%chk=000221789.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221789

0 1
O -2.290691 0.691867 -0.261266
O -2.268298 -1.617670 0.094118
C -4.420235 -0.463670 -0.018071
C -3.650784 0.856617 0.227361
C -3.618373 -1.623668 0.597257
C -1.559489 -0.388595 0.333976
C -4.179116 2.032096 -0.601484
C -5.839864 -0.400678 0.565565
C -0.265800 -0.501325 -0.466387
C 0.974732 -0.377867 0.421117
C -3.736008 3.382364 -0.024446
C 2.261503 -0.494171 -0.407474
C -6.708413 -1.573824 0.120586
C 3.509496 -0.370944 0.476951
C 4.796193 -0.487155 -0.351432
C -4.240114 4.549230 -0.869607
C 6.045186 -0.364010 0.531815
C 7.331462 -0.480289 -0.296801
C 8.581988 -0.357325 0.585254
C 9.865306 -0.472434 -0.234549
H -4.471567 -0.630800 -1.123116
H -3.596572 1.093632 1.311247
H -3.987772 -2.610437 0.265176
H -3.592342 -1.585599 1.699033
H -1.464248 -0.222479 1.422844
H -5.282848 1.985439 -0.670538
H -3.801342 1.929399 -1.641739
H -5.797812 -0.361883 1.671733
H -6.321151 0.550261 0.252507
H -0.266748 0.280302 -1.257703
H -0.267289 -1.470351 -1.012506
H 0.959859 -1.163495 1.202203
H 0.960809 0.591447 0.957367
H -2.627597 3.407389 0.030644
H -4.097051 3.489960 1.016429
H 2.276275 0.287793 -1.191438
H 2.275639 -1.461333 -0.946695
H -7.732937 -1.471507 0.497210
H -6.321788 -2.531962 0.485724
H -6.767521 -1.641976 -0.972439
H 3.495427 0.596054 1.015828
H 3.494831 -1.153237 1.260236
H 4.810679 -1.454031 -0.890621
H 4.811207 0.294633 -1.135223
H 6.030373 -1.146003 1.315297
H 6.030917 0.602883 1.070759
H -3.860637 4.495025 -1.896924
H -5.334054 4.568662 -0.924822
H -3.914424 5.508778 -0.452298
H 7.347717 0.300893 -1.080869
H 7.347169 -1.446639 -0.836444
H 8.568563 0.610235 1.124114
H 8.567971 -1.139915 1.368897
H 9.928469 -1.436506 -0.751868
H 9.928929 0.312430 -0.996762
H 10.751886 -0.383412 0.402974


%chk=000221789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221789

0 1
O -2.488893 1.224626 -0.498952
O -1.795220 -0.982406 0.165800
C -4.242527 -0.443887 0.083043
C -3.850543 1.062054 0.081462
C -3.112260 -1.251408 0.768585
C -1.493040 0.448766 0.232228
C -4.767934 1.971513 -0.748974
C -5.600761 -0.689933 0.791515
C -0.132929 0.686983 -0.411275
C 1.023653 0.004639 0.351122
C -4.374335 3.464466 -0.680073
C 2.394652 0.235876 -0.322073
C -6.043605 -2.171216 0.815480
C 3.562171 -0.444226 0.427443
C 4.935034 -0.219758 -0.245731
C -5.298038 4.356091 -1.536558
C 6.102728 -0.905913 0.498667
C 7.475536 -0.681529 -0.174830
C 8.642729 -1.373353 0.566076
C 10.009889 -1.143647 -0.114206
H -4.309700 -0.774894 -0.973141
H -3.817217 1.419444 1.140924
H -3.259033 -2.336656 0.655789
H -3.082399 -1.001619 1.855803
H -1.520421 0.758073 1.308958
H -5.811976 1.854998 -0.398259
H -4.736087 1.627275 -1.802180
H -5.545812 -0.304446 1.831531
H -6.385338 -0.099219 0.282482
H 0.028739 1.780550 -0.463047
H -0.183406 0.311425 -1.450472
H 0.816742 -1.080297 0.420024
H 1.059698 0.387384 1.393125
H -3.325887 3.570138 -1.013088
H -4.407001 3.801597 0.376792
H 2.591694 1.326279 -0.395670
H 2.358186 -0.144194 -1.364362
H -7.063683 -2.267155 1.229908
H -5.376121 -2.795761 1.435993
H -6.053064 -2.598200 -0.205121
H 3.599362 -0.065060 1.470374
H 3.363661 -1.533988 0.500404
H 4.896043 -0.594957 -1.289900
H 5.135038 0.870225 -0.315297
H 5.902682 -1.995947 0.567033
H 6.141848 -0.531756 1.543342
H -5.259967 4.057138 -2.601175
H -6.351388 4.279798 -1.204652
H -5.001450 5.419295 -1.475253
H 7.679147 0.408092 -0.239808
H 7.436438 -1.052302 -1.220662
H 8.680836 -1.003030 1.611047
H 8.438512 -2.461858 0.629996
H 10.005831 -1.531276 -1.150593
H 10.252153 -0.064999 -0.161837
H 10.826731 -1.649641 0.432944


