%chk=000260126.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260126

0 1
O 1.548400 -3.074148 -0.971906
O -0.147074 -4.354541 -1.289999
O -5.109156 1.843181 1.272259
O -5.394924 -0.315000 0.557181
N 1.306110 -0.739307 0.100158
N -2.850090 -1.483217 0.001345
N 0.332317 -3.279992 -0.921635
N -3.256794 0.728415 0.774819
N -2.570378 -3.633395 -0.760368
C 1.896889 0.538700 0.590439
C 1.789057 1.673124 -0.419226
C 3.349356 0.263976 0.946546
C -0.040316 -0.973968 0.025426
C 1.624587 1.445397 -1.790701
C 4.318770 0.115122 -0.054972
C 1.873918 2.989635 0.062147
C 3.714723 0.148151 2.295402
C -0.532124 -2.261554 -0.440278
C -0.969442 0.014982 0.413875
C -1.967380 -2.462971 -0.402666
C -2.344896 -0.277961 0.384619
C 1.535725 2.527183 -2.673348
C 5.647295 -0.144745 0.292786
C 1.788755 4.065781 -0.823590
C 5.045072 -0.109000 2.637892
C 1.617004 3.836928 -2.193344
C 6.012213 -0.256148 1.638169
C -4.669331 0.604416 0.818236
C -6.560007 2.032197 1.356257
C -7.141856 2.216891 -0.027764
H 1.333595 0.843514 1.521977
H 1.983738 -1.460293 -0.224903
H 1.558796 0.429902 -2.181159
H 4.039804 0.207454 -1.105266
H 2.017167 3.176710 1.125215
H 2.966563 0.252053 3.079872
H -0.625194 1.000118 0.706995
H 1.402703 2.344334 -3.739140
H 6.398505 -0.261830 -0.487540
H 1.857679 5.085309 -0.446926
H 5.327521 -0.198724 3.685967
H 1.548351 4.676853 -2.882341
H 7.047760 -0.459403 1.907193
H -2.864022 1.639415 1.047797
H -2.033539 -4.436017 -1.095092
H -3.581157 -3.711367 -0.721076
H -6.601509 2.946645 1.977346
H -6.993749 1.169031 1.892302
H -8.197476 2.510905 0.015894
H -6.603466 2.986776 -0.595640
H -7.085392 1.285186 -0.612836


%chk=000260126-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260126

0 1
O 1.685474 -3.217891 -0.642078
O -0.086015 -4.606922 -0.928691
O -5.042118 1.946360 1.114700
O -5.427018 -0.325450 0.606729
N 1.341374 -0.754396 0.091639
N -2.833479 -1.575370 0.062266
N 0.382173 -3.418070 -0.624334
N -3.248163 0.673028 0.684406
N -2.519944 -3.767396 -0.561065
C 1.924115 0.523405 0.549336
C 1.719252 1.683265 -0.438523
C 3.403092 0.274320 0.897436
C -0.004207 -1.026202 0.069019
C 1.503982 1.462256 -1.819072
C 4.454155 0.622594 0.016053
C 1.777823 3.014536 0.045039
C 3.715179 -0.361818 2.126269
C -0.506040 -2.354856 -0.279698
C -0.961249 -0.029317 0.392523
C -1.948787 -2.565147 -0.259222
C -2.339443 -0.354522 0.371000
C 1.351960 2.554431 -2.703881
C 5.796075 0.337754 0.357577
C 1.627531 4.107403 -0.836143
C 5.054529 -0.645586 2.469500
C 1.413783 3.879978 -2.216473
C 6.100521 -0.295897 1.583377
C -4.645454 0.629574 0.771146
C -6.512260 2.161200 1.227750
C -7.129956 2.465174 -0.139910
H 1.414087 0.803063 1.497702
H 1.954588 -1.552513 -0.149996
H 1.447350 0.435345 -2.196489
H 4.226104 1.121812 -0.931691
H 1.952421 3.195524 1.113552
H 2.905205 -0.640922 2.811908
H -0.638552 0.989343 0.614110
H 1.182594 2.369988 -3.770613
H 6.601755 0.610650 -0.332933
H 1.675394 5.131623 -0.449612
H 5.282348 -1.137466 3.421523
H 1.293783 4.726011 -2.902215
H 7.141214 -0.514863 1.846987
H -2.852014 1.595219 0.879283
H -1.907856 -4.552057 -0.811703
H -3.537717 -3.813282 -0.517204
H -6.596807 3.014017 1.920455
H -6.964631 1.260406 1.679186
H -8.204714 2.697442 -0.020744
H -6.639120 3.334434 -0.610922
H -7.039213 1.594492 -0.810859


