%chk=000252954.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252954

0 1
O -0.046657 0.402407 -2.792963
O 1.517902 3.287246 -0.016021
C 0.321367 -0.096173 0.546739
C 0.001349 1.441838 0.438636
C -0.525579 -0.728702 -0.596486
C -0.989620 1.534883 -0.751280
C -0.417302 0.403891 -1.663713
C -1.996952 -0.519921 -0.231604
C -2.268873 0.813695 -0.319771
C 1.820398 -0.191130 0.326437
C 1.355797 2.109648 0.160208
C 2.398077 1.020395 0.147587
C -2.871133 -1.638647 0.105154
C -3.510221 1.539037 -0.065708
C 2.457642 -1.513078 0.311747
C 3.814504 1.334696 -0.041581
C -4.203285 -1.661323 -0.344306
C -2.382615 -2.710404 0.873718
C -4.242519 1.293114 1.108950
C -3.974688 2.493439 -0.986783
C 2.336632 -2.372827 1.415518
C 3.179204 -1.925569 -0.820964
C 4.198553 2.364986 -0.918470
C 4.802408 0.618043 0.657080
C -5.032487 -2.738849 -0.025183
C -3.218838 -3.782588 1.192141
C -5.421898 1.998319 1.357942
C -5.157682 3.191449 -0.732564
C 2.934575 -3.635106 1.383076
C 3.768165 -3.191853 -0.847851
C -4.543730 -3.799758 0.743838
C -5.881452 2.947619 0.439132
C 5.550789 2.659376 -1.103807
C 6.152736 0.920793 0.468806
C 3.647392 -4.047199 0.252323
C 6.530267 1.938027 -0.413451
H 0.035651 -0.518520 1.530098
H -0.445646 1.858362 1.362356
H -0.229192 -1.737565 -0.901417
H -1.101599 2.535322 -1.183569
H -4.588036 -0.835573 -0.944086
H -1.351638 -2.705338 1.222901
H -3.888597 0.549078 1.822037
H -3.416913 2.685562 -1.902466
H 1.787940 -2.054499 2.299762
H 3.279700 -1.253791 -1.675163
H 3.436516 2.944956 -1.443180
H 4.515530 -0.173998 1.347615
H -6.062949 -2.751620 -0.378080
H -2.836768 -4.609063 1.789436
H -5.984898 1.807358 2.270467
H -5.515588 3.929217 -1.449618
H 2.845141 -4.299546 2.241328
H 4.324895 -3.511144 -1.728498
H -5.192296 -4.638136 0.991329
H -6.800822 3.496226 0.635849
H 5.841240 3.457031 -1.786034
H 6.912931 0.362328 1.012193
H 4.109406 -5.033002 0.228955
H 7.583067 2.170581 -0.559643


%chk=000252954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252954

0 1
O -0.099530 0.181385 -2.868199
O 1.504667 3.324794 -0.286945
C 0.321448 -0.055483 0.552711
C -0.000694 1.456778 0.337779
C -0.552433 -0.785274 -0.547199
C -1.025183 1.461084 -0.859679
C -0.464493 0.270671 -1.686068
C -2.037232 -0.577070 -0.211222
C -2.311667 0.781266 -0.365436
C 1.829707 -0.177557 0.321070
C 1.351615 2.104081 -0.009725
C 2.414737 1.050164 0.041485
C -2.917699 -1.715403 0.117102
C -3.525390 1.563702 -0.047801
C 2.463220 -1.515373 0.343015
C 3.847807 1.384635 -0.138053
C -4.302745 -1.723845 -0.222037
C -2.374456 -2.876612 0.739979
C -4.307398 1.273165 1.107875
C -3.911636 2.667814 -0.859810
C 2.020762 -2.506402 1.266131
C 3.481353 -1.867561 -0.589684
C 4.250639 2.316076 -1.134400
C 4.840419 0.826262 0.715570
C -5.111817 -2.838548 0.073100
C -3.186788 -3.990671 1.039657
C -5.440110 2.048271 1.428214
C -5.051013 3.437718 -0.542832
C 2.595685 -3.794772 1.277598
C 4.042195 -3.159962 -0.588549
C -4.561573 -3.976788 0.711122
C -5.821805 3.132854 0.602745
C 5.612838 2.653033 -1.291145
C 6.198723 1.170052 0.561913
C 3.608344 -4.128234 0.348729
C 6.592465 2.081486 -0.447197
H 0.032906 -0.416995 1.555714
H -0.440197 1.962936 1.213561
H -0.242342 -1.807947 -0.795543
H -1.122902 2.435763 -1.354128
H -4.736573 -0.859318 -0.733663
H -1.308269 -2.904689 0.994042
H -4.014974 0.443006 1.759525
H -3.329162 2.913629 -1.754973
H 1.243620 -2.258636 1.998813
H 3.814465 -1.128305 -1.324218
H 3.495569 2.775184 -1.778421
H 4.540694 0.130688 1.506898
H -6.171757 -2.825747 -0.204425
H -2.747537 -4.870180 1.523688
H -6.021761 1.811768 2.326309
H -5.334710 4.276555 -1.188037
H 2.254329 -4.537123 2.007510
H 4.815461 -3.414625 -1.321373
H -5.193159 -4.842874 0.937486
H -6.702041 3.735182 0.852987
H 5.907199 3.367672 -2.067691
H 6.948670 0.734109 1.231473
H 4.050388 -5.130640 0.350785
H 7.648422 2.348846 -0.567036


