%chk=000271301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271301

0 1
O -3.562127 0.333398 2.272852
O -2.620416 2.186318 -1.769932
O -3.769451 -0.434339 -1.938300
O 0.097267 3.006080 -0.095070
O -3.400419 -2.574566 -1.326109
O 1.859092 -2.698738 0.611883
O 2.626034 2.605015 0.032393
O 4.291904 -3.119300 0.471066
O 5.072668 2.296390 -0.056225
C -3.904410 0.228400 0.879284
C -2.897950 -0.795096 0.261026
C -3.839413 1.622706 0.239319
C -2.491389 2.070752 -0.348108
C -1.511700 -0.217956 0.142891
C -1.335503 1.145931 -0.039206
C -5.350419 -0.309491 0.889577
C -0.396762 -1.081406 0.281854
C -0.007999 1.670860 -0.015013
C -3.357545 -1.403126 -1.044785
C 0.887869 -0.567182 0.258318
C 1.112874 0.819125 0.118549
C -5.490198 -1.669089 1.563419
C 2.047727 -1.520585 0.408495
C 2.466871 1.388201 0.101977
C 3.418229 -0.939199 0.299533
C 3.620217 0.454543 0.161283
C 4.537419 -1.782999 0.340558
C 4.931459 0.945639 0.074447
C -4.210755 -0.897623 -3.245289
C 5.861980 -1.276191 0.249114
C 6.058170 0.080959 0.117707
H -2.857723 -1.653371 1.004725
H -4.180550 2.364288 0.991317
H -4.588683 1.689932 -0.583359
H -2.251230 3.124223 -0.054149
H -5.736804 -0.352011 -0.148102
H -5.985060 0.426420 1.429096
H -0.546922 -2.159894 0.405092
H -2.708165 0.795567 2.398566
H -5.065421 -2.481538 0.962131
H -4.986825 -1.673581 2.542015
H -6.544165 -1.914325 1.739789
H -2.806389 1.303430 -2.176765
H 1.095508 3.335678 -0.094098
H -4.705208 -0.012734 -3.660563
H -4.902076 -1.740577 -3.135723
H -3.332186 -1.191080 -3.828321
H 6.707669 -1.962272 0.284766
H 7.062815 0.496314 0.047151
H 5.128215 -3.655320 0.488548
H 6.026078 2.570220 -0.118223


%chk=000271301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271301

0 1
O -3.371173 0.308427 2.326059
O -2.701497 2.240966 -1.806950
O -3.274668 -0.486715 -2.236687
O 0.074903 3.047050 -0.124304
O -4.283606 -2.338554 -1.273157
O 1.788378 -2.780252 0.346739
O 2.542296 2.677149 -0.026799
O 4.366881 -3.180040 0.411949
O 5.120705 2.385119 0.027638
C -3.922885 0.195078 0.954331
C -2.990284 -0.822662 0.181189
C -3.930930 1.590546 0.279134
C -2.584620 2.079904 -0.335131
C -1.581169 -0.243693 0.072979
C -1.406977 1.155635 -0.058732
C -5.364851 -0.324353 1.154764
C -0.460916 -1.104571 0.178345
C -0.082020 1.690276 -0.048898
C -3.584484 -1.312134 -1.139278
C 0.846859 -0.587578 0.150762
C 1.056872 0.816691 0.050945
C -5.479644 -1.656053 1.924686
C 2.003424 -1.530951 0.251950
C 2.406928 1.387935 0.050196
C 3.385071 -0.946732 0.235052
C 3.581322 0.483428 0.136216
C 4.527815 -1.799588 0.316342
C 4.909886 1.011328 0.122221
C -3.816915 -0.929944 -3.550125
C 5.834795 -1.245575 0.299627
C 6.022499 0.134757 0.204131
H -2.948172 -1.728564 0.811430
H -4.275249 2.303947 1.049821
H -4.682079 1.612698 -0.531616
H -2.341638 3.097189 0.003977
H -5.851330 -0.418698 0.164650
H -5.908254 0.468132 1.704828
H -0.586392 -2.186628 0.288324
H -2.469334 0.720568 2.276892
H -5.091950 -2.502177 1.330654
H -4.924910 -1.599990 2.876397
H -6.539055 -1.871876 2.152969
H -2.839581 1.320465 -2.171491
H 1.106576 3.224687 -0.107864
H -3.442638 -0.191166 -4.272684
H -4.918568 -0.939008 -3.520530
H -3.446112 -1.940883 -3.782048
H 6.706704 -1.908895 0.362391
H 7.040116 0.544848 0.192787
H 5.252651 -3.625856 0.460129
H 6.093426 2.583114 0.027193


