%chk=000228672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228672

0 1
O 2.500208 0.831754 0.659366
O 0.126601 2.773507 0.327947
O 2.576732 0.453546 -1.565182
C 2.641198 -1.430500 0.039400
C -3.939287 -1.059254 -0.682889
C 1.214856 -2.016428 0.051108
C 3.580007 -2.229780 -0.881907
C -4.137674 -2.029286 0.503053
C -2.822605 -0.070744 -0.416955
C 2.575073 0.010015 -0.438088
C 2.528910 2.291236 0.503512
C -5.244508 -0.313315 -0.994783
C 1.388523 2.820722 -0.379666
C 0.395405 -1.486847 1.221570
C 5.033835 -1.788654 -0.746609
C -1.705902 -0.034108 -1.262847
C -2.894667 0.828212 0.663409
C -2.952162 -2.972448 0.679911
C -0.775067 1.770886 0.022025
C 2.450086 2.775793 1.939982
C -0.671945 0.882565 -1.052950
C -1.880369 1.751148 0.895551
H 3.046686 -1.443362 1.085099
H -3.673697 -1.671498 -1.583377
H 1.273361 -3.121607 0.103845
H 0.702630 -1.787092 -0.906207
H 3.250971 -2.119664 -1.936957
H 3.492009 -3.308270 -0.643458
H -5.061210 -2.619051 0.341121
H -4.306907 -1.458651 1.436177
H 3.507453 2.525355 0.023154
H -5.618414 0.239788 -0.126704
H -5.096382 0.414491 -1.801564
H -6.032848 -1.003346 -1.312225
H 1.509697 3.907563 -0.558423
H 1.337093 2.290252 -1.351978
H 0.746019 -1.877717 2.181637
H 0.437440 -0.387982 1.283041
H -0.671399 -1.757179 1.115357
H 5.170949 -0.746976 -1.064148
H 5.690754 -2.403034 -1.374103
H 5.394779 -1.871962 0.284598
H -1.635462 -0.724784 -2.103124
H -3.758168 0.804003 1.328079
H -2.013677 -2.409771 0.843003
H -3.093520 -3.631566 1.542817
H -2.801461 -3.606544 -0.200085
H 2.750078 3.824735 2.030108
H 3.090665 2.172675 2.597200
H 1.420401 2.687636 2.325050
H 0.194497 0.900627 -1.716156
H -1.925284 2.454612 1.722264


%chk=000228672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228672

0 1
O 2.669249 0.846737 0.753132
O 0.116953 2.509374 0.575734
O 2.788273 0.357736 -1.522340
C 3.010600 -1.468053 0.141927
C -4.324034 -0.948077 -0.807706
C 1.629086 -2.199089 0.216190
C 3.990653 -2.208920 -0.805298
C -4.632140 -1.971894 0.325758
C -3.131235 -0.050564 -0.468330
C 2.818640 -0.028516 -0.326311
C 2.594337 2.321436 0.465068
C -5.586873 -0.111142 -1.144823
C 1.301068 2.728933 -0.264276
C 0.750254 -1.773079 1.409935
C 5.415003 -1.614390 -0.821859
C -1.948919 -0.073764 -1.244526
C -3.167726 0.838453 0.640909
C -3.483903 -2.967294 0.592901
C -0.904054 1.630835 0.155305
C 2.766961 2.995641 1.826912
C -0.835441 0.748565 -0.948822
C -2.076476 1.670043 0.950987
H 3.433124 -1.434017 1.164674
H -4.055534 -1.533111 -1.712475
H 1.840606 -3.284722 0.283626
H 1.084994 -2.043311 -0.736372
H 3.571287 -2.197242 -1.829425
H 4.033872 -3.267561 -0.482163
H -5.550429 -2.529865 0.051269
H -4.870166 -1.419422 1.257461
H 3.434114 2.560268 -0.219601
H -5.919716 0.477079 -0.268957
H -5.387417 0.597410 -1.968639
H -6.423818 -0.768964 -1.445985
H 1.353977 3.820615 -0.443994
H 1.228936 2.217344 -1.234947
H 1.259140 -1.983669 2.369328
H 0.516823 -0.695423 1.382003
H -0.207304 -2.325572 1.403534
H 5.409205 -0.579457 -1.208978
H 6.081819 -2.208717 -1.472671
H 5.856739 -1.601741 0.192691
H -1.885917 -0.753484 -2.103625
H -4.063669 0.888725 1.271822
H -2.562770 -2.436723 0.895206
H -3.749732 -3.677244 1.397619
H -3.250632 -3.556162 -0.314809
H 2.809875 4.092979 1.703679
H 3.699578 2.658219 2.308553
H 1.914809 2.751583 2.481682
H 0.059866 0.669787 -1.572872
H -2.107638 2.359129 1.800894


