%chk=000227801.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227801

0 1
O -4.682739 0.210074 -0.059383
O -4.071785 -1.727171 -1.017534
O -4.797745 2.270871 0.831480
C 2.645058 -0.742641 0.349371
C 4.099404 -0.638170 -0.128355
C 2.063542 -2.135970 0.076081
C 4.680862 0.754793 0.147528
C 0.604998 -2.254535 0.540943
C -2.343111 0.022163 -0.577831
C 6.135698 0.861468 -0.331222
C -2.625763 1.410015 0.020901
C -0.330431 -1.413906 -0.272487
C -1.391869 -0.789714 0.249092
C -3.712896 -0.665942 -0.614583
C 6.719772 2.245726 -0.058545
C -4.102217 1.436732 0.338850
H 2.026723 0.027841 -0.150432
H 2.586757 -0.516457 1.431697
H 4.717218 -1.408648 0.372399
H 4.158538 -0.862365 -1.210919
H 2.139664 -2.374210 -1.002761
H 2.672466 -2.903718 0.593824
H 4.065326 1.527776 -0.351148
H 4.626023 0.980010 1.230024
H 0.535377 -2.008150 1.620730
H 0.278168 -3.316406 0.464552
H -1.975726 0.119931 -1.631405
H 6.193158 0.638770 -1.414707
H 6.754113 0.090377 0.168768
H -2.361868 2.230254 -0.676038
H -2.027039 1.609188 0.934598
H -0.092063 -1.358407 -1.337621
H -1.633786 -0.844425 1.310828
H 7.758010 2.312090 -0.403013
H 6.153882 3.031746 -0.571258
H 6.714279 2.483210 1.011376


%chk=000227801-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227801

0 1
O -4.476672 0.835489 0.131335
O -4.301101 -1.493109 0.200780
O -3.989097 3.115570 -0.014967
C 2.572352 -0.940342 0.287008
C 4.014758 -0.635019 -0.177240
C 2.086208 -2.349598 -0.115795
C 4.491422 0.781614 0.213981
C 0.634074 -2.659979 0.347963
C -2.293058 -0.104196 -0.413277
C 5.930987 1.096786 -0.254618
C -2.153663 1.421677 -0.172996
C -0.402721 -1.794594 -0.332658
C -1.275105 -0.968722 0.298299
C -3.747696 -0.412315 0.005214
C 6.393490 2.517886 0.132643
C -3.576230 1.955067 -0.029345
H 1.883221 -0.178960 -0.132505
H 2.512015 -0.836941 1.391063
H 4.708455 -1.387520 0.253058
H 4.077832 -0.750332 -1.279870
H 2.151943 -2.462395 -1.218063
H 2.766476 -3.110588 0.316508
H 3.796095 1.533945 -0.214602
H 4.432190 0.897743 1.316571
H 0.560931 -2.542459 1.446824
H 0.411667 -3.723886 0.124061
H -2.244136 -0.318043 -1.499728
H 5.990188 0.974887 -1.355623
H 6.626875 0.349091 0.177969
H -1.627394 1.955340 -0.979678
H -1.608849 1.632339 0.766119
H -0.430633 -1.856323 -1.433665
H -1.264872 -0.898365 1.396196
H 7.425098 2.716340 -0.211695
H 5.734243 3.285217 -0.315565
H 6.370704 2.656899 1.230099


