%chk=000239461.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239461

0 1
O -3.915780 -0.375257 1.352473
O -4.378110 -1.533730 -0.666669
O 1.190248 1.271248 -0.357772
O 1.837655 -0.890139 -0.320077
O 0.927340 2.447817 1.551659
O 3.561407 -0.314463 1.036196
C -0.462907 -0.433018 0.007571
C 0.933178 0.017467 0.337804
C -2.745233 -0.539519 0.621430
C -1.478592 -0.123315 0.952425
C -3.026126 -1.236896 -0.595045
C -0.736606 -1.105009 -1.182054
C -2.044128 -1.532021 -1.513028
C -4.978868 -0.997134 0.560166
C 1.217612 2.446879 0.382308
C 3.168007 -0.953323 0.096769
C 1.638225 3.560806 -0.533209
C 3.878753 -1.906606 -0.821689
C 0.853937 4.830857 -0.235782
C 4.889065 -2.745484 -0.052373
H 1.181014 0.118711 1.417676
H -1.263069 0.418682 1.872581
H 0.080792 -1.311307 -1.878471
H -2.253166 -2.058537 -2.439490
H -5.379310 -1.842383 1.135218
H -5.688841 -0.211360 0.270299
H 2.730542 3.729313 -0.396199
H 1.513617 3.255291 -1.596469
H 3.145370 -2.554383 -1.352476
H 4.381635 -1.313239 -1.618565
H 0.922072 5.106759 0.827251
H 1.233333 5.675826 -0.822916
H -0.212039 4.715950 -0.471581
H 4.399524 -3.421814 0.660547
H 5.489812 -3.361919 -0.732261
H 5.582038 -2.114949 0.524654


%chk=000239461-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239461

0 1
O -4.110488 -0.136749 1.186112
O -4.646404 -1.493622 -0.722584
O 1.147846 1.138939 -0.542985
O 1.736918 -1.122396 -0.387223
O 0.627080 2.327379 1.402007
O 3.445879 -0.246347 0.953185
C -0.606765 -0.568256 -0.115390
C 0.811432 -0.143740 0.168127
C -2.932530 -0.481176 0.476374
C -1.623003 -0.107719 0.773618
C -3.249642 -1.277304 -0.645964
C -0.925551 -1.364012 -1.242119
C -2.266280 -1.734611 -1.527102
C -5.209456 -0.875474 0.510527
C 1.078716 2.310387 0.235949
C 3.077414 -1.053623 0.079031
C 1.617180 3.492186 -0.550660
C 3.922443 -2.083525 -0.645425
C 1.343795 4.841202 0.137982
C 5.350044 -2.188123 -0.080560
H 1.011801 0.025054 1.241520
H -1.381051 0.525117 1.632041
H -0.117784 -1.707480 -1.893300
H -2.520789 -2.350817 -2.392700
H -5.571572 -1.677306 1.179652
H -5.999124 -0.162525 0.224497
H 2.705415 3.328796 -0.680236
H 1.184551 3.454733 -1.567537
H 3.393068 -3.053815 -0.600371
H 3.937864 -1.802452 -1.716900
H 1.770863 4.856962 1.154725
H 1.790831 5.665443 -0.445036
H 0.260042 5.028220 0.230880
H 5.337193 -2.501371 0.977419
H 5.934848 -2.926917 -0.655761
H 5.867616 -1.215258 -0.130891


