%chk=000221942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221942

0 1
O 2.716921 -0.168890 0.097566
O 1.553778 1.626559 -0.629796
C -3.395976 -0.357144 -0.011494
C -4.472616 -1.262818 0.623788
C -3.851019 1.115752 0.031743
C -2.048566 -0.549442 0.715249
C -5.826364 -1.084766 -0.077476
C -5.203408 1.296965 -0.670602
C -6.275409 0.383142 -0.060426
C 3.966018 0.356232 -0.479072
C -0.884060 0.076986 -0.059386
C 4.774527 -0.895942 -0.848533
C 4.724736 1.114212 0.619502
C 6.083600 -0.835611 -0.041972
C 6.160696 0.568122 0.590057
C 0.449008 -0.146516 0.663938
C 1.567176 0.573367 -0.036289
H -3.273191 -0.657447 -1.080733
H -4.159615 -2.321251 0.568517
H -4.575927 -1.027280 1.699611
H -3.925454 1.456858 1.081271
H -3.090293 1.761258 -0.445719
H -2.105449 -0.117861 1.732673
H -1.859130 -1.630999 0.859724
H -6.588918 -1.718002 0.412599
H -5.756743 -1.442096 -1.122809
H -5.097196 1.080287 -1.750839
H -5.523727 2.353065 -0.600832
H -7.226205 0.494044 -0.613340
H -6.485686 0.697404 0.979748
H 3.701430 0.990913 -1.347845
H 4.968225 -0.932257 -1.933147
H 4.195098 -1.807519 -0.605123
H 4.250090 0.925334 1.601076
H 4.691092 2.204403 0.462889
H -1.054005 1.166318 -0.197620
H -0.833044 -0.347207 -1.081868
H 6.958993 -1.034959 -0.680948
H 6.086526 -1.612019 0.743448
H 6.598793 0.531392 1.600604
H 6.813297 1.227601 -0.009017
H 0.679571 -1.230582 0.747287
H 0.394026 0.223592 1.711097


%chk=000221942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221942

0 1
O 2.848414 -0.263502 -0.194457
O 1.598484 1.657886 -0.632521
C -3.405057 -0.390521 0.004521
C -4.472020 -1.247090 0.736756
C -3.842937 1.098190 -0.016328
C -2.005714 -0.594153 0.639360
C -5.882833 -1.072815 0.126588
C -5.253753 1.280439 -0.626420
C -6.305285 0.415539 0.107815
C 4.079432 0.415983 -0.745433
C -0.850631 0.087425 -0.127663
C 5.078758 -0.714231 -1.042184
C 4.746197 1.292131 0.352347
C 5.761178 -0.970767 0.324478
C 5.949103 0.459338 0.905837
C 0.531139 -0.299645 0.442854
C 1.670450 0.488250 -0.184934
H -3.355899 -0.743029 -1.051032
H -4.175588 -2.315260 0.711768
H -4.497542 -0.948203 1.806780
H -3.841970 1.482623 1.026644
H -3.111793 1.706817 -0.581997
H -2.024399 -0.220461 1.685839
H -1.804089 -1.684906 0.702548
H -6.620491 -1.674460 0.693067
H -5.881088 -1.462771 -0.912735
H -5.227115 0.988536 -1.697191
H -5.545227 2.348549 -0.594403
H -7.297784 0.527822 -0.370826
H -6.408893 0.777382 1.152261
H 3.758651 0.998136 -1.625675
H 5.822251 -0.345272 -1.775962
H 4.581367 -1.599889 -1.471904
H 4.008114 1.531492 1.136668
H 5.077133 2.255020 -0.075408
H -0.949984 1.187165 -0.093358
H -0.897717 -0.198060 -1.197893
H 6.712384 -1.524109 0.233921
H 5.083140 -1.561363 0.968084
H 5.984902 0.459914 2.009234
H 6.904242 0.886790 0.546680
H 0.733734 -1.379180 0.328218
H 0.550334 -0.092544 1.533559


