%chk=000290104.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290104

0 1
O -1.578435 -1.551209 -2.270231
O 1.372560 -0.597399 1.888200
C -1.523308 -2.881443 -0.259966
C -2.696434 -3.421955 0.589994
C -0.408664 -2.328930 0.660286
C -3.444897 -2.316516 1.338634
C -2.001918 -1.708182 -1.143020
C -4.015440 -1.279807 0.364343
C -0.998376 -4.009280 -1.157500
C -2.953688 -0.719215 -0.532679
C 0.830606 -1.837929 -0.091868
C -2.818469 0.579727 -0.837007
C 1.691754 -0.935783 0.765704
C -3.652126 1.668234 -0.295744
C 2.958235 -0.485318 0.130438
C -4.608976 2.285635 -1.116391
C -3.473701 2.107031 1.025644
C 3.815019 0.309669 0.788003
C -5.384754 3.332794 -0.612571
C -4.250771 3.157645 1.520060
C -5.207242 3.770576 0.704001
C 5.087130 0.796064 0.232201
C 5.200359 1.161518 -1.119252
C 6.206531 0.906974 1.076560
C 6.419383 1.627306 -1.619383
C 7.423768 1.364687 0.568594
C 7.532156 1.726552 -0.778858
H -2.315514 -4.174466 1.306768
H -3.403250 -3.968589 -0.065663
H -0.112090 -3.110527 1.387424
H -0.813418 -1.500081 1.283892
H -2.770563 -1.819077 2.064679
H -4.263154 -2.756176 1.940523
H -4.523538 -0.470688 0.930525
H -4.808062 -1.738751 -0.265551
H -1.807910 -4.495524 -1.714107
H -0.299474 -3.622365 -1.912935
H -0.479765 -4.778257 -0.577713
H 1.429127 -2.700817 -0.450235
H 0.541251 -1.293053 -1.019284
H -2.046221 0.912788 -1.543210
H 3.149995 -0.837539 -0.881835
H -4.745875 1.946058 -2.141679
H -2.726810 1.631158 1.659504
H 3.591560 0.633792 1.816013
H -6.128529 3.810066 -1.248727
H -4.109347 3.500113 2.544062
H -5.811105 4.588075 1.092231
H 4.334477 1.091322 -1.776636
H 6.126505 0.629149 2.126931
H 6.501227 1.913118 -2.667196
H 8.290246 1.442655 1.223870
H 8.481732 2.086772 -1.171243


%chk=000290104-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290104

0 1
O -1.620980 -1.167987 -2.127188
O 1.715203 -0.806679 1.898756
C -1.525343 -2.778479 -0.291148
C -2.565719 -3.436515 0.664902
C -0.314131 -2.254322 0.569639
C -3.298985 -2.430996 1.573723
C -2.106453 -1.533860 -1.010607
C -4.059088 -1.407341 0.701034
C -1.044750 -3.824281 -1.325303
C -3.157219 -0.704911 -0.305811
C 0.884858 -1.712589 -0.225212
C -3.254794 0.605929 -0.708868
C 1.912033 -0.998353 0.657813
C -4.112430 1.699248 -0.209601
C 3.150093 -0.537828 -0.027193
C -4.593710 2.658610 -1.148641
C -4.435003 1.890996 1.165763
C 4.147468 0.101961 0.660985
C -5.409177 3.734256 -0.740931
C -5.235711 2.977433 1.576122
C -5.738384 3.896892 0.625369
C 5.421034 0.611654 0.138991
C 5.800346 0.509583 -1.232505
C 6.326171 1.239190 1.044033
C 7.036866 1.015273 -1.675849
C 7.565097 1.745771 0.600317
C 7.925906 1.635570 -0.762573
H -2.043827 -4.203214 1.271185
H -3.320956 -3.974561 0.054756
H 0.022198 -3.095421 1.208293
H -0.648610 -1.464859 1.267545
H -2.586623 -1.913946 2.243276
H -4.017648 -2.968248 2.221551
H -4.614945 -0.687255 1.320323
H -4.825747 -1.967191 0.121487
H -1.905945 -4.287511 -1.841115
H -0.409157 -3.362215 -2.097436
H -0.474680 -4.626677 -0.820200
H 1.408125 -2.521286 -0.774619
H 0.551240 -1.002814 -1.011779
H -2.605534 0.872565 -1.557732
H 3.223883 -0.736637 -1.104329
H -4.331858 2.543345 -2.207384
H -4.014289 1.219411 1.921050
H 3.964093 0.245684 1.737021
H -5.778412 4.450031 -1.483773
H -5.458338 3.114499 2.640271
H -6.363036 4.737588 0.946909
H 5.124237 0.034365 -1.951576
H 6.046852 1.324873 2.101304
H 7.313470 0.929706 -2.732531
H 8.246733 2.224263 1.311887
H 8.887374 2.027881 -1.111800


