%chk=000250800.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250800

0 1
O 3.939731 0.550169 0.679679
O 5.957069 1.317208 1.053125
O -6.771372 0.239232 -1.088559
C 1.571494 0.269552 0.315599
C 0.742137 -0.994868 -0.075006
C -0.683833 -0.913593 0.488793
C -1.379272 0.330507 -0.133232
C 2.999033 -0.159571 -0.188152
C 0.916641 1.481519 -0.367104
C 1.634550 -2.174759 0.348455
C -2.843386 0.494544 0.393391
C -0.548524 1.614071 0.086346
C 3.078122 -1.681024 0.107950
C -1.485080 -2.179833 0.145922
C 1.652757 0.508290 1.830298
C 3.330063 0.221698 -1.633580
C -3.609964 -0.819055 0.225854
C -2.918540 -2.077898 0.672185
C -3.524017 1.616210 -0.440037
C -2.882077 0.851773 1.889688
C 4.757000 -0.167521 -2.037770
C -5.039980 1.660425 -0.269621
C -4.874185 -0.871043 -0.225129
C 5.748470 -0.137677 -0.869562
C 5.269624 0.639729 0.327294
C -5.667775 0.317997 -0.590005
H 0.658459 -1.025860 -1.191987
H -0.643719 -0.799338 1.597859
H -1.447956 0.155391 -1.236961
H 0.956182 1.389577 -1.467317
H 1.470312 2.406367 -0.115185
H 1.414856 -3.083325 -0.233196
H 1.478072 -2.437048 1.408814
H -0.570050 1.894743 1.159113
H -1.014630 2.458511 -0.456043
H 3.706336 -1.851682 1.000627
H 3.553032 -2.233210 -0.717115
H -0.992680 -3.071348 0.578663
H -1.498242 -2.344363 -0.949180
H 2.043593 -0.364841 2.363355
H 2.342218 1.338013 2.051357
H 0.678836 0.758440 2.261194
H 3.208052 1.319645 -1.748429
H 2.600567 -0.241040 -2.325219
H -2.920306 -2.102060 1.784366
H -3.490161 -2.977850 0.362950
H -3.286892 1.472005 -1.513943
H -3.094032 2.598561 -0.164609
H -2.303021 0.140381 2.489696
H -2.466463 1.848474 2.075780
H -3.908606 0.851748 2.274360
H 5.104707 0.518373 -2.836890
H 4.760894 -1.178032 -2.492546
H -5.483801 2.446367 -0.913954
H -5.318186 1.943275 0.766285
H -5.410076 -1.814022 -0.347358
H 6.722962 0.283176 -1.200835
H 5.982354 -1.171009 -0.532772


%chk=000250800-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250800

0 1
O 4.065227 0.712074 0.559256
O 6.204592 1.507918 0.627502
O -6.756855 0.225292 -1.425615
C 1.623940 0.296205 0.419052
C 0.784753 -0.967090 0.051975
C -0.669440 -0.913103 0.568393
C -1.364343 0.365167 -0.004380
C 3.027420 -0.116548 -0.160531
C 0.940795 1.532626 -0.211988
C 1.688004 -2.151879 0.480175
C -2.882908 0.508539 0.428861
C -0.532968 1.654366 0.261237
C 3.143699 -1.640100 0.211864
C -1.455636 -2.176579 0.153291
C 1.761012 0.491823 1.956568
C 3.231801 0.175625 -1.664067
C -3.611166 -0.816214 0.132412
C -2.935962 -2.094002 0.595755
C -3.527999 1.665493 -0.398461
C -3.025706 0.809890 1.955169
C 4.622279 -0.292815 -2.168631
C -5.070259 1.665912 -0.381809
C -4.836592 -0.867554 -0.483944
C 5.712861 -0.218451 -1.057007
C 5.384020 0.744539 0.080039
C -5.637676 0.322200 -0.834538
H 0.709406 -0.993351 -1.059589
H -0.655905 -0.864345 1.677439
H -1.384080 0.220882 -1.110896
H 0.942935 1.444606 -1.316807
H 1.493467 2.457777 0.043570
H 1.467172 -3.074140 -0.085429
H 1.542512 -2.384106 1.551689
H -0.553390 1.905683 1.337625
H -0.995905 2.508735 -0.266205
H 3.778718 -1.747320 1.109518
H 3.622372 -2.216888 -0.598480
H -0.990735 -3.079429 0.593247
H -1.406837 -2.290613 -0.949644
H 2.267173 -0.360282 2.441917
H 2.369374 1.386937 2.164220
H 0.778998 0.618612 2.440554
H 3.137578 1.267830 -1.807461
H 2.433190 -0.300665 -2.261301
H -2.968124 -2.132020 1.705928
H -3.502196 -2.972151 0.235234
H -3.188712 1.576268 -1.450748
H -3.160207 2.638308 -0.023377
H -2.542174 0.038499 2.579862
H -2.571896 1.784329 2.208222
H -4.090494 0.849871 2.246735
H 4.920926 0.341369 -3.022247
H 4.568618 -1.328209 -2.551445
H -5.482257 2.460964 -1.028271
H -5.449734 1.864067 0.641642
H -5.306956 -1.835190 -0.703988
H 6.695729 0.070626 -1.461621
H 5.839841 -1.215882 -0.592771


