%chk=000243893.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243893

0 1
O -5.047496 4.567425 -1.159796
O 5.532260 3.882598 -0.320882
O 5.668491 -3.682930 0.338241
O -4.881791 -4.751808 1.142068
O -5.369061 3.954701 0.891489
O 4.683154 4.534702 1.560672
O 4.850154 -4.364619 -1.546458
O -5.219023 -4.150514 -0.910083
N -4.751280 3.936564 -0.159547
N 4.654002 3.892690 0.524397
N 4.794116 -3.724537 -0.510095
N -4.605585 -4.110276 0.142880
C -0.016541 0.620026 -0.466890
C 0.004470 -0.623906 0.465725
C -1.271181 1.465475 -0.348515
C 1.201770 1.487089 -0.195350
C 1.254386 -1.446094 0.198266
C -1.218231 -1.514344 0.343232
C -2.035784 1.517019 0.826838
C 1.280120 2.275900 0.963732
C 1.364956 -2.231829 -0.960297
C -1.976570 -1.593584 -0.834649
C -1.654065 2.234978 -1.462445
C 2.261113 1.489914 -1.117369
C 2.310277 -1.410100 1.123507
C -1.576586 -2.297323 1.455925
C -3.174605 2.320528 0.893041
C 2.404613 3.064445 1.203020
C 2.518137 -2.978937 -1.195870
C -3.085211 -2.437932 -0.904568
C -2.787476 3.043352 -1.407210
C 3.391426 2.274023 -0.887812
C 3.469112 -2.152589 0.897679
C -2.679689 -3.146353 1.396992
C -3.544398 3.080371 -0.225732
C 3.456308 3.057151 0.274254
C 3.566033 -2.933108 -0.263886
C -3.430847 -3.210786 0.213026
H 0.040117 0.239870 -1.525742
H 0.043770 -0.242020 1.524739
H -1.756773 0.924674 1.698646
H 0.455431 2.289092 1.677739
H 0.543462 -2.275207 -1.676790
H -1.716367 -0.991456 -1.705573
H -1.059704 2.212414 -2.377103
H 2.211737 0.875717 -2.017513
H 2.235831 -0.797895 2.023282
H -0.986481 -2.253237 2.372555
H -3.781137 2.364663 1.805871
H 2.476396 3.688493 2.102042
H 2.615391 -3.600172 -2.094445
H -3.686729 -2.504029 -1.819388
H -3.093787 3.648036 -2.269543
H 4.225239 2.285585 -1.600394
H 4.300579 -2.133593 1.612837
H -2.966653 -3.761820 2.258349


%chk=000243893-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243893

0 1
O -5.061315 4.751080 -1.186680
O 5.641788 3.851091 -0.411122
O 5.785701 -3.629815 0.422979
O -4.893712 -4.937223 1.163258
O -5.393570 4.126667 0.982995
O 4.786050 4.518517 1.596270
O 4.953475 -4.346894 -1.577157
O -5.244498 -4.317244 -1.004767
N -4.747573 4.074958 -0.133116
N 4.719871 3.854145 0.491526
N 4.862489 -3.677724 -0.477099
N -4.602580 -4.246537 0.112652
C -0.050095 0.627167 -0.467961
C -0.030484 -0.636491 0.468806
C -1.319737 1.482469 -0.352131
C 1.196937 1.493987 -0.219665
C 1.248250 -1.457792 0.225409
C -1.269064 -1.534933 0.346838
C -2.080483 1.576381 0.842099
C 1.319244 2.269521 0.963717
C 1.399224 -2.236181 -0.952721
C -2.024496 -1.650868 -0.848766
C -1.714584 2.260640 -1.472646
C 2.251753 1.517291 -1.166576
C 2.304720 -1.431797 1.170446
C -1.637571 -2.331243 1.463633
C -3.203675 2.421663 0.922794
C 2.469756 3.041756 1.207036
C 2.579637 -2.963006 -1.193069
C -3.116985 -2.535140 -0.934494
C -2.834044 3.110617 -1.415743
C 3.410139 2.288286 -0.946117
C 3.492833 -2.156966 0.952961
C -2.726231 -3.220007 1.401787
C -3.564364 3.180029 -0.210016
C 3.502490 3.038571 0.244368
C 3.613173 -2.910988 -0.232698
C -3.452129 -3.310300 0.194771
H 0.016104 0.264435 -1.512540
H 0.018240 -0.272692 1.513994
H -1.814980 0.976108 1.717870
H 0.502358 2.289690 1.692984
H 0.582093 -2.293608 -1.679643
H -1.779258 -1.038205 -1.721821
H -1.131264 2.205495 -2.399300
H 2.170249 0.921594 -2.082661
H 2.200792 -0.832771 2.082027
H -1.057438 -2.259601 2.391159
H -3.801636 2.501639 1.834440
H 2.580885 3.647195 2.110429
H 2.713542 -3.569681 -2.092539
H -3.710464 -2.632580 -1.847365
H -3.148663 3.713580 -2.271460
H 4.232289 2.316589 -1.665960
H 4.316919 -2.147133 1.671058
H -3.020307 -3.837245 2.254625


