%chk=000225894.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225894

0 1
O 2.913121 1.400208 -0.183945
O -1.451502 -1.035917 -1.292158
O -1.617041 -2.814553 0.269567
O 3.085014 1.740098 2.043123
C -1.487149 2.612206 -0.119777
C -2.468185 1.657123 0.574161
C -0.171771 2.717155 0.663395
C -3.777967 1.525911 -0.214554
C 0.907379 3.444682 -0.148572
C -4.691866 0.456802 0.397324
C 2.243124 3.526559 0.601663
C 3.275087 -0.018121 -0.020598
C -6.000462 0.312418 -0.391746
C 1.985336 -0.800823 0.084079
C 2.776544 2.165570 0.954931
C 4.059395 -0.346387 -1.294952
C 0.897904 -0.437404 -0.753466
C 1.887823 -1.850837 0.996255
C -0.250263 -1.178787 -0.609104
C -0.349008 -2.252687 0.327347
C -6.851784 -0.796347 0.153426
C 0.703475 -2.612145 1.138107
C 5.496128 0.069706 -1.192386
C -2.352841 -2.052904 -0.743958
C -7.455161 -1.707379 -0.607428
C 6.511854 -0.685093 -1.604882
H -1.287055 2.249634 -1.147925
H -1.943289 3.613383 -0.233174
H -1.994066 0.659707 0.680446
H -2.677121 2.006926 1.602718
H -0.342832 3.235290 1.626065
H 0.183750 1.699886 0.930790
H -4.300448 2.500948 -0.244369
H -3.554264 1.270087 -1.269407
H 1.065246 2.923465 -1.116086
H 0.569480 4.468761 -0.400622
H -4.909537 0.702287 1.454508
H -4.159888 -0.523568 0.418261
H 2.130333 4.114623 1.538906
H 2.991228 4.067161 -0.016465
H 3.896741 -0.111536 0.901516
H -5.779066 0.155442 -1.466884
H -6.576103 1.262005 -0.349080
H 3.961343 -1.428835 -1.521823
H 3.591452 0.179651 -2.159415
H 0.980744 0.394812 -1.449548
H 2.737139 -2.100635 1.634123
H -6.956902 -0.801002 1.240484
H 0.634360 -3.426888 1.852968
H 5.650710 1.062372 -0.762561
H -2.621251 -2.740432 -1.555354
H -3.186020 -1.524023 -0.234667
H -8.078547 -2.493095 -0.206483
H -7.380275 -1.740628 -1.683954
H 7.543785 -0.370405 -1.542755
H 6.399372 -1.669348 -2.034965


%chk=000225894-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225894

0 1
O 2.980815 1.353767 -0.148392
O -1.353446 -1.587062 -1.306324
O -1.399190 -3.234803 0.443979
O 3.111600 1.389717 2.182733
C -1.444684 2.609309 -0.019904
C -2.546310 1.716364 0.593580
C -0.153641 2.641190 0.828049
C -3.807414 1.605452 -0.291737
C 0.980724 3.456478 0.168247
C -4.887050 0.675943 0.305197
C 2.318900 3.388802 0.952777
C 3.353876 -0.109873 -0.148930
C -6.147137 0.552458 -0.592960
C 2.104314 -0.951899 0.051024
C 2.838177 1.967109 1.106596
C 4.054765 -0.346208 -1.505913
C 0.983900 -0.777592 -0.817604
C 2.060846 -1.911829 1.090016
C -0.127492 -1.587080 -0.592489
C -0.158069 -2.552576 0.437584
C -7.202146 -0.358459 -0.001796
C 0.923973 -2.740446 1.299335
C 5.331465 0.452727 -1.661847
C -2.195245 -2.630338 -0.658837
C -7.725406 -1.455208 -0.606571
C 6.549195 -0.079490 -1.933446
H -1.200178 2.231995 -1.035089
H -1.831911 3.641170 -0.154190
H -2.130789 0.700690 0.761188
H -2.827413 2.107307 1.593761
H -0.374472 3.053615 1.834185
H 0.189080 1.598724 0.987158
H -4.239842 2.615886 -0.449820
H -3.514567 1.229318 -1.293846
H 1.152824 3.083713 -0.859205
H 0.678616 4.519026 0.081037
H -5.184995 1.047875 1.307406
H -4.458760 -0.335019 0.467526
H 2.203637 3.803330 1.969092
H 3.085885 3.987080 0.423915
H 4.057485 -0.274802 0.686629
H -5.855595 0.188162 -1.597645
H -6.572889 1.569041 -0.734058
H 4.263155 -1.428306 -1.599947
H 3.341823 -0.081668 -2.312965
H 0.988272 -0.022225 -1.608069
H 2.918055 -2.007136 1.764543
H -7.551206 -0.090620 1.008984
H 0.890111 -3.478332 2.104346
H 5.227059 1.540838 -1.543211
H -2.432348 -3.411970 -1.400576
H -3.095500 -2.153151 -0.233338
H -8.486304 -2.074979 -0.118642
H -7.409770 -1.760581 -1.612520
H 7.439492 0.550372 -2.040639
H 6.691928 -1.160706 -2.057277


