%chk=000249114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249114

0 1
O 2.419824 2.131985 -1.792814
O -0.452317 1.379375 -1.579666
N 2.686824 0.228964 -0.507965
N -6.269291 -0.132995 0.017241
C 4.168186 0.229927 -0.400759
C 4.611149 0.440249 1.062564
C 4.756757 -1.075243 -0.975774
C 6.142826 0.467723 1.146327
C 6.288103 -1.041185 -0.886259
C 6.759693 -0.808130 0.556005
C 1.837606 -0.797379 0.160028
C 1.948820 1.194310 -1.192337
C 0.406698 -0.371268 -0.123595
C 0.444175 0.802661 -1.028489
C -0.642471 -0.991119 0.444154
C -2.067245 -0.716127 0.302095
C -2.912147 -0.967240 1.405118
C -2.650103 -0.240230 -0.886409
C -4.861928 -0.246443 0.137550
C -4.276661 -0.728876 1.337800
C -4.018125 -0.010187 -0.974196
C -7.050929 0.029300 1.272784
C -6.792306 0.725185 -1.080013
H 4.527993 1.100860 -1.021541
H 4.213417 -0.362309 1.709923
H 4.190259 1.387048 1.451203
H 4.438035 -1.201577 -2.027852
H 4.368525 -1.953274 -0.428267
H 6.457187 0.587095 2.200179
H 6.532331 1.355949 0.610928
H 6.685553 -0.244204 -1.545087
H 6.705964 -1.989974 -1.272102
H 7.863341 -0.740022 0.584338
H 6.490628 -1.679205 1.183402
H 2.050339 -0.829604 1.250258
H 2.047721 -1.805912 -0.258984
H -0.427776 -1.821248 1.138712
H -2.485169 -1.343553 2.335930
H -2.020792 -0.044249 -1.761030
H -4.896125 -0.927059 2.209138
H -4.429820 0.354163 -1.913330
H -8.128121 -0.039744 1.047533
H -6.862002 0.984990 1.787319
H -6.815946 -0.796315 1.967948
H -6.552001 1.793289 -0.955558
H -7.887427 0.616884 -1.144155
H -6.379753 0.384814 -2.047095


%chk=000249114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249114

0 1
O 2.707318 1.645318 -2.425784
O -0.239143 1.392838 -2.015858
N 2.777371 0.242827 -0.519375
N -6.359158 -0.002603 0.098531
C 4.246007 0.127473 -0.438553
C 4.792875 0.566031 0.943425
C 4.736700 -1.299251 -0.803674
C 6.339305 0.496350 0.966186
C 6.282799 -1.369253 -0.775732
C 6.846139 -0.917648 0.592908
C 1.848990 -0.435133 0.398966
C 2.140622 0.983989 -1.513520
C 0.455077 -0.037344 -0.099456
C 0.624199 0.830752 -1.273892
C -0.668286 -0.503717 0.570643
C -2.096480 -0.332124 0.384494
C -2.968502 -0.984307 1.317325
C -2.717593 0.436857 -0.654674
C -4.975836 -0.113036 0.193626
C -4.360184 -0.886014 1.236124
C -4.108677 0.541376 -0.746077
C -7.226961 -0.683387 1.071679
C -6.965457 0.793452 -0.981067
H 4.622651 0.830965 -1.208609
H 4.392255 -0.100976 1.735095
H 4.446071 1.592258 1.169094
H 4.353267 -1.572886 -1.804352
H 4.325788 -2.032642 -0.078674
H 6.712914 0.787401 1.966826
H 6.748060 1.233445 0.245053
H 6.690100 -0.713571 -1.572232
H 6.616312 -2.398875 -1.008346
H 7.952877 -0.932574 0.573139
H 6.529099 -1.638294 1.375497
H 2.015756 -0.104304 1.444056
H 1.994868 -1.534622 0.367163
H -0.430049 -1.145038 1.438214
H -2.528307 -1.582510 2.126110
H -2.078420 0.947805 -1.383159
H -4.973990 -1.405608 1.976831
H -4.531248 1.139737 -1.557982
H -8.280499 -0.472425 0.832426
H -7.035222 -0.333148 2.105428
H -7.084849 -1.782237 1.048450
H -6.643695 1.852397 -0.936416
H -8.061709 0.766499 -0.884296
H -6.699653 0.395857 -1.980358


