%chk=000259694.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259694

0 1
O -5.296139 1.164316 -0.076482
O -5.341857 -1.321133 -0.647095
O 5.769750 -0.174123 -0.230972
C -2.124219 -0.633111 0.499292
C -2.822787 0.682030 0.024032
C -0.714151 -0.754680 -0.091558
C 0.130287 0.456715 0.393779
C 1.552974 0.423522 -0.264381
C -2.038691 1.856569 0.627188
C -0.574026 1.811996 0.159687
C -4.257303 0.473188 0.605735
C -3.151650 -1.737037 0.198443
C -4.508591 -1.072079 0.497407
C -0.045083 -2.066603 0.360347
C 2.159786 -0.971269 -0.128779
C 2.439449 1.461363 0.478744
C -2.904011 0.809038 -1.502232
C 1.433509 -2.065919 0.136255
C 1.482988 0.752910 -1.767296
C 3.635904 -1.095446 -0.390489
C 3.919466 1.379022 0.103579
C 4.451066 -0.035924 0.362578
C 6.843887 0.364034 0.556392
H -2.010934 -0.581315 1.614011
H -0.765911 -0.744304 -1.205862
H 0.272256 0.337508 1.497071
H -2.086640 1.829236 1.731332
H -2.498472 2.818405 0.331684
H -0.532994 2.070305 -0.918981
H -0.008659 2.609375 0.679358
H -4.356631 0.847856 1.643659
H -3.116527 -2.060409 -0.860408
H -2.989379 -2.641736 0.801688
H -5.009230 -1.479831 1.394398
H -0.506975 -2.919349 -0.177480
H -0.241918 -2.251099 1.437740
H 2.330595 1.315064 1.571379
H 2.065802 2.481550 0.268540
H -3.363897 1.759452 -1.794865
H -1.909401 0.772965 -1.962682
H -3.491400 -0.009122 -1.941942
H 1.897275 -3.049140 0.212762
H 1.000002 1.719544 -1.947781
H 2.483774 0.796709 -2.211826
H 0.915601 -0.010201 -2.312126
H 4.018749 -2.102371 -0.129834
H 3.829390 -0.994446 -1.481992
H 4.071244 1.638168 -0.963173
H 4.502262 2.122853 0.675518
H 4.508449 -0.259920 1.447615
H -5.280122 0.941677 -1.039896
H -6.234790 -0.937402 -0.491978
H 7.728769 0.120889 -0.045129
H 6.893735 -0.128847 1.531597
H 6.738716 1.446960 0.664731


%chk=000259694-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259694

0 1
O -5.349799 1.289897 0.215621
O -5.512614 -1.292405 -0.561010
O 5.921144 -0.291404 -0.067411
C -2.137285 -0.613173 0.411425
C -2.865181 0.701483 -0.003450
C -0.718434 -0.757164 -0.171744
C 0.141821 0.477441 0.253331
C 1.594807 0.431631 -0.358191
C -2.033689 1.886363 0.536606
C -0.581323 1.832182 -0.009182
C -4.239542 0.476488 0.699949
C -3.183138 -1.724983 0.147341
C -4.534483 -1.071581 0.534051
C -0.047453 -2.061238 0.320887
C 2.197723 -0.980000 -0.209857
C 2.501459 1.431196 0.441233
C -3.089444 0.834989 -1.532697
C 1.450469 -2.071058 0.110543
C 1.591350 0.820318 -1.870517
C 3.696690 -1.115939 -0.453880
C 4.007388 1.332502 0.104212
C 4.521727 -0.098807 0.356058
C 6.894041 0.383554 0.788690
H -2.005764 -0.548474 1.518711
H -0.779266 -0.796704 -1.278942
H 0.267829 0.385187 1.357888
H -2.013573 1.839376 1.646489
H -2.501415 2.852245 0.263254
H -0.606278 2.039985 -1.094914
H 0.000590 2.654622 0.448837
H -4.151673 0.728979 1.773265
H -3.220417 -1.991647 -0.924906
H -2.989888 -2.651983 0.713783
H -4.943871 -1.485102 1.476151
H -0.498396 -2.935485 -0.191079
H -0.270076 -2.203169 1.402908
H 2.365603 1.234149 1.525514
H 2.157989 2.467145 0.258991
H -3.604585 1.789292 -1.745799
H -2.138841 0.838324 -2.091333
H -3.712343 0.017790 -1.937791
H 1.957336 -3.041439 0.223188
H 1.402744 1.900217 -2.011002
H 2.559121 0.591827 -2.349034
H 0.815349 0.258139 -2.420593
H 4.035112 -2.139177 -0.211645
H 3.942540 -0.945908 -1.522292
H 4.192123 1.591189 -0.956390
H 4.566526 2.064139 0.719030
H 4.437243 -0.329357 1.445242
H -5.656034 0.854505 -0.626351
H -6.424248 -1.329035 -0.176680
H 7.885633 0.043048 0.449390
H 6.756136 0.105068 1.856161
H 6.841854 1.488364 0.699240


