%chk=000253022.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253022

0 1
O -2.241479 -1.181755 -0.600663
O -1.624329 -1.131463 1.585409
C 0.468518 0.720205 0.490525
C -0.014241 -0.587834 -0.196932
C 1.833186 1.174120 0.012853
C -0.569094 1.815048 0.309721
C 0.967282 -1.723769 -0.015975
C -1.355631 -0.994931 0.411996
C -3.671503 -1.532361 -0.344948
C 2.696335 1.781950 0.939985
C -0.612341 2.612176 -0.841788
C 2.251357 1.025584 -1.317338
C -1.519181 2.018841 1.324518
C 1.234231 -2.238074 1.262548
C 1.613670 -2.271126 -1.133509
C -4.290536 -0.408903 0.473932
C -4.198997 -1.587531 -1.776306
C -3.711462 -2.882113 0.356099
C 3.957998 2.228520 0.540633
C -1.588115 3.605224 -0.973480
C 3.516136 1.471485 -1.712380
C -2.492342 3.010865 1.189223
C 2.150061 -3.280175 1.420326
C 2.530056 -3.314335 -0.969405
C 4.372297 2.073633 -0.786307
C -2.528648 3.808014 0.040153
C 2.802011 -3.818601 0.305686
H 0.551317 0.490786 1.591986
H -0.174315 -0.384454 -1.290062
H 2.383052 1.910023 1.974945
H 0.117884 2.469350 -1.637146
H 1.596242 0.557278 -2.049330
H -1.506844 1.389654 2.216773
H 0.711571 -1.831205 2.131255
H 1.407719 -1.888254 -2.131024
H -4.080524 0.574009 0.032077
H -5.376138 -0.517441 0.554275
H -3.880650 -0.388563 1.496159
H -3.648980 -2.325001 -2.374647
H -4.080244 -0.620272 -2.281259
H -5.260014 -1.854835 -1.798835
H -3.258716 -2.822461 1.359176
H -4.737454 -3.242373 0.479718
H -3.151853 -3.643559 -0.199706
H 4.620680 2.697991 1.265921
H -1.612070 4.222961 -1.869586
H 3.834267 1.347537 -2.746085
H -3.223105 3.164008 1.981553
H 2.355215 -3.674558 2.414341
H 3.033090 -3.733672 -1.838995
H 5.356116 2.419487 -1.095149
H -3.284851 4.583046 -0.062966
H 3.517467 -4.628576 0.431137


%chk=000253022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253022

0 1
O -2.264915 -1.191585 -0.650274
O -1.615768 -1.013410 1.598628
C 0.489732 0.784468 0.514102
C -0.005477 -0.516763 -0.213276
C 1.900014 1.220753 0.103038
C -0.535132 1.920318 0.325384
C 0.949260 -1.709962 -0.081299
C -1.370170 -0.922377 0.370575
C -3.699837 -1.649374 -0.354014
C 2.712756 1.881073 1.059952
C -0.629175 2.636092 -0.896207
C 2.413912 1.048401 -1.207107
C -1.427207 2.252173 1.376108
C 1.403570 -2.149016 1.188511
C 1.362858 -2.417932 -1.236739
C -4.423884 -0.550925 0.449002
C -4.281846 -1.794599 -1.769691
C -3.651772 -3.001307 0.384159
C 3.998718 2.356200 0.723433
C -1.593810 3.653463 -1.063980
C 3.700435 1.520785 -1.549911
C -2.391036 3.272921 1.213149
C 2.268566 -3.259186 1.295089
C 2.227308 -3.530373 -1.132713
C 4.498981 2.178678 -0.587463
C -2.479379 3.977256 -0.009179
C 2.686734 -3.953154 0.135506
H 0.509331 0.545475 1.594381
H -0.167480 -0.302907 -1.283801
H 2.329418 2.026871 2.077729
H 0.068089 2.414592 -1.712306
H 1.819830 0.530141 -1.968104
H -1.372787 1.696111 2.319278
H 1.066651 -1.632578 2.094172
H 1.003458 -2.098036 -2.222866
H -4.335970 0.423959 -0.062335
H -5.496757 -0.806054 0.528552
H -4.004722 -0.458093 1.462789
H -3.705605 -2.533226 -2.353131
H -4.252128 -0.828533 -2.302244
H -5.331771 -2.133555 -1.710876
H -3.207783 -2.892743 1.385970
H -4.679339 -3.394006 0.494108
H -3.061927 -3.736062 -0.191950
H 4.609543 2.860997 1.480589
H -1.649863 4.199983 -2.012538
H 4.080774 1.370597 -2.566843
H -3.069909 3.517569 2.038147
H 2.614211 -3.586252 2.282338
H 2.541622 -4.064051 -2.036881
H 5.497770 2.543163 -0.852582
H -3.223477 4.771700 -0.137100
H 3.359483 -4.814078 0.219823


