%chk=000243634.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243634

0 1
O -0.000649 1.431241 -0.006267
O 0.000458 -1.431314 0.006652
C 1.186690 0.672848 -0.002809
C -1.187400 0.671929 -0.002803
C 1.187209 -0.672003 0.002959
C -1.186879 -0.672921 0.002968
C 2.348462 1.578237 -0.006582
C -2.349869 1.576419 -0.006560
C 2.349676 -1.576495 0.006489
C -2.348648 -1.578312 0.006519
C 2.900074 2.000645 -1.225482
C -2.896898 2.014564 1.208875
C 2.902507 -1.997646 1.225272
C -2.894982 -2.017059 -1.209015
C 2.895517 2.016354 1.208857
C -2.902167 1.997949 -1.225456
C 2.896171 -2.015022 -1.209051
C -2.900975 -2.000091 1.225312
C 4.007014 2.853604 -1.223794
C -4.004494 2.866604 1.200351
C 4.010095 -2.849761 1.223351
C -4.001917 -2.869955 -1.200691
C 4.002453 2.869244 1.200321
C -4.009757 2.850058 -1.223756
C 4.003764 -2.867064 -1.200748
C -4.007905 -2.853062 1.223412
C 4.558848 3.286484 -0.013447
C -4.561565 3.282966 -0.013403
C 4.561368 -3.283049 0.012894
C -4.559021 -3.286573 0.012964
H 2.462579 1.666793 -2.165188
H -2.455282 1.693583 2.151128
H 2.465458 -1.663481 2.165070
H -2.453336 -1.695872 -2.151183
H 2.454420 1.694682 2.151119
H -2.464701 1.664078 -2.165166
H 2.454138 -1.694332 -2.151208
H -2.464044 -1.665746 2.165103
H 4.438742 3.182844 -2.167467
H -4.432663 3.208052 2.141303
H 4.442768 -3.178025 2.166932
H -4.429548 -3.211876 -2.141715
H 4.430642 3.210674 2.141270
H -4.442020 3.178618 -2.167421
H 4.431521 -3.208810 -2.141778
H -4.440186 -3.181816 2.167002
H 5.421415 3.950705 -0.016107
H -5.424642 3.946526 -0.016058
H 5.424444 -3.946612 0.015375
H -5.421584 -3.950802 0.015459


%chk=000243634-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243634

0 1
O -0.000503 1.041241 1.228258
O 0.001065 -1.560292 0.380040
C 1.213461 0.511603 0.645539
C -1.214252 0.509755 0.646516
C 1.226401 -0.814422 0.298223
C -1.225576 -0.816426 0.299585
C 2.260875 1.541227 0.502515
C -2.262955 1.538105 0.503919
C 2.359837 -1.671822 -0.102545
C -2.358092 -1.675881 -0.099277
C 3.202052 1.518134 -0.565313
C -2.303215 2.621038 1.426636
C 3.646075 -1.514212 0.486340
C -2.158611 -2.731893 -1.030748
C 2.300810 2.623681 1.425794
C -3.205053 1.513434 -0.563064
C 2.161618 -2.726066 -1.036239
C -3.644512 -1.518757 0.489366
C 4.175520 2.530217 -0.682410
C -3.280941 3.630828 1.305550
C 4.709133 -2.363938 0.121620
C -3.223080 -3.585206 -1.389639
C 3.277387 3.634549 1.304430
C -4.179662 2.524441 -0.679885
C 3.227129 -3.577358 -1.396875
C -4.706509 -2.370553 0.126417
C 4.223429 3.590804 0.254213
C -4.227847 3.585512 0.256184
C 4.507741 -3.397481 -0.824830
C -4.503916 -3.405744 -0.817978
H 3.162307 0.715645 -1.308012
H -1.562036 2.660979 2.230375
H 3.805631 -0.732477 1.235474
H -1.165267 -2.879131 -1.464921
H 1.560314 2.662384 2.230229
H -3.165148 0.710549 -1.305333
H 1.168520 -2.873460 -1.470964
H -3.805116 -0.735823 1.237014
H 4.888967 2.500015 -1.513503
H -3.301454 4.454417 2.027929
H 5.692150 -2.229889 0.586455
H -3.053122 -4.391078 -2.112315
H 3.297676 4.457753 2.027254
H -4.893795 2.493045 -1.510342
H 3.058198 -4.381909 -2.121261
H -5.689648 -2.236798 0.591081
H 4.979749 4.377790 0.158609
H -4.985058 4.371666 0.160774
H 5.334810 -4.060184 -1.102649
H -5.330184 -4.070010 -1.094434


