%chk=000186240.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186240

0 1
O -3.762118 0.065838 1.229257
O -0.271267 -0.652023 0.139301
O -4.114394 -2.535627 -0.964257
O 0.677805 0.455350 1.865868
C -3.652915 -0.259231 -0.199258
C -2.471138 0.309636 0.576351
C -4.505473 0.464461 -1.171397
C -1.495002 -0.837612 0.904538
C -6.003764 0.189181 -1.215062
C -5.499698 1.509594 -0.680284
C -3.414032 -1.765662 -0.369221
C -2.111736 -2.122015 0.333412
C -1.983450 1.711368 0.525077
C 2.808034 1.315156 -0.338089
C 1.910906 0.057023 -0.209242
C 3.345916 0.055356 0.339720
C 0.784357 0.020592 0.741173
C 2.511011 2.516597 0.524331
C 3.264463 1.674219 -1.731241
C 4.361704 -0.810586 -0.296613
C 5.682117 -0.567251 -0.250946
C 6.669122 -1.495467 -0.888258
C 6.269645 0.622460 0.440744
H -3.982331 0.642669 -2.121872
H -1.255569 -0.885731 1.988253
H -6.427392 -0.543961 -0.528371
H -6.505317 0.143440 -2.178903
H -5.643084 2.421328 -1.253208
H -5.560104 1.704822 0.392431
H -2.294006 -2.879157 1.120286
H -1.410632 -2.605367 -0.382488
H -1.381550 1.892013 -0.377096
H -2.819597 2.427635 0.521869
H -1.352393 1.947703 1.399345
H 1.707017 -0.509576 -1.132368
H 3.448413 0.085774 1.439137
H 3.421267 3.096780 0.719345
H 2.089463 2.239997 1.505332
H 1.787524 3.187968 0.045827
H 3.581258 0.794063 -2.307222
H 4.123113 2.357426 -1.701195
H 2.465294 2.168764 -2.297196
H 3.965244 -1.692908 -0.797814
H 7.182152 -1.008708 -1.729452
H 7.442135 -1.806826 -0.171727
H 6.205785 -2.410746 -1.278612
H 6.395760 0.421079 1.514771
H 7.254416 0.897612 0.044196
H 5.624642 1.508350 0.353526


%chk=000186240-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186240

0 1
O -3.626750 -0.107286 1.361006
O -0.114173 -0.317731 -0.027008
O -3.499300 -2.768537 -0.964582
O 1.002800 0.865920 1.661297
C -3.494807 -0.438874 -0.139752
C -2.415348 0.348993 0.570173
C -4.545848 0.079058 -1.061446
C -1.241412 -0.590353 0.912405
C -6.019100 -0.275151 -0.806071
C -5.536044 1.169408 -0.621992
C -2.994129 -1.874648 -0.248548
C -1.746339 -2.020996 0.638634
C -2.185760 1.832492 0.438124
C 2.835323 1.885105 -0.753661
C 2.021924 0.564210 -0.549997
C 3.517483 0.692253 -0.071290
C 0.976198 0.426583 0.483196
C 2.512330 3.109047 0.101147
C 3.179927 2.226211 -2.203591
C 4.574761 -0.134780 -0.706343
C 5.527657 -0.874823 -0.062718
C 6.560539 -1.660556 -0.853437
C 5.660158 -0.993563 1.445026
H -4.228370 0.086192 -2.110746
H -0.886634 -0.416922 1.943059
H -6.247286 -0.848068 0.096815
H -6.639957 -0.518028 -1.672142
H -5.832179 1.917740 -1.362727
H -5.455691 1.534597 0.405760
H -2.029400 -2.535352 1.574454
H -0.982693 -2.633203 0.131944
H -1.485474 2.034766 -0.391914
H -3.130590 2.359182 0.234352
H -1.739944 2.234440 1.365144
H 1.840726 -0.025483 -1.452526
H 3.580417 0.797152 1.018053
H 3.393828 3.776096 0.143292
H 2.233755 2.830639 1.130669
H 1.674355 3.683893 -0.337804
H 3.308465 1.331226 -2.836598
H 4.119593 2.808715 -2.246464
H 2.377716 2.840576 -2.652600
H 4.586215 -0.144372 -1.805989
H 7.589252 -1.342017 -0.590851
H 6.497647 -2.742806 -0.622297
H 6.431021 -1.534899 -1.942413
H 5.611167 -2.056867 1.752925
H 6.645822 -0.614473 1.781073
H 4.879751 -0.448905 1.999658


