%chk=000240717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240717

0 1
O -0.486425 -0.470787 -1.228027
O -0.131604 0.235629 2.766653
O 6.899809 -1.666489 -1.405484
O -6.417302 3.846439 0.585252
O -6.592147 1.816700 -0.332354
C 1.072709 -0.368378 0.796696
C 2.322094 -0.416525 1.682993
C -1.471106 0.010596 0.848905
C -3.890530 0.335609 1.039246
C -0.168535 -0.018764 1.576970
C -5.102162 0.621375 1.882964
C -2.619944 0.282589 1.615265
C 3.549062 -0.704623 0.865064
C -1.644278 -0.207921 -0.534797
C -4.028409 0.118298 -0.344181
C -5.483804 2.106576 1.856328
C -2.915853 -0.153094 -1.133641
C 3.899614 -2.035410 0.562829
C 4.348355 0.341601 0.390540
C 5.027022 -2.317908 -0.197960
C 5.490518 0.085394 -0.377259
C 5.815854 -1.244292 -0.662227
C -6.200249 2.484155 0.596282
C -0.572246 -0.705158 -2.657021
C 7.805369 -0.657069 -1.909782
H 0.928760 -1.340335 0.273588
H 1.210687 0.365311 -0.029913
H 2.188647 -1.178947 2.479456
H 2.424090 0.541249 2.236746
H -5.961074 0.003637 1.538345
H -4.923318 0.312228 2.934523
H -2.487642 0.454367 2.691287
H -5.023363 0.174827 -0.802539
H -4.577966 2.746295 1.974512
H -6.125024 2.361826 2.729491
H -3.042387 -0.317795 -2.199303
H 3.279980 -2.852847 0.931698
H 4.084062 1.373944 0.619581
H 5.315660 -3.337847 -0.439165
H 6.098247 0.909553 -0.732502
H 0.481404 -0.881174 -2.914132
H -1.178861 -1.592056 -2.860887
H -0.957186 0.183231 -3.165504
H -6.894232 4.154853 -0.230031
H 8.260215 -0.105654 -1.081910
H 7.285329 0.007063 -2.605629
H 8.553261 -1.267172 -2.432769


%chk=000240717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240717

0 1
O -0.636758 -0.640045 -1.431453
O -0.209072 0.194451 2.712140
O 7.084945 -1.623975 -1.338051
O -5.958791 4.113390 0.725823
O -6.653433 2.091552 -0.173321
C 1.073433 -0.378059 0.736418
C 2.313402 -0.341509 1.661087
C -1.554557 -0.071321 0.743202
C -4.009113 0.261196 1.011626
C -0.229067 -0.070380 1.468916
C -5.193948 0.609941 1.903514
C -2.699684 0.224577 1.532340
C 3.591316 -0.646163 0.893807
C -1.761389 -0.345695 -0.647804
C -4.178508 -0.017312 -0.369274
C -5.459682 2.134460 2.003224
C -3.072833 -0.317198 -1.188163
C 3.947841 -1.984519 0.569155
C 4.449422 0.387409 0.450048
C 5.107988 -2.278402 -0.169942
C 5.621735 0.116484 -0.295614
C 5.949701 -1.224967 -0.607598
C -6.076208 2.716309 0.744712
C -0.833618 -0.923000 -2.857794
C 7.992655 -0.571274 -1.794352
H 0.979461 -1.361632 0.236017
H 1.188238 0.333872 -0.104506
H 2.164985 -1.066588 2.482818
H 2.373131 0.652033 2.140845
H -6.110377 0.118245 1.530122
H -5.009712 0.232339 2.926037
H -2.510816 0.422307 2.594593
H -5.183973 0.011907 -0.803197
H -4.535721 2.692468 2.236580
H -6.166788 2.344783 2.831239
H -3.240740 -0.528416 -2.247900
H 3.309311 -2.809087 0.910660
H 4.203839 1.428608 0.693970
H 5.387333 -3.308267 -0.413615
H 6.260790 0.945346 -0.615506
H 0.176492 -1.116912 -3.246975
H -1.469801 -1.816228 -3.006050
H -1.276858 -0.054781 -3.381585
H -6.399766 4.468934 -0.093452
H 8.418736 -0.006958 -0.941461
H 7.483929 0.131628 -2.483504
H 8.797631 -1.096451 -2.329580


