%chk=000239649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239649

0 1
O -1.817218 -1.308291 0.620043
N 1.079047 1.053281 0.510257
N 0.928001 -1.361571 0.108129
C 0.178477 -0.067763 0.092725
C 2.363413 1.155724 -0.255280
C -1.003462 -0.184078 1.124005
C 3.060477 -0.225066 -0.265658
C 2.126959 -1.335686 -0.786405
C -1.859306 1.090432 1.198561
C 2.134638 1.658763 -1.700584
C 3.241967 2.174548 0.498859
C -0.562024 -0.668706 2.494572
C -2.533693 1.413592 -0.139680
C 2.806916 -2.708532 -0.731434
C -3.156758 0.181111 -0.731908
C -2.780686 -1.044253 -0.325694
C -4.207741 0.381507 -1.771801
H -0.268189 0.127850 -0.925069
H 3.365417 -0.476169 0.772741
H 3.984014 -0.184352 -0.865044
H 1.849808 -1.113661 -1.851983
H 0.563710 1.939053 0.464885
H 0.287382 -2.129617 -0.126717
H -1.250200 1.940586 1.555236
H -2.642642 0.943096 1.971662
H 1.643651 2.635259 -1.718966
H 3.084646 1.767604 -2.233213
H 1.518349 0.965043 -2.280059
H 4.249675 2.219939 0.076886
H 2.822169 3.183926 0.466168
H 3.333408 1.897819 1.557874
H -0.209280 -1.711106 2.439713
H 0.294903 -0.076396 2.848994
H -1.365367 -0.630751 3.233732
H -1.806286 1.846312 -0.855497
H -3.304524 2.195875 0.013303
H 3.757132 -2.703654 -1.274057
H 3.018034 -3.002864 0.306147
H 2.177880 -3.491998 -1.166140
H -3.179853 -1.999579 -0.648401
H -5.105133 0.846705 -1.338972
H -4.526518 -0.558939 -2.239176
H -3.852395 1.038909 -2.576851


%chk=000239649-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239649

0 1
O -1.845861 -1.357894 0.645588
N 1.104955 0.999332 0.563172
N 0.952259 -1.363651 0.145051
C 0.197459 -0.098537 0.156939
C 2.350055 1.160495 -0.261369
C -0.998526 -0.218576 1.163161
C 3.056421 -0.222938 -0.320634
C 2.114638 -1.363317 -0.769651
C -1.865712 1.061873 1.222514
C 2.044482 1.696015 -1.694837
C 3.254126 2.173920 0.476591
C -0.539734 -0.660596 2.554074
C -2.497366 1.426820 -0.141645
C 2.814940 -2.732049 -0.715820
C -3.136211 0.203255 -0.777765
C -2.793923 -1.043113 -0.348847
C -4.159858 0.408074 -1.873205
H -0.248590 0.093667 -0.860941
H 3.424344 -0.471117 0.693007
H 3.924919 -0.159165 -1.004499
H 1.805621 -1.172735 -1.831213
H 0.596494 1.895016 0.607553
H 0.311984 -2.155292 -0.005712
H -1.267552 1.898256 1.629715
H -2.676329 0.873214 1.951929
H 1.575541 2.697431 -1.637324
H 2.972772 1.792107 -2.288779
H 1.358108 1.030462 -2.247983
H 4.215151 2.304833 -0.054283
H 2.767337 3.166744 0.543937
H 3.457510 1.820581 1.502165
H -0.066150 -1.652906 2.501433
H 0.216093 0.049333 2.930347
H -1.397097 -0.700468 3.248565
H -1.742001 1.869765 -0.826018
H -3.265794 2.212192 0.006741
H 3.694149 -2.749796 -1.385426
H 3.148621 -2.947016 0.315267
H 2.132078 -3.544032 -1.031818
H -3.251049 -1.960979 -0.733009
H -5.026508 0.996743 -1.509965
H -4.543685 -0.551523 -2.263758
H -3.729312 0.969473 -2.727344


