%chk=000221268.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221268

0 1
O 0.091684 2.613372 2.787840
O -1.119169 4.052841 1.590464
O 3.202845 -2.650843 -0.191581
O 1.416529 -1.650337 -1.078156
C 1.333397 2.090333 -0.502671
C -0.838641 1.720076 0.792393
C 0.527643 1.137224 0.402939
C -1.690368 2.082194 -0.456002
C 2.568566 1.364034 -1.075265
C 0.473737 2.634916 -1.615240
C -0.860863 2.637846 -1.585949
C 3.651508 1.139081 -0.013360
C -2.412275 0.842429 -0.924965
C -0.673921 2.933690 1.680801
C 4.802644 0.283162 -0.557897
C -3.702533 0.603421 -0.675659
C -4.398400 -0.650539 -1.119074
C -4.650822 -1.610352 0.056775
C -3.357297 -2.095891 0.725821
C -2.525649 -3.010597 -0.184241
C 5.881966 0.040465 0.492076
C -1.081802 -3.131999 0.320290
C -0.232699 -4.006163 -0.611923
C 1.254227 -3.967453 -0.243248
C 1.880989 -2.644778 -0.567694
H 1.676662 2.965550 0.108908
H -1.391676 0.950586 1.396440
H 1.108387 0.897843 1.314846
H 0.369616 0.171841 -0.129709
H -2.429819 2.875229 -0.156518
H 2.247742 0.391503 -1.510687
H 2.989447 1.944265 -1.917965
H 1.019774 3.057353 -2.458275
H -1.449737 3.050345 -2.405102
H 3.213338 0.656823 0.882478
H 4.043078 2.113422 0.338663
H -1.786834 0.138329 -1.477497
H 5.245367 0.767151 -1.451151
H 4.406170 -0.696771 -0.924986
H -4.326788 1.301239 -0.117903
H -3.810402 -1.174345 -1.901969
H -5.364067 -0.389628 -1.598190
H -5.283896 -1.108091 0.814379
H -5.238184 -2.477141 -0.302610
H -3.604375 -2.626905 1.664655
H -2.753500 -1.215648 1.027101
H -2.522783 -2.605129 -1.217170
H -2.997677 -4.007926 -0.251988
H 6.692099 -0.583280 0.097011
H 5.483609 -0.461969 1.381345
H 6.332567 0.982174 0.829080
H -0.631854 -2.118536 0.385916
H -1.068931 -3.541976 1.347097
H 0.212729 3.384026 3.400918
H -0.361989 -3.668828 -1.661963
H -0.589680 -5.053935 -0.580416
H 1.402266 -4.190442 0.837106
H 1.808927 -4.772363 -0.775023
H 3.671616 -1.763294 -0.388092


%chk=000221268-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221268

0 1
O 0.247182 3.085699 2.687729
O -1.499845 4.229880 1.694783
O 3.381934 -3.162037 0.434899
O 1.794607 -1.998668 -0.791970
C 1.298751 2.301695 -0.452429
C -0.894858 1.961830 0.855717
C 0.479864 1.359220 0.463893
C -1.780582 2.250278 -0.397247
C 2.495267 1.559306 -1.113897
C 0.407399 2.938895 -1.509013
C -0.951189 2.916465 -1.489622
C 3.558291 1.059628 -0.110316
C -2.436085 0.975385 -0.919653
C -0.775948 3.210424 1.728042
C 4.732116 0.329803 -0.801631
C -3.740714 0.640564 -0.735553
C -4.375790 -0.652609 -1.206711
C -4.614001 -1.674888 -0.051168
C -3.316664 -2.172510 0.632904
C -2.408359 -3.035908 -0.273760
C 5.789407 -0.194705 0.195847
C -1.027638 -3.324918 0.357008
C -0.123284 -4.183339 -0.557070
C 1.323387 -4.320444 -0.041184
C 2.132313 -3.043367 -0.189522
H 1.726603 3.118196 0.174153
H -1.423691 1.221373 1.493366
H 1.049116 1.120915 1.377412
H 0.300086 0.407861 -0.073425
H -2.581877 2.949995 -0.087800
H 2.107974 0.695267 -1.689610
H 2.980929 2.242240 -1.842412
H 0.923690 3.450838 -2.335100
H -1.517436 3.385011 -2.305570
H 3.085688 0.366120 0.613206
H 3.948693 1.915804 0.479640
H -1.780180 0.289864 -1.479537
H 5.220382 1.015752 -1.522837
H 4.322242 -0.507053 -1.404144
H -4.392589 1.331355 -0.175372
H -3.741565 -1.115098 -1.986415
H -5.353481 -0.434579 -1.681820
H -5.268727 -1.204896 0.710641
H -5.175293 -2.541466 -0.457434
H -3.584562 -2.756375 1.537250
H -2.739370 -1.294227 0.986673
H -2.243252 -2.520590 -1.241005
H -2.921999 -3.990933 -0.512706
H 6.594786 -0.755259 -0.313255
H 5.338265 -0.863343 0.959034
H 6.256615 0.639596 0.751494
H -0.525833 -2.358346 0.562842
H -1.159532 -3.832834 1.335419
H 0.245274 3.902772 3.257370
H -0.100605 -3.733249 -1.568387
H -0.560387 -5.195485 -0.663930
H 1.350228 -4.622663 1.023260
H 1.871241 -5.111591 -0.590966
H 3.905506 -2.323046 0.305096


