%chk=000246491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246491

0 1
O 5.802626 0.634962 -0.565560
O -6.022925 -0.044394 -0.620193
C -0.563393 0.352683 0.565607
C 0.319891 -0.600996 -0.287833
C 1.791441 -0.259727 -0.197059
C -0.062382 1.805123 0.459341
C 2.262778 0.862995 0.375540
C 1.370910 1.905014 0.992730
C -2.018058 0.257156 0.155648
C 0.030313 -2.070986 0.095601
C 2.742156 -1.238072 -0.838978
C 3.732204 1.154739 0.473567
C 3.938081 -0.530666 -1.479194
C -2.959086 -0.299192 1.191508
C 4.608983 0.430472 -0.526279
C -2.462771 0.660419 -1.043311
C 0.482140 -2.444355 1.504479
C -4.176914 -0.978282 0.561546
C -3.896357 0.611483 -1.458302
C -4.819572 -0.120234 -0.506106
H -0.458495 0.039943 1.637536
H 0.030883 -0.469840 -1.364952
H -0.731039 2.480408 1.024431
H -0.097087 2.149495 -0.592003
H 1.380380 1.785251 2.096397
H 1.766559 2.922402 0.799125
H 0.513368 -2.745122 -0.638674
H -1.058330 -2.256829 -0.007338
H 3.093611 -1.960535 -0.071165
H 2.227189 -1.848295 -1.608307
H 3.929957 2.245880 0.377777
H 4.088897 0.901193 1.498911
H 3.613493 0.040157 -2.375906
H 4.677665 -1.268123 -1.852732
H -2.438862 -1.025117 1.850131
H -3.287318 0.528526 1.857218
H -1.790985 1.069088 -1.797770
H 1.561202 -2.296345 1.634176
H -0.016819 -1.831311 2.264787
H 0.261904 -3.494020 1.727106
H -4.926086 -1.235163 1.338500
H -3.882768 -1.945057 0.100598
H -4.280682 1.648785 -1.599691
H -3.990800 0.143088 -2.464306


%chk=000246491-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246491

0 1
O 5.891897 0.045587 0.209683
O -6.163947 0.299235 -0.295519
C -0.574692 0.368465 0.511826
C 0.331660 -0.580088 -0.340769
C 1.819758 -0.210272 -0.284696
C -0.081658 1.833547 0.391260
C 2.286488 0.919314 0.326050
C 1.353794 1.956473 0.936368
C -2.059162 0.212733 0.158311
C 0.087440 -2.080897 0.028398
C 2.770082 -1.175292 -0.990263
C 3.771727 1.233226 0.459169
C 4.119601 -0.519059 -1.382463
C -2.981584 -0.342692 1.237924
C 4.714084 0.226001 -0.197878
C -2.554090 0.580229 -1.056276
C 0.532637 -2.491696 1.450792
C -4.288064 -0.946816 0.659469
C -4.021062 0.529241 -1.442836
C -4.943498 -0.006904 -0.344878
H -0.446173 0.084153 1.577066
H 0.006695 -0.472914 -1.401164
H -0.764701 2.507347 0.942548
H -0.103769 2.147535 -0.670920
H 1.348570 1.858861 2.043786
H 1.752773 2.970735 0.728570
H 0.609260 -2.722585 -0.707382
H -0.992656 -2.292571 -0.100237
H 2.965281 -2.063812 -0.354836
H 2.284586 -1.564444 -1.907516
H 3.988419 2.229338 0.010834
H 4.059511 1.330962 1.525400
H 3.929171 0.221147 -2.186983
H 4.845907 -1.261126 -1.755062
H -2.450793 -1.121315 1.820010
H -3.229113 0.459634 1.964685
H -1.873719 0.980282 -1.822057
H 1.598040 -2.253576 1.624090
H -0.052062 -1.978171 2.235661
H 0.399480 -3.578799 1.600175
H -5.014525 -1.198308 1.450669
H -4.028044 -1.880744 0.117983
H -4.393743 1.528489 -1.742538
H -4.163903 -0.113851 -2.339848


