%chk=000251279.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251279

0 1
N 0.315276 -0.317471 -2.167634
N -1.091796 2.998368 0.412247
C -1.236151 0.557227 -0.353850
C 0.230660 0.409038 -0.867313
C -1.838717 -0.788510 0.087560
C 1.149194 -0.263199 0.173466
C -1.311793 1.583766 0.803412
C 2.631195 -0.095137 -0.185219
C -3.372391 -0.742792 0.157760
C 3.540196 -0.785811 0.840357
C -3.954795 -2.074157 0.625382
C 5.016330 -0.614979 0.487919
H -1.847601 0.949346 -1.204071
H 0.623527 1.442419 -1.074681
H -1.530726 -1.590312 -0.610370
H -1.428461 -1.084281 1.072773
H 0.906519 -1.338466 0.267482
H 0.951920 0.178797 1.171446
H -2.311148 1.521416 1.292762
H -0.570147 1.324096 1.593398
H 2.818279 -0.505523 -1.198878
H 2.886300 0.979419 -0.253207
H -3.694551 0.067094 0.843455
H -3.789144 -0.480394 -0.834174
H -0.415089 -0.014890 -2.804669
H 0.204646 -1.318630 -2.041217
H 3.293331 -1.863910 0.897139
H 3.348495 -0.377067 1.851603
H -3.596481 -2.344118 1.625542
H -5.049215 -2.032489 0.671744
H -3.687537 -2.894363 -0.050442
H -1.753006 3.284682 -0.302958
H -0.161269 3.127795 0.025135
H 5.305881 0.441802 0.464763
H 5.246490 -1.037443 -0.497095
H 5.659579 -1.116222 1.219332


%chk=000251279-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000251279

0 1
N 0.325739 -0.330253 -2.121992
N -1.064677 3.056334 0.355829
C -1.264018 0.565604 -0.324725
C 0.212372 0.409935 -0.838631
C -1.874721 -0.775012 0.166571
C 1.163366 -0.241901 0.197006
C -1.398849 1.678672 0.765898
C 2.656507 -0.076740 -0.161741
C -3.421460 -0.817107 0.136480
C 3.599243 -0.840810 0.795034
C -3.992145 -2.156095 0.652299
C 5.091046 -0.659124 0.439340
H -1.858336 0.906144 -1.204720
H 0.590413 1.434822 -1.045432
H -1.498705 -1.611348 -0.462025
H -1.524536 -0.986248 1.198967
H 0.925121 -1.323686 0.278339
H 0.976732 0.192791 1.199387
H -2.439637 1.686982 1.142459
H -0.763803 1.419822 1.635568
H 2.807546 -0.422042 -1.202440
H 2.919653 1.002533 -0.147191
H -3.834661 0.013588 0.742621
H -3.765623 -0.642925 -0.903695
H -0.172269 0.120381 -2.898839
H 0.058000 -1.318884 -2.037656
H 3.342656 -1.920176 0.771908
H 3.423254 -0.502977 1.837516
H -3.695081 -2.334494 1.702974
H -5.096630 -2.171500 0.606066
H -3.616397 -3.005223 0.050144
H -1.673788 3.441802 -0.372168
H -0.074487 3.220244 0.154575
H 5.382391 0.407313 0.488114
H 5.297174 -1.014816 -0.587789
H 5.746410 -1.220506 1.130850


