%chk=000251575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251575

0 1
O -4.093617 -1.439190 1.737993
O -3.688602 2.512423 -0.855310
O -5.188655 2.543688 0.833100
O 6.786534 0.508127 0.680842
N -0.564808 -1.804328 -0.775108
N 1.438735 1.379793 -0.382587
C -3.025747 -1.601455 -0.505099
C -2.892628 -0.055950 -0.525069
C -0.409531 -0.315071 -0.983997
C -1.473768 0.396344 -0.127628
C -1.886868 -2.252367 -1.317128
C -3.024843 -2.112455 0.944439
C 0.988067 0.068495 -0.594305
C 0.566379 -2.584723 -1.380909
C 2.051698 -0.822413 -0.456843
C 1.872798 -2.286533 -0.611835
C -3.910076 0.545104 0.407972
C 3.222900 -0.059849 -0.132039
C -3.392254 -3.574901 1.109412
C -4.424180 -0.173082 1.439596
C 2.817063 1.320037 -0.085044
C -4.356435 1.918626 0.206951
C 4.567269 -0.400112 0.120699
C 3.726595 2.357423 0.209544
C 5.436947 0.638975 0.407015
C 5.037835 2.012218 0.455295
C -4.074016 3.878467 -1.160223
C 7.343197 -0.826668 0.682400
H -3.998843 -1.873545 -0.983609
H -3.104147 0.301253 -1.566259
H -0.556976 -0.033057 -2.064633
H -1.289332 0.187712 0.945269
H -1.401477 1.494007 -0.247044
H -1.946798 -3.358887 -1.227165
H -2.022536 -2.014743 -2.395171
H -2.081004 -1.846326 1.473678
H 0.709765 -2.365729 -2.460676
H 0.328365 -3.665722 -1.292722
H 2.732574 -2.740915 -1.140976
H 1.833108 -2.758251 0.394340
H 0.878764 2.207538 -0.388236
H -2.537683 -4.223462 0.879427
H -3.692908 -3.782752 2.148125
H -4.233942 -3.873592 0.473980
H -5.180947 0.173057 2.151774
H 4.873721 -1.437213 0.087042
H 3.398072 3.392586 0.240975
H 5.794197 2.758448 0.689862
H -3.429160 4.126079 -2.008398
H -3.881049 4.517931 -0.292936
H -5.135109 3.909359 -1.428140
H 8.395085 -0.632492 0.927591
H 7.248325 -1.278939 -0.308855
H 6.866445 -1.436464 1.455223


%chk=000251575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251575

0 1
O -4.243162 -1.482714 1.697271
O -3.745224 2.581149 -0.856392
O -5.288815 2.550311 0.897946
O 6.871016 0.494153 0.717590
N -0.553445 -1.812796 -0.799722
N 1.466125 1.356184 -0.438606
C -3.023076 -1.608990 -0.481491
C -2.898680 -0.057095 -0.516336
C -0.397185 -0.337813 -0.986360
C -1.461475 0.402447 -0.140624
C -1.877757 -2.249065 -1.297119
C -3.070580 -2.118024 0.976824
C 1.016364 0.041751 -0.630548
C 0.571728 -2.592784 -1.384101
C 2.078239 -0.843548 -0.457792
C 1.888839 -2.330415 -0.616421
C -3.955606 0.559895 0.384211
C 3.248111 -0.053675 -0.134023
C -3.280424 -3.621031 1.145282
C -4.550522 -0.181761 1.376662
C 2.836382 1.325669 -0.131139
C -4.417042 1.946908 0.217047
C 4.603481 -0.383294 0.146590
C 3.741842 2.372975 0.145440
C 5.500905 0.669133 0.422072
C 5.077089 2.033452 0.422361
C -4.168358 3.974035 -1.118168
C 7.375839 -0.875922 0.743496
H -3.982492 -1.895461 -0.960757
H -3.088788 0.277579 -1.555342
H -0.586565 -0.076946 -2.067276
H -1.257403 0.217262 0.929369
H -1.395995 1.493539 -0.311155
H -1.931026 -3.350891 -1.237944
H -2.022799 -1.973199 -2.375494
H -2.166368 -1.792422 1.523125
H 0.720073 -2.341687 -2.465469
H 0.306534 -3.664726 -1.325160
H 2.731141 -2.785902 -1.174537
H 1.844628 -2.831289 0.371454
H 0.886756 2.191239 -0.481021
H -2.365553 -4.171600 0.867293
H -3.508708 -3.850453 2.200087
H -4.119252 -3.980264 0.522610
H -5.352306 0.219115 2.004624
H 4.925817 -1.428695 0.147576
H 3.427329 3.422409 0.148438
H 5.823471 2.801796 0.644436
H -3.558597 4.298983 -1.973787
H -3.983544 4.607342 -0.233756
H -5.243686 4.010753 -1.361967
H 8.444090 -0.788089 0.992234
H 7.262976 -1.368647 -0.243187
H 6.862154 -1.482379 1.516257


