2.257874 -2.059505
H 2.316980 -2.421982 0.578942
H 3.019142 -0.808787 0.907955
H 2.534516 3.443351 0.289478
H 1.090567 3.075711 -0.728486


