%chk=000230070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230070

0 1
O 5.311692 -0.346657 -0.232282
O -5.802400 0.073428 -0.387158
O 6.515309 -1.417645 1.352003
O -6.051958 -1.968999 0.611068
C 2.495839 1.670229 0.313912
C 2.115073 0.167367 0.093553
C 0.623318 -0.050946 0.362581
C -0.161593 0.771866 -0.702521
C 4.040520 1.620525 0.169778
C 3.164433 -0.602790 0.909785
C 1.752153 2.496088 -0.750517
C 4.437506 0.262525 0.782019
C 0.233512 2.265820 -0.644124
C 0.208034 -1.524891 0.264702
C 2.154631 2.193838 1.718891
C -1.653162 0.552183 -0.561970
C -1.270931 -1.676105 0.635383
C -2.159971 -0.616850 0.041340
C -2.554544 1.490768 -1.095037
C -3.548224 -0.824219 0.126237
C -3.931991 1.303902 -1.022332
C 6.321435 -1.183011 0.182554
C -4.403972 0.136554 -0.402624
C 7.044567 -1.698964 -1.033561
C 8.550425 -1.687314 -0.810192
C -6.544721 -0.989853 0.119985
C -7.991380 -0.636370 -0.106070
C -8.821517 -0.971604 1.124869
H 2.305105 -0.080959 -0.984077
H 0.362647 0.325828 1.380921
H 0.122294 0.383551 -1.717113
H 4.542692 2.461607 0.667960
H 4.351917 1.661978 -0.890796
H 2.868226 -0.719136 1.965227
H 3.331094 -1.618925 0.517237
H 2.106178 2.224456 -1.762318
H 1.975222 3.571865 -0.632829
H 5.006950 0.341938 1.727700
H -0.145657 2.709095 0.297623
H -0.271064 2.815048 -1.462769
H 0.829255 -2.146777 0.935721
H 0.387565 -1.910285 -0.757016
H 2.668464 1.627267 2.501927
H 2.441420 3.244340 1.829346
H 1.079461 2.125164 1.925741
H -1.384699 -1.647397 1.741605
H -1.627809 -2.682197 0.329475
H -2.172702 2.390092 -1.582600
H -3.945002 -1.726377 0.598160
H -4.631181 2.028922 -1.428855
H 6.686283 -2.731254 -1.241037
H 6.771139 -1.099337 -1.929319
H 8.822721 -2.221547 0.112523
H 9.077517 -2.169745 -1.641712
H 8.940203 -0.665605 -0.718402
H -8.353845 -1.201293 -0.993761
H -8.093597 0.439657 -0.372811
H -8.547003 -0.346461 1.984578
H -9.890493 -0.817018 0.933229
H -8.687079 -2.020169 1.429569


%chk=000230070-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230070

0 1
O 5.426774 -0.210908 -0.402495
O -5.879272 0.085620 -0.232364
O 6.387767 -1.469080 1.314488
O -6.080993 -2.005480 0.839117
C 2.575523 1.915414 0.204137
C 2.176924 0.407222 0.079729
C 0.687992 0.156133 0.371310
C -0.156027 0.973886 -0.657400
C 4.105401 1.826614 -0.068721
C 3.265279 -0.324314 0.896054
C 1.754532 2.715715 -0.834545
C 4.558541 0.497710 0.601373
C 0.227883 2.482791 -0.658975
C 0.279464 -1.330092 0.290850
C 2.352074 2.498080 1.628790
C -1.661491 0.713289 -0.485789
C -1.184205 -1.509004 0.742255
C -2.136543 -0.475004 0.142689
C -2.623422 1.625585 -0.997132
C -3.528908 -0.725837 0.251038
C -4.005308 1.386671 -0.895659
C 6.293513 -1.189346 0.096734
C -4.451688 0.204706 -0.267893
C 7.063785 -1.843598 -1.041695
C 8.259910 -2.678561 -0.549517
C -6.597484 -0.998258 0.312604
C -8.085213 -0.725408 0.148230
C -8.963881 -1.857284 0.707925
H 2.346698 0.138127 -0.989269
H 0.451418 0.516469 1.395842
H 0.130385 0.577295 -1.660507
H 4.666583 2.697667 0.312900
H 4.297967 1.747288 -1.155331
H 3.042168 -0.304223 1.979049
H 3.398054 -1.381866 0.612145
H 2.055068 2.394739 -1.854249
H 1.971813 3.800123 -0.761614
H 5.170045 0.635080 1.509084
H -0.129015 2.952319 0.278600
H -0.293407 3.003472 -1.484177
H 0.940015 -1.950849 0.925227
H 0.404815 -1.684233 -0.753143
H 2.938374 1.958244 2.394509
H 2.676549 3.555686 1.649695
H 1.294084 2.469161 1.941465
H -1.231411 -1.428212 1.848538
H -1.544371 -2.526515 0.497333
H -2.293009 2.545312 -1.489226
H -3.881782 -1.639613 0.732610
H -4.740677 2.092747 -1.292343
H 6.348148 -2.480440 -1.599536
H 7.377192 -1.054304 -1.748957
H 7.933762 -3.438242 0.180731
H 8.747470 -3.189966 -1.398167
H 9.010402 -2.041847 -0.049764
H -8.281065 -0.557640 -0.928273
H -8.307795 0.239431 0.643323
H -8.772874 -2.012785 1.783407
H -10.032165 -1.612705 0.573384
H -8.756059 -2.811782 0.194978


