%chk=000258307.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258307

0 1
O -4.537054 1.295464 -0.414849
N -0.004217 -0.132895 0.604198
N -2.822600 -0.271645 -0.403781
N -5.003635 -0.715319 0.575734
C -0.804835 1.080322 0.238499
C -0.684482 -1.407619 0.215212
C -1.871455 0.797748 -0.832920
C -2.198821 -1.312639 0.471887
C 1.397721 -0.052755 0.282808
C -4.138131 0.186091 -0.088517
C 2.120836 1.045815 0.803943
C 2.090338 -1.054325 -0.420207
C 3.495836 1.131227 0.616503
C 3.473850 -0.960941 -0.595145
C 4.189605 0.128906 -0.085782
C 5.668157 0.236500 -0.273475
H -0.153073 1.913328 -0.102215
H -1.291721 1.424344 1.181853
H -0.253934 -2.214034 0.853565
H -0.500835 -1.690001 -0.846685
H -2.433112 1.733816 -1.074773
H -1.404121 0.452573 -1.782623
H -2.672133 -2.290555 0.231376
H -2.385335 -1.099941 1.550560
H 1.604272 1.815873 1.374295
H 1.568124 -1.909648 -0.840345
H 4.042410 1.980861 1.023755
H 3.994458 -1.747834 -1.138968
H -5.983697 -0.450867 0.573301
H -4.855142 -1.709318 0.507742
H 6.080076 -0.585263 -0.872727
H 5.939707 1.172547 -0.781390
H 6.192342 0.224585 0.692871


%chk=000258307-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258307

0 1
O -4.866008 1.204574 0.037585
N -0.024903 -0.048864 -0.161320
N -2.911363 -0.082782 -0.106346
N -4.835269 -0.914356 0.998582
C -0.800182 1.211976 -0.122057
C -0.763074 -1.285105 -0.453975
C -2.181835 1.014638 -0.768353
C -2.144186 -1.295429 0.236796
C 1.379076 -0.028797 -0.073285
C -4.233652 0.130888 0.294203
C 2.062054 1.135018 0.400403
C 2.179274 -1.150654 -0.447771
C 3.466204 1.160530 0.496281
C 3.584913 -1.105595 -0.334298
C 4.264871 0.043783 0.137624
C 5.779360 0.084779 0.254947
H -0.257436 1.998350 -0.684131
H -0.927742 1.574780 0.920582
H -0.195726 -2.147551 -0.062238
H -0.893381 -1.447560 -1.547578
H -2.795880 1.924436 -0.664480
H -2.065634 0.810241 -1.851773
H -2.683355 -2.206857 -0.097314
H -1.992280 -1.365926 1.336040
H 1.494656 2.015034 0.718282
H 1.717062 -2.054012 -0.858440
H 3.952745 2.071341 0.869024
H 4.166141 -1.986427 -0.635569
H -5.799265 -0.762591 1.282868
H -4.365805 -1.774574 1.267182
H 6.234597 -0.856979 -0.098617
H 6.212748 0.909998 -0.341785
H 6.102672 0.238093 1.302632


