%chk=000183727.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183727

0 1
O 1.474408 -1.041171 -0.714523
O -0.306825 3.221335 0.126359
N -1.720428 1.417639 0.186393
C 2.643449 -0.097421 -0.811708
C 2.079608 1.325751 -0.552938
C 0.626464 1.059107 -0.304672
C 0.373077 -0.288269 -0.411735
C -0.926773 -0.863894 -0.231432
C -1.984978 0.044773 0.075597
C -0.397426 2.014359 0.002178
C 3.667430 -0.536718 0.208597
C -1.185187 -2.249468 -0.346505
C -3.295089 -0.487974 0.262652
C -2.830451 2.351801 0.505068
C 3.130555 -0.995210 1.522311
C -2.462310 -2.739645 -0.160832
C -3.515397 -1.846100 0.144936
C 4.968895 -0.481144 -0.081785
H 2.978430 -0.250256 -1.857721
H 2.232859 1.994192 -1.420233
H 2.559831 1.822175 0.311838
H -0.350590 -2.913433 -0.585617
H -4.125244 0.173966 0.497869
H -3.275496 2.119632 1.485718
H -3.608437 2.324705 -0.274558
H -2.439940 3.392121 0.552176
H 2.569708 -0.193042 2.025241
H 2.429385 -1.834471 1.384413
H 3.916806 -1.330533 2.209614
H -2.669567 -3.803387 -0.247637
H -4.521019 -2.246802 0.289070
H 5.743422 -0.759629 0.618012
H 5.366031 -0.155789 -1.030843


%chk=000183727-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183727

0 1
O 1.472211 -1.051779 -0.643460
O -0.305515 3.254063 0.224005
N -1.792304 1.410483 0.192778
C 2.652904 -0.064787 -0.729304
C 2.048543 1.345819 -0.396979
C 0.574448 1.053544 -0.222397
C 0.336980 -0.296155 -0.367395
C -0.971867 -0.880591 -0.243319
C -2.047109 0.034790 0.044725
C -0.475918 1.999659 0.073139
C 3.750274 -0.548252 0.199178
C -1.226963 -2.269404 -0.392053
C -3.364287 -0.495576 0.174216
C -2.901309 2.339611 0.488018
C 3.379988 -0.743893 1.655420
C -2.531091 -2.771405 -0.259604
C -3.595338 -1.874601 0.024059
C 4.996839 -0.774854 -0.291617
H 2.987836 -0.125159 -1.778762
H 2.234742 2.062320 -1.215937
H 2.491371 1.782867 0.516440
H -0.383577 -2.931296 -0.613048
H -4.205622 0.166855 0.391399
H -3.387580 2.082903 1.446336
H -3.654452 2.324925 -0.320151
H -2.463278 3.346866 0.560263
H 2.970896 0.182371 2.102817
H 2.595500 -1.517698 1.747301
H 4.252150 -1.057461 2.252702
H -2.728067 -3.841802 -0.374141
H -4.616510 -2.257946 0.128335
H 5.822068 -1.084897 0.358974
H 5.229240 -0.652319 -1.356637


