%chk=000270575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270575

0 1
O 2.383716 1.280865 0.472798
O -2.524809 4.062448 0.093983
O -4.563039 -1.929363 0.190272
O 2.279343 2.203015 -1.600159
O 2.705266 -2.741882 1.352902
C 3.873537 1.144044 0.505108
C -0.426361 0.475655 -0.343174
C -1.859205 0.464387 -0.134578
C 0.246487 1.677383 -0.381484
C -2.551128 1.701316 0.012865
C 0.291198 -0.810916 -0.508362
C -0.421928 2.925150 -0.239151
C -1.785516 2.914511 -0.050429
C 1.729363 1.757615 -0.618615
C 4.463677 2.547312 0.478428
C 4.051564 0.439876 1.846656
C 4.308479 0.286806 -0.673905
C -2.601373 -0.739335 -0.060491
C -3.960246 1.714115 0.218489
C -3.974304 -0.688254 0.142657
C 1.157527 -1.247301 0.492914
C -4.676256 0.542437 0.283299
C 0.107748 -1.580698 -1.674585
C 1.851548 -2.458521 0.304702
C 0.796863 -2.781724 -1.828029
C 1.680462 -3.240898 -0.841453
C -5.993097 -2.003435 0.407088
C 3.433923 -3.991476 1.309734
H 0.148180 3.847515 -0.294453
H 4.057280 3.170370 1.283021
H 5.552739 2.528473 0.584871
H 4.233798 3.053723 -0.472251
H 3.667790 -0.593335 1.812105
H 3.496208 0.953897 2.641602
H 5.104511 0.397599 2.138885
H 4.146011 0.805699 -1.631927
H 5.369445 0.027683 -0.612902
H 3.735342 -0.649400 -0.719621
H -2.103794 -1.705460 -0.154978
H -4.456289 2.683793 0.323886
H 1.324915 -0.654097 1.393913
H -5.749760 0.555300 0.439333
H -0.568029 -1.228678 -2.451184
H 0.652946 -3.376148 -2.730683
H 2.209288 -4.175939 -0.980395
H -1.962632 4.876793 0.032293
H -6.161780 -3.088915 0.399715
H -6.528552 -1.519348 -0.414385
H -6.253977 -1.574510 1.378651
H 3.991659 -3.960657 2.254553
H 4.112838 -4.005384 0.452518
H 2.739623 -4.836601 1.293554


%chk=000270575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270575

0 1
O 2.493527 1.196375 0.111966
O -2.789607 4.092583 -0.202393
O -4.373216 -2.128839 0.395333
O 2.143810 3.157655 -1.118353
O 1.483481 -3.418153 1.981511
C 4.021648 1.261215 0.044551
C -0.343945 0.581557 -0.203027
C -1.786138 0.492584 -0.032096
C 0.232183 1.859014 -0.367535
C -2.597423 1.694934 -0.015851
C 0.457198 -0.685837 -0.279989
C -0.578179 3.043353 -0.390822
C -1.952923 2.962798 -0.207429
C 1.704029 2.135461 -0.523082
C 4.504417 2.545609 0.747680
C 4.423487 -0.000408 0.826948
C 4.470123 1.181537 -1.428291
C -2.452778 -0.764274 0.102733
C -4.009031 1.596412 0.163333
C -3.842005 -0.834237 0.273560
C 0.632030 -1.499820 0.858981
C -4.634536 0.356773 0.312252
C 1.011848 -1.103319 -1.521398
C 1.369284 -2.705628 0.774737
C 1.739621 -2.307259 -1.600038
C 1.930865 -3.121242 -0.457872
C -5.820512 -2.261490 0.575637
C 2.221488 -4.681658 1.952993
H -0.071142 4.000732 -0.558293
H 4.097751 2.599821 1.773069
H 5.607948 2.530889 0.815690
H 4.195354 3.443055 0.189686
H 4.013041 -0.902522 0.342182
H 4.035095 0.044275 1.859013
H 5.524962 -0.082028 0.865217
H 4.164143 2.079220 -1.987637
H 5.571765 1.096762 -1.468935
H 4.036839 0.287868 -1.911196
H -1.886060 -1.697736 0.072538
H -4.595516 2.519200 0.175638
H 0.220981 -1.205292 1.829494
H -5.718940 0.308644 0.447465
H 0.863979 -0.485981 -2.413899
H 2.159544 -2.627062 -2.560700
H 2.495871 -4.054386 -0.542383
H -2.260940 4.915522 -0.349382
H -6.000471 -3.344487 0.643057
H -6.376595 -1.845712 -0.287170
H -6.159763 -1.770346 1.508492
H 2.179214 -5.061899 2.984325
H 3.277695 -4.527471 1.656052
H 1.747697 -5.411261 1.267238


