%chk=000250479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250479

0 1
O -2.152950 0.924928 -0.849078
O -1.452646 -0.054099 1.071690
N 0.549320 -2.391946 -1.322513
C 1.224192 0.873505 -0.200849
C 1.635377 0.194074 1.116852
C 2.424916 0.965423 -1.161609
C 2.785536 0.962343 1.779642
C 3.580272 1.731699 -0.501559
C 3.987003 1.091061 0.832805
C 0.040792 0.132842 -0.895833
C -1.231415 0.280097 -0.063719
C 0.317890 -1.278290 -1.122806
C -3.482774 1.182857 -0.290211
C -4.315511 -0.092738 -0.371555
C -5.772513 0.185453 -0.022886
H 0.871923 1.911469 0.027347
H 1.943952 -0.853461 0.931908
H 0.767012 0.131807 1.804966
H 2.133151 1.464848 -2.103403
H 2.766151 -0.050447 -1.443252
H 3.091276 0.444701 2.708807
H 2.440565 1.966805 2.091208
H 3.288380 2.786861 -0.337679
H 4.448718 1.758031 -1.186688
H 4.783359 1.690286 1.311846
H 4.425211 0.090765 0.648788
H -0.138263 0.623026 -1.901884
H -3.840530 1.983981 -0.961412
H -3.369724 1.555767 0.741989
H -4.236508 -0.528711 -1.388154
H -3.894908 -0.857526 0.316016
H -6.230714 0.902412 -0.714059
H -6.367979 -0.735436 -0.069559
H -5.879262 0.585611 0.992845


%chk=000250479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250479

0 1
O -1.900482 0.799404 -0.570032
O -1.576021 -1.167808 0.651337
N 1.164334 -2.812009 -1.153433
C 1.168874 0.653355 -0.316629
C 1.548076 0.264714 1.132999
C 2.432133 0.795996 -1.202462
C 2.543644 1.283774 1.737896
C 3.426864 1.814508 -0.595134
C 3.805417 1.434288 0.855870
C 0.143015 -0.356555 -0.966788
C -1.188841 -0.341774 -0.199705
C 0.691023 -1.722106 -1.058050
C -3.216118 1.016592 0.114096
C -4.344658 0.275429 -0.614812
C -5.710876 0.562555 0.047735
H 0.643897 1.631209 -0.298592
H 2.009970 -0.743435 1.129251
H 0.643240 0.195343 1.766442
H 2.144713 1.108656 -2.226421
H 2.929394 -0.191180 -1.292103
H 2.824868 0.966493 2.760161
H 2.046074 2.271448 1.835065
H 2.968248 2.825264 -0.600733
H 4.333414 1.871378 -1.227636
H 4.484073 2.196279 1.285045
H 4.361856 0.474542 0.848329
H -0.063812 0.005189 -1.992990
H -3.351767 2.110120 0.077010
H -3.129258 0.675682 1.161727
H -4.361719 0.590692 -1.674972
H -4.136773 -0.809858 -0.593252
H -5.952154 1.641921 0.027303
H -6.519123 0.027533 -0.480852
H -5.722226 0.230355 1.102331


