%chk=000221029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221029

0 1
O 2.294168 -0.108430 0.614652
O -2.370578 0.127254 0.483668
O 1.069611 1.410996 -0.523462
O -1.331618 -0.399250 -1.446047
C -0.053804 -0.447481 0.659908
C 0.310879 -1.974579 0.620979
C -0.307364 -0.002232 2.122943
C -0.886392 -2.835004 1.031419
C 0.829466 -2.391867 -0.756165
C 1.108379 0.403399 0.138772
C -1.266528 -0.231294 -0.251038
C -0.544962 1.494915 2.280165
C 3.531233 0.583731 0.246622
C -3.613881 0.391590 -0.245980
C 3.914609 0.233991 -1.175524
C -3.544350 1.756491 -0.896728
H 1.137445 -2.120497 1.365165
H 0.558573 -0.313683 2.742846
H -1.190042 -0.556431 2.509709
H -0.587141 -3.882002 1.160161
H -1.330342 -2.503620 1.977455
H -1.680744 -2.822538 0.274560
H 0.978871 -3.475148 -0.813011
H 0.132789 -2.118200 -1.563888
H 1.792693 -1.917783 -0.983521
H -1.419064 1.821233 1.695767
H 0.309278 2.096706 1.948436
H -0.740078 1.752473 3.327284
H 3.382965 1.668706 0.391865
H 4.226768 0.174354 1.001653
H -3.772440 -0.420787 -0.977239
H -4.349252 0.334162 0.576645
H 4.888532 0.659568 -1.444824
H 3.969559 -0.851095 -1.327857
H 3.176188 0.626349 -1.892809
H -4.502135 2.037152 -1.349193
H -3.269368 2.537096 -0.176157
H -2.783922 1.776455 -1.694332


%chk=000221029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221029

0 1
O 2.308858 -0.054218 0.623627
O -2.440536 0.135275 0.460855
O 1.020478 1.364055 -0.698428
O -1.324598 -0.341641 -1.519484
C -0.073044 -0.454587 0.620671
C 0.261664 -2.011191 0.577656
C -0.276881 0.003219 2.109123
C -0.929708 -2.872841 1.062101
C 0.750040 -2.504757 -0.804427
C 1.101345 0.376734 0.062849
C -1.301644 -0.198799 -0.276608
C -0.342960 1.528925 2.334656
C 3.532050 0.717036 0.237766
C -3.689772 0.376060 -0.329618
C 4.112403 0.195049 -1.079467
C -3.737359 1.821756 -0.831775
H 1.097421 -2.131863 1.293844
H 0.563472 -0.418941 2.692501
H -1.209175 -0.452181 2.481629
H -0.626805 -3.935494 1.093476
H -1.274170 -2.592478 2.072353
H -1.790127 -2.794812 0.371293
H 1.017036 -3.576096 -0.738542
H -0.029107 -2.385294 -1.575895
H 1.646869 -1.954310 -1.138479
H -1.160436 1.982243 1.749078
H 0.600184 2.031724 2.053962
H -0.529776 1.741807 3.403038
H 3.262055 1.785059 0.159922
H 4.215649 0.555706 1.086729
H -3.716536 -0.339759 -1.170019
H -4.495604 0.155504 0.388684
H 5.056353 0.724982 -1.306103
H 4.330556 -0.885161 -1.014978
H 3.410935 0.371107 -1.911975
H -4.692972 2.002083 -1.358597
H -3.666250 2.534727 0.007925
H -2.911908 2.016071 -1.536444


