%chk=000296520.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296520

0 1
O 4.928703 1.538660 -0.818257
O 5.881880 -1.074954 0.130917
O -4.598239 0.601350 -1.585959
O -6.184859 -0.187419 0.675498
O -0.981218 2.243030 -1.374219
N 0.082787 1.598086 0.542537
C -0.527456 -0.768841 0.973795
C 0.311578 0.198954 0.091957
C -0.143875 -2.215683 0.612044
C 1.316879 -2.486027 0.979350
C 1.793752 -0.133077 0.121851
C 2.252819 -1.405812 0.512332
C -2.021916 -0.583931 0.824520
C 2.715072 0.836598 -0.302799
C 3.625964 -1.697902 0.475810
C -2.585684 -0.094030 -0.364013
C -2.857371 -0.925004 1.894601
C 4.081426 0.551129 -0.323957
C 4.540936 -0.729810 0.056187
C -3.963710 0.085511 -0.471366
C -0.588347 2.524596 -0.250177
C -4.243870 -0.777849 1.789995
C -4.811081 -0.271492 0.614134
C 5.842986 2.069419 0.181080
C 6.607121 -0.954966 -1.124799
C -3.754123 1.136711 -2.639843
C -6.882625 0.346125 -0.477452
H -0.253547 -0.586508 2.045140
H -0.034294 0.119018 -0.983865
H -0.808395 -2.928315 1.138175
H -0.312218 -2.394672 -0.468240
H 1.417956 -2.591892 2.081762
H 1.625939 -3.466972 0.560219
H 0.391003 1.825866 1.481504
H 2.384089 1.822913 -0.633133
H 3.999296 -2.678565 0.769501
H -1.932885 0.175375 -1.200301
H -2.437261 -1.310632 2.821035
H -0.721124 3.517479 0.208081
H -4.900142 -1.047213 2.616591
H 6.470215 2.742311 -0.413137
H 6.430235 1.262317 0.633029
H 5.275538 2.618851 0.936420
H 6.271900 -1.744649 -1.802865
H 6.463843 0.036802 -1.569768
H 7.643592 -1.112404 -0.808856
H -3.014110 1.843305 -2.235633
H -3.267886 0.314757 -3.171519
H -4.485568 1.647754 -3.274709
H -6.690572 -0.279372 -1.356003
H -7.927924 0.286001 -0.156294
H -6.571008 1.379873 -0.659301


%chk=000296520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296520

0 1
O 5.097878 1.572048 -0.603884
O 5.956980 -1.154536 0.072493
O -4.681678 0.804353 -1.597525
O -6.267702 0.205966 0.711847
O -0.808092 2.471926 -1.505449
N 0.136167 1.702226 0.499247
C -0.547673 -0.676096 0.916992
C 0.341189 0.296708 0.088535
C -0.198692 -2.132021 0.493949
C 1.247902 -2.482931 0.893513
C 1.830340 -0.090899 0.136848
C 2.248046 -1.407629 0.483563
C -2.048372 -0.402796 0.817530
C 2.808162 0.872920 -0.212892
C 3.627799 -1.721582 0.440706
C -2.655286 0.047735 -0.380734
C -2.876421 -0.655270 1.937618
C 4.180208 0.561023 -0.227795
C 4.596139 -0.767308 0.076684
C -4.049393 0.267256 -0.464021
C -0.429483 2.660643 -0.311651
C -4.274318 -0.481285 1.851043
C -4.881674 -0.026628 0.661462
C 6.065919 1.946118 0.453606
C 6.617096 -1.072008 -1.252529
C -3.824940 1.219375 -2.721214
C -7.097547 -0.300285 -0.400355
H -0.256556 -0.571368 1.985586
H 0.016712 0.264356 -0.970127
H -0.907833 -2.832698 0.970551
H -0.335314 -2.230599 -0.601575
H 1.293355 -2.618181 1.994834
H 1.542708 -3.454764 0.453754
H 0.390326 1.959425 1.456275
H 2.513894 1.893334 -0.477809
H 3.974732 -2.733428 0.679768
H -2.033704 0.292541 -1.245560
H -2.431036 -0.995318 2.880514
H -0.523062 3.646816 0.195276
H -4.928071 -0.678295 2.706636
H 6.730316 2.692432 -0.007897
H 6.643869 1.066938 0.791262
H 5.533757 2.396644 1.313199
H 6.149957 -1.790119 -1.952859
H 6.550562 -0.049577 -1.665800
H 7.666744 -1.350963 -1.074266
H -3.047626 1.934730 -2.395864
H -3.344919 0.342155 -3.197321
H -4.511862 1.698028 -3.434863
H -6.982762 -1.397621 -0.499235
H -8.131905 -0.058224 -0.111193
H -6.830632 0.191534 -1.349273


