%chk=000273437.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273437

0 1
O 1.905632 -1.771048 -1.007918
O 2.541083 -1.364844 1.203470
O -1.713205 1.740920 0.948932
O -0.270947 2.675429 -1.974548
O -3.669169 0.089717 0.260107
O 2.094070 1.793101 2.531435
O 2.928825 2.782939 -1.529905
O -2.951453 -0.327057 2.376695
C 1.487418 0.438024 -0.035731
C 1.080774 -0.589549 -1.126437
C 0.475827 1.588903 0.059257
C 1.653415 -0.244265 1.335607
C -0.392586 -0.985343 -1.069195
C 2.126476 -2.389683 0.270016
C 1.428760 -0.092786 -2.531105
C -1.331326 -0.193351 -0.375210
C -0.955756 1.084201 0.263508
C 0.575931 2.514457 -1.136362
C -0.799735 -2.138016 -1.744825
C 2.389338 0.633371 2.359490
C 0.908322 -3.131139 0.786811
C 3.376758 -3.230704 0.066743
C -2.668189 -0.643013 -0.354661
C -2.144301 -2.534013 -1.738669
C -3.090539 -1.796121 -1.033738
C 1.898590 3.315435 -1.204892
C -3.619229 0.359668 1.654345
C -4.556004 1.473465 1.920845
H 2.496963 0.844737 -0.330501
H 0.730204 2.203769 0.986711
H 0.678733 -0.590922 1.756242
H 1.636443 -0.945733 -3.195466
H 0.613014 0.487011 -2.981842
H 2.336351 0.529166 -2.537917
H -0.054319 -2.734063 -2.276703
H 3.189174 0.117548 2.913821
H 0.060813 -2.469564 1.008474
H 0.552251 -3.866209 0.053473
H 1.142110 -3.667847 1.715846
H 3.167543 -4.304553 0.077429
H 3.851114 -2.987614 -0.898373
H 4.119698 -3.014638 0.849790
H -2.447896 -3.430502 -2.282727
H -4.139470 -2.086834 -0.999864
H 1.802095 4.381426 -0.949445
H -5.024853 1.380652 2.911408
H -5.346848 1.557363 1.157420
H -3.995001 2.430811 1.897254


%chk=000273437-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273437

0 1
O 1.939625 -1.846466 -1.023182
O 2.565522 -1.363265 1.260885
O -1.714801 1.916125 0.815763
O -0.298965 2.844005 -2.030619
O -3.709999 0.106647 0.292648
O 1.877970 1.838340 2.679035
O 2.909429 3.297587 -0.585126
O -2.758760 -0.387920 2.381072
C 1.533703 0.445653 -0.097988
C 1.117526 -0.602098 -1.176350
C 0.518804 1.626768 -0.032881
C 1.664964 -0.208397 1.315266
C -0.384256 -0.941117 -1.138955
C 2.122585 -2.421532 0.329643
C 1.515123 -0.139028 -2.596923
C -1.335864 -0.141443 -0.428265
C -0.929280 1.158573 0.175937
C 0.617723 2.603574 -1.201899
C -0.812594 -2.080169 -1.857499
C 2.322307 0.716256 2.344809
C 0.867270 -3.134371 0.872261
C 3.319535 -3.359988 0.189315
C -2.697434 -0.588050 -0.407886
C -2.171288 -2.451483 -1.878891
C -3.117187 -1.712792 -1.136742
C 1.919239 3.419465 -1.339914
C -3.576049 0.268679 1.715945
C -4.573626 1.282565 2.198750
H 2.534280 0.825810 -0.367762
H 0.786227 2.226273 0.867379
H 0.658172 -0.495336 1.692795
H 1.402864 -0.987091 -3.293161
H 0.874244 0.680184 -2.960173
H 2.573219 0.174787 -2.610993
H -0.063700 -2.685763 -2.376287
H 3.256735 0.290014 2.782135
H 0.009939 -2.459685 1.024486
H 0.553383 -3.923851 0.169106
H 1.115462 -3.600928 1.841238
H 3.084458 -4.172099 -0.518308
H 4.186167 -2.795016 -0.188212
H 3.572094 -3.796481 1.169850
H -2.493453 -3.328851 -2.449416
H -4.172925 -1.996270 -1.103510
H 1.883612 4.142047 -2.191027
H -4.712603 1.190025 3.285616
H -5.534944 1.175580 1.671431
H -4.167558 2.283232 1.965701


