%chk=000271512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271512

0 1
O -0.740932 -1.556837 1.851867
O 0.740414 1.554454 1.853793
N -2.877531 -0.604002 0.529457
N 2.877113 0.603219 0.530422
N -1.664304 0.039230 0.449139
N 1.663902 -0.039925 0.449226
C -3.827273 -0.256185 -0.493750
C 3.826928 0.256654 -0.493137
C -0.631954 -0.392038 1.120859
C 0.631500 0.390530 1.121385
C 0.494383 -2.237115 2.270524
C -0.494939 2.234221 2.273173
C -3.756850 0.954201 -1.208589
C 3.756556 -0.952856 -1.209457
C -4.909793 -1.139097 -0.689133
C 4.909458 1.139807 -0.687363
C -4.774090 1.275915 -2.106710
C 4.773860 -1.273472 -2.107897
C -5.918460 -0.792157 -1.589072
C 5.918189 0.793969 -1.587653
C -5.856385 0.410044 -2.300301
C 5.856168 -0.407363 -2.300353
C -0.024197 -3.465546 2.987900
C 0.023579 3.461802 2.992050
H 1.054919 -1.552204 2.929486
H 1.081333 -2.472497 1.365156
H -1.081825 2.470678 1.368044
H -1.055515 1.548520 2.931276
H -2.861646 -1.603687 0.794621
H 2.861194 1.602582 0.796792
H -2.913579 1.628763 -1.061378
H 2.913275 -1.627597 -1.063129
H -4.971054 -2.076386 -0.142963
H 4.970676 2.076429 -0.140045
H -4.723048 2.211866 -2.662679
H 4.722859 -2.208743 -2.665013
H -6.759484 -1.468635 -1.738782
H 6.759222 1.470632 -1.736477
H -6.644531 0.670712 -3.001688
H 6.644365 -0.667173 -3.002002
H 0.799766 -4.047543 3.418771
H -0.708507 -3.192873 3.803900
H -0.584846 -4.123187 2.310361
H -0.800417 4.043249 3.423601
H 0.707871 3.188162 3.807742
H 0.584227 4.120281 2.315327


%chk=000271512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271512

0 1
O -0.540697 -1.819027 0.504269
O 0.540426 1.818439 0.506495
N -2.862381 -0.733075 0.070095
N 2.861865 0.732841 0.071234
N -1.784837 0.118834 0.084425
N 1.784269 -0.119032 0.084328
C -4.157709 -0.257954 -0.196757
C 4.157176 0.257981 -0.196137
C -0.600803 -0.420239 0.341645
C 0.600282 0.419850 0.342110
C 0.494224 -2.451847 1.372578
C -0.495092 2.450703 1.374459
C -4.405924 1.109692 -0.494804
C 4.405299 -1.109274 -0.496058
C -5.240960 -1.179943 -0.168609
C 5.240511 1.179825 -0.166557
C -5.723677 1.537380 -0.755098
C 5.723048 -1.536721 -0.756763
C -6.552245 -0.735003 -0.431805
C 6.551791 0.735128 -0.430185
C -6.806600 0.626043 -0.725472
C 6.806057 -0.625532 -0.725709
C 0.038814 -3.888546 1.611533
C -0.038321 3.886312 1.617286
H 0.564739 -1.879100 2.317993
H 1.463951 -2.396065 0.853340
H -1.464052 2.397219 0.853557
H -0.567936 1.876009 2.318504
H -2.697590 -1.733776 0.230795
H 2.697174 1.733308 0.233472
H -3.564487 1.806245 -0.531099
H 3.563797 -1.805691 -0.533458
H -5.053077 -2.237376 0.057717
H 5.052698 2.236960 0.061221
H -5.906314 2.592949 -0.987957
H 5.905618 -2.591983 -0.991063
H -7.378239 -1.454954 -0.407519
H 7.377851 1.454966 -0.404774
H -7.826487 0.967844 -0.930172
H 7.825942 -0.967150 -0.930731
H 0.790019 -4.419425 2.224731
H -0.929031 -3.921261 2.141859
H -0.066697 -4.426899 0.653796
H -0.789916 4.416768 2.230374
H 0.928675 3.916725 2.149295
H 0.069443 4.426655 0.660914


