%chk=000206153.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206153

0 1
O -1.731439 0.620892 2.535243
O 2.829929 1.882729 -1.739942
N 3.004702 -1.273682 0.088283
C 1.354562 0.435989 -0.646317
C 0.185475 0.198117 0.101497
C -0.671398 1.273779 0.430024
C 2.278092 -0.675362 -1.083927
C -1.961845 1.078790 1.199457
C -2.907877 0.159451 0.448005
C 1.650811 1.766254 -1.027715
C -0.342266 2.574903 0.034624
C -0.101724 -1.175638 0.543925
C -2.575870 -1.174363 0.148300
C 3.953702 -0.283392 0.700540
C 3.721366 -2.527767 -0.325114
C 0.816907 2.838470 -0.696102
C -1.299647 -1.776442 0.555764
C -4.151412 0.670805 0.044408
C -3.499627 -1.976536 -0.550436
C 4.341640 -0.733921 2.109637
C 2.722731 -3.672756 -0.503573
C -5.056493 -0.128266 -0.654152
C -4.727896 -1.456000 -0.953394
C 3.196452 3.193990 -2.231784
H 1.671214 -1.480895 -1.561669
H 2.974496 -0.303191 -1.872834
H -2.453323 2.064579 1.411107
H -0.998616 3.405740 0.299433
H 0.795322 -1.728621 0.873749
H 4.862140 -0.120163 0.082335
H 3.437107 0.701741 0.763629
H 4.321212 -2.395547 -1.251396
H 4.440867 -2.797341 0.481386
H 1.052732 3.855670 -0.988281
H -1.377648 -2.820155 0.880254
H -4.416193 1.701108 0.280746
H -3.246671 -3.009514 -0.784339
H 3.446690 -0.945048 2.710875
H 4.944010 -1.648878 2.099546
H 4.915238 0.043082 2.624704
H 2.121090 -3.813110 0.403808
H 2.023491 -3.483546 -1.326417
H 3.240018 -4.614638 -0.712585
H -1.253217 -0.235412 2.545634
H -6.017428 0.278048 -0.963411
H -5.432807 -2.081174 -1.498653
H 2.435413 3.569272 -2.921933
H 4.134711 2.979915 -2.759809
H 3.364675 3.879732 -1.396429


%chk=000206153-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206153

0 1
O -1.650418 0.742595 2.422940
O 3.016669 1.988625 -1.767715
N 3.041578 -1.316961 0.098338
C 1.459478 0.484242 -0.728257
C 0.210219 0.233967 -0.070080
C -0.683599 1.321993 0.202696
C 2.416464 -0.648000 -1.089883
C -1.953157 1.133955 1.020871
C -2.972641 0.192185 0.392650
C 1.773368 1.813981 -1.126455
C -0.333868 2.622392 -0.215773
C -0.100894 -1.158690 0.298662
C -2.668740 -1.190849 0.183706
C 3.881304 -0.372717 0.891736
C 3.798464 -2.532242 -0.316209
C 0.878407 2.883607 -0.881816
C -1.333434 -1.765679 0.396925
C -4.275059 0.665876 0.107749
C -3.711574 -2.060989 -0.250298
C 4.130828 -0.856721 2.332323
C 2.895370 -3.719517 -0.704355
C -5.286677 -0.200257 -0.359952
C -5.003325 -1.576940 -0.529302
C 3.377132 3.338075 -2.204744
H 1.848842 -1.421382 -1.639516
H 3.195123 -0.256562 -1.780400
H -2.429484 2.120660 1.150232
H -1.014621 3.453998 0.001011
H 0.786800 -1.788832 0.439729
H 4.855768 -0.170269 0.379036
H 3.342303 0.590353 0.932677
H 4.497816 -2.299963 -1.160950
H 4.427055 -2.840115 0.538238
H 1.119765 3.905823 -1.185725
H -1.323493 -2.850567 0.577882
H -4.503348 1.725053 0.278530
H -3.486725 -3.125495 -0.390115
H 3.168709 -1.029199 2.845690
H 4.711660 -1.796336 2.368708
H 4.698925 -0.094077 2.896973
H 2.221255 -3.977116 0.131878
H 2.275608 -3.504699 -1.593164
H 3.513116 -4.606309 -0.938620
H -1.187888 -0.136516 2.401752
H -6.289902 0.187040 -0.568978
H -5.785014 -2.262860 -0.873720
H 2.654310 3.728994 -2.947117
H 4.366967 3.231361 -2.672819
H 3.443956 4.036783 -1.348270


