%chk=000229370.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229370

0 1
O -0.198071 -1.516271 0.663723
O -0.019916 -0.023337 -2.624992
O 0.345561 -2.144354 -2.014653
O -2.191259 -2.118647 -0.260877
C 0.043820 -0.409631 -0.254130
C -1.027598 0.640964 -0.046303
C 1.447379 0.076975 0.082173
C 0.124832 -1.009979 -1.678414
C -0.879751 1.571953 0.994190
C 1.962218 1.177770 -0.621919
C -2.178927 0.674090 -0.846045
C 2.218664 -0.553105 1.064864
C -1.864286 2.537405 1.216472
C 3.244373 1.646430 -0.333803
C -3.160540 1.643621 -0.621917
C 3.503570 -0.077923 1.348638
C -3.004032 2.577341 0.406414
C 4.016162 1.019821 0.652481
C -1.347014 -2.296208 0.577602
C -1.274887 -3.307966 1.665101
H 0.004570 1.544028 1.632772
H 1.356391 1.658630 -1.394542
H -2.320241 -0.067415 -1.636676
H 1.816565 -1.413910 1.603696
H -1.743070 3.259018 2.022349
H 3.645180 2.500079 -0.878442
H -4.050782 1.664715 -1.248733
H 4.104439 -0.568763 2.112671
H -3.769509 3.332231 0.579245
H 5.016963 1.387525 0.874317
H 0.069450 -0.374054 -3.553841
H -0.441685 -3.125606 2.362704
H -1.134444 -4.316851 1.240413
H -2.210626 -3.323475 2.246360


%chk=000229370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229370

0 1
O -0.232159 -1.470682 0.829890
O 0.018175 -0.208031 -2.628954
O 0.509412 -2.291838 -1.738382
O -2.126865 -2.206441 -0.330615
C 0.027530 -0.401818 -0.193181
C -1.049582 0.684118 -0.059856
C 1.457451 0.108858 0.104215
C 0.167166 -1.106617 -1.570350
C -0.957261 1.574009 1.042431
C 1.888738 1.330623 -0.470748
C -2.168353 0.777039 -0.923175
C 2.363825 -0.661641 0.870074
C -1.953744 2.545731 1.270074
C 3.208765 1.784674 -0.265446
C -3.159518 1.757310 -0.701324
C 3.683136 -0.199996 1.078917
C -3.058682 2.645083 0.393363
C 4.110854 1.022483 0.513525
C -1.346353 -2.309568 0.637343
C -1.419537 -3.327383 1.751124
H -0.101813 1.503472 1.723156
H 1.193128 1.919281 -1.077770
H -2.271004 0.088015 -1.763513
H 2.030734 -1.608412 1.301501
H -1.867144 3.223211 2.126716
H 3.531552 2.731447 -0.712295
H -4.017133 1.820316 -1.380102
H 4.376543 -0.798748 1.679928
H -3.832618 3.401939 0.564101
H 5.135432 1.376171 0.674323
H 0.242462 -0.676262 -3.479049
H -1.230376 -2.853608 2.728017
H -0.642087 -4.096713 1.593263
H -2.407174 -3.810924 1.743697


