%chk=000229371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229371

0 1
O 1.920780 -2.695029 -1.750566
C 0.085268 -0.443937 -0.525496
C 0.500810 -1.818558 0.033568
C 1.923630 -2.226110 -0.381465
C 0.910586 0.715969 -0.000928
C -1.389912 -0.218426 -0.242924
C 2.443122 -3.420924 0.408066
C 1.048135 1.858911 -0.806842
C -2.326472 -0.428820 -1.266677
C 1.525462 0.688708 1.258635
C -1.833467 0.176633 1.027534
C 1.794865 2.951098 -0.360034
C -3.689647 -0.243598 -1.020357
C 2.273911 1.783436 1.701900
C -3.197315 0.361420 1.269044
C 2.412100 2.915891 0.894894
C -4.128492 0.151667 0.247013
H 0.231163 -0.483048 -1.640016
H -0.213958 -2.589431 -0.324505
H 0.407415 -1.829031 1.136297
H 2.628008 -1.364631 -0.326879
H 2.631021 -3.169474 1.455247
H 3.382093 -3.786589 -0.032345
H 1.740714 -4.263429 0.372265
H 0.564030 1.900639 -1.781047
H -1.996978 -0.739323 -2.256062
H 1.424047 -0.185983 1.899215
H -1.113865 0.349195 1.826652
H 1.567314 -2.013407 -2.348081
H 1.895489 3.833188 -0.990649
H -4.411243 -0.408100 -1.818913
H 2.749802 1.752029 2.680757
H -3.534818 0.671270 2.256789
H 2.995021 3.766630 1.240835
H -5.189721 0.296263 0.436974


%chk=000229371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229371

0 1
O 2.352678 -1.821502 -1.581866
C 0.041049 -0.438456 -0.465344
C 0.479560 -1.831300 0.084650
C 1.962907 -2.184972 -0.199501
C 0.933122 0.719379 -0.008106
C -1.453000 -0.217094 -0.165305
C 2.227074 -3.688427 -0.070409
C 1.227302 1.771751 -0.914867
C -2.416992 -0.809960 -1.022998
C 1.466052 0.800648 1.305410
C -1.911260 0.515150 0.958601
C 2.026409 2.870652 -0.527098
C -3.799005 -0.683665 -0.763844
C 2.266624 1.896580 1.698850
C -3.294554 0.644344 1.221378
C 2.550581 2.936966 0.784498
C -4.244539 0.044197 0.364136
H 0.133090 -0.509529 -1.567448
H -0.172556 -2.592963 -0.384935
H 0.294472 -1.889484 1.175751
H 2.611393 -1.630338 0.511658
H 1.908791 -4.058995 0.921304
H 3.300202 -3.907572 -0.203406
H 1.664049 -4.236734 -0.846688
H 0.813734 1.732748 -1.930867
H -2.078799 -1.371128 -1.903925
H 1.257200 0.003068 2.028087
H -1.188022 1.002927 1.620830
H 2.463079 -0.836523 -1.627101
H 2.239469 3.670858 -1.244865
H -4.526433 -1.145783 -1.441093
H 2.669127 1.938103 2.717483
H -3.630161 1.218479 2.092801
H 3.172663 3.785898 1.089105
H -5.316408 0.147774 0.567025


