%chk=000265288.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265288

0 1
O -0.589473 2.631568 0.859210
O 2.104863 1.241109 -0.812110
O 1.982750 0.594360 1.403155
O -0.217700 3.230271 -2.260354
N -1.533856 0.673022 -0.060424
N -1.454046 -1.524014 0.624656
N -4.014391 0.859278 -0.415012
N -5.191667 -1.231507 0.079409
N -4.089378 -3.196739 0.800704
C 1.307404 2.421945 -0.626959
C 0.860202 2.731471 0.820301
C 0.008155 2.106359 -1.411944
C -1.120982 2.057336 -0.341476
C 1.420112 1.817504 1.914166
C 2.888826 0.800742 0.313166
C -2.858699 0.208438 -0.062746
C 3.452112 -0.540207 -0.080568
C -0.724751 -0.435809 0.383863
C -2.790302 -1.164660 0.356714
C 4.055080 -0.683673 -1.338238
C 3.388697 -1.624704 0.803974
C -4.020601 -1.882369 0.421146
C 4.608074 -1.913955 -1.702446
C 3.945317 -2.851764 0.432854
C -5.125425 0.079016 -0.314009
C 4.556260 -2.996205 -0.817116
H 1.872178 3.261642 -1.090453
H 1.032209 3.804423 1.075596
H 0.107831 1.170762 -2.005705
H -2.016631 2.688051 -0.585641
H 2.187063 2.324008 2.526219
H 0.601854 1.443834 2.570071
H 3.644672 1.569955 0.566233
H -0.772850 2.974483 -3.030188
H 0.359593 -0.332421 0.487906
H 4.076069 0.159024 -2.030005
H 2.897841 -1.507963 1.772957
H 5.076385 -2.030429 -2.678464
H 3.897137 -3.697232 1.117669
H -6.088539 0.549030 -0.578252
H 4.988583 -3.953967 -1.103608
H -4.975026 -3.673874 0.849690
H -3.253048 -3.690338 1.072061


%chk=000265288-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265288

0 1
O -0.235592 2.320332 1.417964
O 1.577843 0.983527 -0.686978
O 2.541364 0.978802 1.519890
O -0.684481 3.720126 -1.445653
N -1.522765 0.592034 0.398373
N -1.540375 -1.645261 0.892219
N -3.689227 0.775518 -0.800490
N -4.851355 -1.390839 -0.920616
N -3.967739 -3.382589 -0.002075
C 1.108233 2.379551 -0.585727
C 1.039056 2.867635 0.882186
C -0.366858 2.360638 -1.011950
C -1.129950 2.003878 0.308681
C 2.199488 2.392786 1.763623
C 2.802459 0.769654 0.097263
C -2.719828 0.092791 -0.121504
C 3.287210 -0.646555 -0.124323
C -0.850551 -0.492633 0.991431
C -2.712985 -1.291305 0.195028
C 3.051885 -1.295094 -1.360545
C 4.022520 -1.306903 0.889398
C -3.845360 -2.039828 -0.238728
C 3.552303 -2.597429 -1.580343
C 4.520590 -2.609436 0.665632
C -4.721416 -0.050006 -1.157951
C 4.289899 -3.257014 -0.570125
H 1.713912 3.047893 -1.226787
H 0.978088 3.974180 0.895717
H -0.556390 1.611473 -1.801532
H -2.057557 2.602267 0.382482
H 3.088903 3.032180 1.573614
H 1.921809 2.455490 2.826732
H 3.554597 1.530431 -0.233911
H -1.625286 3.750818 -1.754188
H 0.117118 -0.367364 1.470057
H 2.465569 -0.785762 -2.130936
H 4.182883 -0.804808 1.848044
H 3.362220 -3.098227 -2.536125
H 5.083712 -3.118979 1.455387
H -5.547073 0.416902 -1.703458
H 4.676301 -4.267906 -0.742365
H -4.798039 -3.869472 -0.332569
H -3.233232 -3.875696 0.501161


