%chk=000222908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222908

0 1
O 0.208687 1.627765 -1.931694
O -4.155035 1.772096 1.253649
O -4.366136 -0.003994 -0.094740
N 0.865308 -0.007619 -0.482904
C 0.534326 -1.111982 0.451154
C 2.304164 0.232405 -0.784025
C 0.318367 -2.435671 -0.301586
C 2.960642 1.085745 0.312587
C -0.026280 -3.570494 0.671415
C 4.450028 1.303458 0.015686
C -0.098858 0.761408 -1.127885
C -0.243009 -4.890627 -0.063524
C 5.119056 2.148283 1.096996
C -1.534783 0.458997 -0.806189
C -2.223359 1.153166 0.100278
C -3.650979 0.864330 0.349562
H -0.371162 -0.847609 1.042048
H 1.361514 -1.219057 1.189536
H 2.821603 -0.744562 -0.892666
H 2.379847 0.755724 -1.769760
H -0.487755 -2.323788 -1.052353
H 1.224383 -2.695827 -0.883001
H 2.442554 2.063722 0.383358
H 2.836127 0.609912 1.303177
H 0.782942 -3.689037 1.418906
H -0.937641 -3.312625 1.247266
H 4.968014 0.328159 -0.069699
H 4.568644 1.798819 -0.969223
H 0.650361 -5.198876 -0.618750
H -0.487318 -5.697927 0.636948
H -1.068181 -4.823734 -0.782668
H 5.055821 1.672617 2.082082
H 6.181188 2.304800 0.875735
H 4.654577 3.138147 1.180662
H -1.981222 -0.340502 -1.411117
H -1.798363 1.970826 0.693543
H -5.121170 1.623650 1.444295


%chk=000222908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222908

0 1
O 0.122293 1.974370 -1.027984
O -4.814805 2.103487 -0.134444
O -4.309334 0.026755 0.787653
N 0.877982 -0.034366 -0.118064
C 0.688764 -1.299792 0.631369
C 2.247280 0.271516 -0.598561
C 0.260531 -2.488900 -0.261269
C 3.085048 1.060014 0.435581
C 0.155147 -3.810288 0.533481
C 4.519959 1.331715 -0.069677
C -0.126078 0.886102 -0.405448
C -0.265589 -5.001733 -0.353557
C 5.364221 2.131442 0.945695
C -1.519019 0.546365 0.029214
C -2.545037 1.408761 -0.209019
C -3.925257 1.072954 0.206144
H -0.037059 -1.156178 1.451902
H 1.653490 -1.539324 1.118077
H 2.747778 -0.685024 -0.845463
H 2.154716 0.869207 -1.521983
H -0.714445 -2.260390 -0.736032
H 0.991415 -2.605610 -1.086466
H 2.573121 2.018212 0.644722
H 3.129098 0.497523 1.391244
H 1.131265 -4.031157 1.012418
H -0.576475 -3.686327 1.357782
H 5.023167 0.368002 -0.292736
H 4.469099 1.887640 -1.027558
H 0.464393 -5.167343 -1.167887
H -0.335604 -5.935450 0.233344
H -1.252400 -4.820302 -0.818587
H 5.454430 1.587144 1.904724
H 6.385167 2.316357 0.564511
H 4.899844 3.112185 1.158899
H -1.741974 -0.401104 0.532319
H -2.365604 2.362553 -0.714522
H -5.732624 1.851084 0.157280


