%chk=000291681.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291681

0 1
O -3.196980 0.341023 -1.662374
O -0.847362 2.361886 -0.240631
O 1.613119 2.140222 -0.851476
O 3.662546 -2.111776 0.147847
O -3.498773 -2.304798 0.597566
O -5.133706 -0.842375 0.118909
C -2.220484 0.594402 0.608666
C -2.775995 -0.332441 -0.497537
C -0.890381 1.190738 0.134850
C 0.307577 0.361194 0.140118
C -3.198708 1.702867 0.985293
C 1.523035 0.886009 -0.376246
C 2.733014 0.132141 -0.429631
C 0.330324 -0.964322 0.645770
C 2.679509 -1.169404 0.069643
C -3.964259 -1.123234 0.072407
C 1.474964 -1.718557 0.616879
C 3.942623 0.790333 -1.004847
C 4.998692 -1.861613 -0.349560
H -2.023048 -0.031019 1.521321
H -1.993781 -1.036632 -0.889820
H -3.244592 2.481058 0.206707
H -2.881092 2.216269 1.902790
H -4.214724 1.324153 1.154666
H -0.582790 -1.390704 1.071496
H 1.505840 -2.737719 0.999637
H 4.292420 0.280733 -1.911776
H 3.727885 1.832890 -1.303574
H 4.763706 0.844878 -0.278860
H -3.851608 1.055275 -1.451717
H 0.707858 2.668993 -0.791298
H -4.220814 -2.878156 0.972954
H 4.973602 -1.665441 -1.424978
H 5.490244 -2.820996 -0.134968
H 5.466040 -1.046976 0.210575


%chk=000291681-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291681

0 1
O -3.088176 0.273166 -1.759548
O -0.827250 2.431687 -0.256416
O 1.617082 2.249223 -0.737413
O 3.866330 -1.957919 0.335323
O -3.509603 -2.090277 1.002705
O -5.084641 -1.063163 -0.372189
C -2.233741 0.630501 0.585425
C -2.719438 -0.386776 -0.525674
C -0.877094 1.208812 0.166631
C 0.340815 0.395911 0.223888
C -3.275342 1.737798 0.829872
C 1.582205 0.960774 -0.260339
C 2.808873 0.229001 -0.244592
C 0.374297 -0.928645 0.760747
C 2.759304 -1.099087 0.247878
C -3.900694 -1.195853 0.009190
C 1.557607 -1.664413 0.773037
C 4.084757 0.940590 -0.654167
C 4.815524 -2.053153 -0.789846
H -2.090733 0.035670 1.507704
H -1.894241 -1.076973 -0.770384
H -3.384992 2.364757 -0.069196
H -2.948661 2.398624 1.650117
H -4.258039 1.310680 1.100831
H -0.534635 -1.383193 1.167697
H 1.599822 -2.683621 1.165573
H 4.447337 0.626841 -1.650524
H 3.892591 2.022976 -0.705670
H 4.892173 0.757175 0.076938
H -4.066767 0.450260 -1.747094
H 0.646482 2.628383 -0.651342
H -4.298368 -2.592043 1.345124
H 4.287646 -1.985959 -1.758742
H 5.277545 -3.046963 -0.683592
H 5.595924 -1.275889 -0.733148


