%chk=000191272.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191272

0 1
O 3.162526 -0.451331 0.214656
O -1.422659 2.190697 0.523777
O 0.081677 1.509050 -1.428737
C 0.867359 0.399587 0.601391
C -0.573432 -0.130844 0.849052
C 1.817591 -0.857301 0.577962
C -1.607244 0.965344 1.222720
C -1.002174 -1.021886 -0.297375
C 1.010808 1.130305 -0.749556
C -3.049600 0.465306 1.035115
C 1.287962 1.396636 1.684038
C 1.305579 -1.892393 -0.399979
C -3.302968 -0.033336 -0.399188
C 2.047588 -1.484340 1.953960
C 0.024019 -1.963979 -0.777684
C -2.232187 -0.997378 -0.833604
C 2.431730 1.398763 -1.202007
C 3.300944 0.150317 -1.082906
C -4.695584 -0.663057 -0.515237
H -0.518150 -0.801458 1.754807
H -1.447445 1.286553 2.280961
H -3.746592 1.293294 1.270145
H -3.265983 -0.338367 1.762119
H 1.071332 1.021867 2.690030
H 2.366168 1.599515 1.640227
H 0.745631 2.349800 1.573023
H 2.062548 -2.588798 -0.756044
H -3.253015 0.850842 -1.092644
H 1.103057 -1.687852 2.469112
H 2.599048 -2.429458 1.865905
H 2.658972 -0.825552 2.585424
H -2.513733 -1.668102 -1.644696
H -0.317356 -2.732427 -1.474728
H 2.431728 1.780200 -2.243987
H 2.847916 2.224108 -0.585895
H 3.055302 -0.594371 -1.861136
H 4.381410 0.384650 -1.114142
H -4.924718 -0.941136 -1.549913
H -4.783386 -1.568244 0.095926
H -5.474939 0.033167 -0.185474
H -1.421932 2.042907 -0.462920


%chk=000191272-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191272

0 1
O 3.239273 -0.485029 0.270691
O -1.623318 2.267472 0.338778
O 0.193798 1.622859 -1.479813
C 0.897183 0.453163 0.592502
C -0.591121 -0.031058 0.772864
C 1.826585 -0.849617 0.600972
C -1.657124 1.046159 1.146854
C -1.016741 -0.934104 -0.387348
C 1.134102 1.174228 -0.759362
C -3.070184 0.418717 1.076607
C 1.302939 1.440145 1.724630
C 1.300732 -1.844129 -0.425895
C -3.407726 -0.066341 -0.354438
C 1.988456 -1.505355 1.987658
C 0.012575 -1.849792 -0.886257
C -2.293498 -0.949107 -0.878886
C 2.575777 1.384622 -1.196512
C 3.397834 0.083042 -1.070052
C -4.780132 -0.777858 -0.416074
H -0.557092 -0.683937 1.671905
H -1.465728 1.380655 2.185034
H -3.802106 1.182122 1.397801
H -3.139256 -0.435553 1.782484
H 1.009211 1.032886 2.708627
H 2.394630 1.601249 1.735427
H 0.790162 2.408934 1.594635
H 2.024346 -2.597976 -0.764425
H -3.465016 0.838090 -1.001114
H 1.018666 -1.784434 2.430568
H 2.590902 -2.423297 1.879352
H 2.523184 -0.827690 2.674415
H -2.537619 -1.637891 -1.702672
H -0.291159 -2.591141 -1.637839
H 2.578727 1.772342 -2.229652
H 3.027143 2.150457 -0.535508
H 3.079749 -0.642447 -1.845704
H 4.477421 0.277200 -1.176948
H -5.025827 -1.086992 -1.449510
H -4.786707 -1.682658 0.220662
H -5.584048 -0.106152 -0.063011
H -1.181194 2.059516 -0.538946


