%chk=000227649.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227649

0 1
O -4.329165 0.989435 0.140338
C 2.355193 0.484503 -0.228024
C 3.008444 -0.905971 -0.048028
C 0.822931 -2.156972 -0.242657
C 0.825687 0.412646 -0.119933
C 0.124843 -0.817604 -0.152236
C 2.250482 -2.001458 -0.796139
C 2.889881 1.438912 0.878068
C -1.267511 -0.776055 -0.091641
C 2.684974 1.038605 -1.628177
C -1.973650 0.446095 0.004927
C 0.115836 1.618200 -0.031926
C -2.222488 -1.945420 -0.118607
C 0.826585 -2.846496 1.130048
C -1.288955 1.661848 0.036530
C -3.630616 -1.328810 -0.015268
C -3.429593 0.186552 0.056602
C 4.409302 1.567351 0.921281
C -1.998574 2.966674 0.135240
H 3.052725 -1.158831 1.029986
H 4.058761 -0.870791 -0.392679
H 0.253314 -2.806285 -0.957745
H 2.204726 -1.763028 -1.876637
H 2.795050 -2.960685 -0.720024
H 2.518011 1.090769 1.862126
H 2.449296 2.447001 0.733685
H 2.265994 0.400678 -2.414658
H 2.278188 2.044887 -1.773194
H 3.766433 1.095991 -1.788949
H 0.664207 2.560862 -0.016963
H -2.105529 -2.533210 -1.047936
H -2.019751 -2.641427 0.717925
H -0.191812 -2.990663 1.508346
H 1.309170 -3.827517 1.083468
H 1.364677 -2.246999 1.874309
H -4.177834 -1.682293 0.875898
H -4.265753 -1.587952 -0.880138
H 4.894711 0.628401 1.209127
H 4.818986 1.866211 -0.050718
H 4.714405 2.326418 1.651533
H -3.097831 2.841266 0.181580
H -1.704271 3.521089 1.036709
H -1.788776 3.608673 -0.731051


%chk=000227649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227649

0 1
O -4.395815 1.043228 0.126882
C 2.364763 0.491087 -0.255915
C 3.028604 -0.915622 -0.145935
C 0.828234 -2.186464 -0.173182
C 0.821282 0.405515 -0.119895
C 0.113728 -0.836257 -0.106100
C 2.217020 -2.028279 -0.835466
C 2.937087 1.408486 0.884028
C -1.301578 -0.788536 -0.043177
C 2.686298 1.102586 -1.655275
C -2.006861 0.438282 0.020653
C 0.084215 1.626160 -0.061029
C -2.266739 -1.974305 -0.066367
C 0.932108 -2.849352 1.231156
C -1.321826 1.687250 0.017910
C -3.682989 -1.340086 -0.006105
C -3.467655 0.187556 0.058567
C 4.475694 1.546609 0.922473
C -2.055576 3.010278 0.084038
H 3.162373 -1.174818 0.923129
H 4.044050 -0.867121 -0.581720
H 0.218515 -2.865323 -0.804636
H 2.089548 -1.791692 -1.910514
H 2.767663 -2.987487 -0.780411
H 2.585716 1.004037 1.855001
H 2.500265 2.421619 0.796282
H 2.288370 0.464538 -2.465000
H 2.236484 2.104977 -1.771714
H 3.777655 1.195779 -1.801309
H 0.632544 2.574902 -0.085982
H -2.126413 -2.580367 -0.982078
H -2.090031 -2.657273 0.784924
H -0.062920 -2.975445 1.693396
H 1.400900 -3.848248 1.153185
H 1.538584 -2.237567 1.922088
H -4.262346 -1.662062 0.877941
H -4.299197 -1.578167 -0.892054
H 4.975323 0.574344 1.079718
H 4.874514 1.987934 -0.008835
H 4.774209 2.209803 1.755299
H -2.782250 3.107344 -0.742336
H -2.653528 3.089371 1.009931
H -1.349318 3.857385 0.042832


