%chk=000221064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221064

0 1
O 4.088482 0.296760 -1.338374
O 4.325253 1.295811 0.637928
C 0.655631 0.600308 -0.403057
C 1.550309 -0.684158 -0.530212
C 2.772056 -0.649505 0.440633
C -0.616471 0.427586 -1.311507
C 0.240949 0.815116 1.067884
C 0.745810 -1.980286 -0.291576
C 2.332298 -0.364280 1.892832
C 1.448208 0.881268 2.006843
C -1.336659 -0.848599 -0.948285
C -0.503664 -2.076187 -1.177189
C 1.428029 1.829716 -0.923016
C -1.554983 1.657350 -1.317322
C 3.593239 -1.951828 0.394093
C 3.771015 0.429904 0.002083
C -2.564821 -0.886256 -0.404080
C -2.797082 1.534512 -0.490477
C -3.289574 0.347531 -0.092193
C -4.578892 0.250651 0.702513
C -5.636648 -0.537987 -0.080661
C -4.319688 -0.375049 2.079327
H 1.950689 -0.715496 -1.574984
H -0.239410 0.312379 -2.362129
H -0.441562 -0.000054 1.380313
H -0.357434 1.741650 1.157263
H 0.440917 -2.038718 0.772971
H 1.386118 -2.862686 -0.481579
H 3.224744 -0.243621 2.539269
H 1.787030 -1.246455 2.281196
H 1.104899 0.998775 3.052075
H 2.054497 1.785884 1.786498
H -1.061690 -3.003559 -0.945010
H -0.222102 -2.159698 -2.245866
H 2.130462 2.222670 -0.177191
H 1.989234 1.607489 -1.836091
H 0.747416 2.662705 -1.149017
H -1.868576 1.854019 -2.366518
H -0.987164 2.562877 -1.007661
H 3.022636 -2.806571 0.774258
H 3.904260 -2.189526 -0.632398
H 4.501407 -1.882044 1.005631
H -3.057545 -1.823389 -0.157365
H -3.291830 2.474856 -0.263416
H -4.978846 1.285285 0.868354
H 4.760716 0.963154 -1.635318
H -5.338473 -1.581108 -0.231668
H -5.799304 -0.100190 -1.072100
H -6.596422 -0.543156 0.445634
H -3.551262 0.183122 2.625981
H -3.971749 -1.410413 1.996947
H -5.228652 -0.380562 2.689131


%chk=000221064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221064

0 1
O 4.234688 0.191881 -1.322503
O 4.486546 1.175104 0.753225
C 0.666454 0.651119 -0.421088
C 1.558034 -0.660153 -0.532570
C 2.791869 -0.641635 0.464010
C -0.626311 0.478843 -1.346570
C 0.255197 0.901604 1.058843
C 0.745168 -1.974928 -0.346792
C 2.337119 -0.313096 1.914894
C 1.464925 0.956275 2.020999
C -1.344394 -0.830869 -1.044836
C -0.493630 -2.053319 -1.276017
C 1.457495 1.869752 -0.975936
C -1.616339 1.689943 -1.371225
C 3.556118 -2.010324 0.469246
C 3.875494 0.355248 0.029074
C -2.583798 -0.874783 -0.470020
C -2.843129 1.556931 -0.484830
C -3.329454 0.343017 -0.090489
C -4.607120 0.208559 0.738826
C -5.703402 -0.584424 -0.022475
C -4.325460 -0.433961 2.123935
H 1.971926 -0.683037 -1.562676
H -0.204673 0.385411 -2.372661
H -0.437691 0.100961 1.385044
H -0.313534 1.849041 1.123034
H 0.401247 -2.076387 0.700662
H 1.397615 -2.840710 -0.560346
H 3.231174 -0.209365 2.557317
H 1.762571 -1.181550 2.293924
H 1.102822 1.060593 3.062328
H 2.086944 1.847586 1.818046
H -1.056180 -2.983868 -1.073006
H -0.147331 -2.093963 -2.330563
H 2.333538 2.131640 -0.361434
H 1.811098 1.671596 -2.005052
H 0.825629 2.774980 -1.002264
H -1.974816 1.822911 -2.415834
H -1.089770 2.632206 -1.130097
H 2.952146 -2.785740 0.969350
H 3.794687 -2.342149 -0.555731
H 4.503087 -1.915983 1.032505
H -3.028931 -1.853964 -0.244556
H -3.376852 2.479474 -0.216452
H -4.996272 1.231996 0.916115
H 4.978629 0.820632 -1.528540
H -5.381005 -1.622873 -0.225297
H -5.937392 -0.108115 -0.991594
H -6.633358 -0.633763 0.574704
H -3.579257 0.153893 2.688796
H -3.933623 -1.462837 2.015143
H -5.252699 -0.489405 2.724829


