%chk=000250790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250790

0 1
O 4.104496 -0.174788 0.767620
O -3.880277 -2.543330 -0.019061
O 6.038879 0.932223 0.893031
C -3.598946 -0.187952 -0.063778
C -2.626700 0.896697 0.447006
C -4.495675 0.422208 -1.159380
C -5.096279 0.033048 0.172357
C -1.201049 0.635582 -0.128345
C -0.726657 -0.805395 0.206692
C -3.191809 2.232263 -0.144058
C -4.099389 1.879346 -1.341674
C 0.705245 -0.978751 -0.320754
C 1.682254 0.035245 0.354147
C -3.122698 -1.603046 -0.144585
C -1.660094 -1.835796 -0.443106
C -0.200912 1.707874 0.356905
C 1.253775 1.449888 -0.067146
C 3.048925 -0.492795 -0.203968
C -2.632784 0.925550 1.978420
C 1.395224 -2.344054 -0.141398
C 2.906496 -2.033545 -0.211601
C 1.719737 -0.065411 1.884678
C 3.521711 0.107909 -1.549704
C 4.831268 0.840585 -1.256846
C 5.117060 0.585836 0.205639
H -4.764412 -0.127063 -2.059489
H -5.425579 0.793527 0.874672
H -5.731798 -0.853942 0.231290
H -1.274260 0.717262 -1.241820
H -0.743080 -0.953818 1.313106
H -2.382348 2.917103 -0.444426
H -3.771488 2.772511 0.624066
H -4.986691 2.534516 -1.381446
H -3.563611 2.016008 -2.297447
H 0.684464 -0.759681 -1.419672
H -1.380907 -2.861247 -0.120597
H -1.535426 -1.839419 -1.546670
H -0.242483 1.782172 1.463809
H -0.521581 2.698774 -0.022481
H 1.362479 1.580453 -1.161947
H 1.916806 2.205040 0.396053
H -2.024809 1.746149 2.374321
H -3.647825 1.045266 2.375026
H -2.239333 -0.009561 2.395953
H 1.091154 -3.060858 -0.919811
H 1.130686 -2.805240 0.825764
H 3.443013 -2.452910 0.662000
H 3.374834 -2.488150 -1.097605
H 1.911883 -1.088985 2.224929
H 2.533239 0.552733 2.292130
H 0.783155 0.267884 2.342486
H 2.760131 0.790986 -1.973638
H 3.664633 -0.681930 -2.308725
H 4.762839 1.928219 -1.450506
H 5.670314 0.478507 -1.881618


%chk=000250790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250790

0 1
O 4.292470 -0.204233 0.564854
O -4.004086 -2.515410 -0.246784
O 6.010439 1.350739 0.421042
C -3.584352 -0.137400 -0.079145
C -2.627467 0.944043 0.494019
C -4.340511 0.475138 -1.316997
C -5.092210 0.153971 -0.032219
C -1.157597 0.646567 0.010167
C -0.723820 -0.825625 0.307480
C -3.174447 2.274358 -0.145379
C -3.812718 1.895990 -1.511673
C 0.721787 -1.041025 -0.189432
C 1.758868 -0.056504 0.435101
C -3.164634 -1.568255 -0.193071
C -1.672490 -1.840601 -0.370807
C -0.121785 1.663828 0.569339
C 1.330715 1.391363 0.091980
C 3.075926 -0.608295 -0.231377
C -2.729024 1.006308 2.040822
C 1.377506 -2.437525 -0.014805
C 2.912155 -2.157904 -0.143684
C 1.886491 -0.214691 1.977269
C 3.398442 -0.073119 -1.661354
C 4.337330 1.127889 -1.430457
C 5.006301 0.824076 -0.085260
H -4.527612 -0.157207 -2.190755
H -5.447881 0.976382 0.596005
H -5.729933 -0.734483 -0.041680
H -1.158064 0.751595 -1.100695
H -0.755928 -0.998769 1.402323
H -2.385946 3.039279 -0.251598
H -3.942332 2.708713 0.521418
H -4.609161 2.606175 -1.804338
H -3.054883 1.900880 -2.318499
H 0.698331 -0.826930 -1.284618
H -1.471284 -2.874625 -0.039240
H -1.487425 -1.822390 -1.468559
H -0.148110 1.652433 1.674287
H -0.404525 2.689907 0.266252
H 1.374364 1.554727 -1.004342
H 2.013231 2.126260 0.563222
H -2.229707 1.904261 2.446985
H -3.789115 1.046792 2.349099
H -2.281898 0.119816 2.526093
H 1.025356 -3.161029 -0.770046
H 1.134264 -2.859952 0.977873
H 3.468235 -2.524247 0.736290
H 3.349411 -2.651252 -1.029139
H 2.193563 -1.232895 2.268917
H 2.656163 0.475298 2.362459
H 0.936176 0.008621 2.489390
H 2.489114 0.186012 -2.227573
H 3.931462 -0.857669 -2.227295
H 3.790043 2.083349 -1.335622
H 5.106600 1.260967 -2.207447


