%chk=000258583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258583

0 1
O 0.649963 0.725711 0.348352
O -5.223686 -0.646999 -0.283884
O -3.694737 -2.269525 -0.338866
O 0.465333 -3.087622 0.620803
N -1.084723 -1.521895 0.151790
C -0.718260 0.925302 0.166855
C -1.210309 2.237341 0.157820
C -1.577872 -0.210347 0.081368
C -2.968115 0.031851 -0.092579
C 1.396845 0.662316 -0.921616
C -2.598920 2.440209 0.015799
C -3.451564 1.358043 -0.118902
C 2.771715 0.225527 -0.504843
C -0.289776 3.398935 0.292882
C 3.651705 1.148244 0.079451
C 3.176757 -1.104321 -0.693123
C -3.913983 -1.075879 -0.242304
C 4.933511 0.743892 0.462934
C 4.460111 -1.502455 -0.309564
C 5.339632 -0.579903 0.266894
C 0.182128 -1.912451 0.691968
H 1.379757 1.670067 -1.371060
H 0.894653 -0.050779 -1.597759
H -2.994677 3.454458 0.009057
H -4.529386 1.517701 -0.245516
H 0.719043 3.088179 0.615001
H -0.184493 3.941711 -0.657714
H -0.654142 4.120788 1.039224
H -1.724163 -2.296854 -0.136559
H 3.332881 2.176223 0.242945
H 2.495280 -1.833590 -1.132254
H 5.615461 1.460812 0.917543
H 4.771935 -2.536469 -0.455169
H 6.338509 -0.893766 0.566110
H 0.801776 -1.108878 1.131019
H -5.857988 -1.409976 -0.387601


%chk=000258583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258583

0 1
O 0.623361 0.554774 0.452606
O -5.374275 -0.499416 -0.485805
O -3.826957 -2.212823 -0.532717
O 0.073423 -3.429533 0.553872
N -1.283541 -1.601003 0.092087
C -0.758140 0.832823 0.271033
C -1.184327 2.183269 0.309540
C -1.681643 -0.247777 0.093921
C -3.068272 0.081447 -0.124118
C 1.399858 0.482402 -0.845220
C -2.565627 2.471130 0.139447
C -3.483945 1.440405 -0.092798
C 2.843282 0.208382 -0.508080
C -0.179797 3.296963 0.524040
C 3.743272 1.282379 -0.292387
C 3.314785 -1.123763 -0.384788
C -4.063172 -0.975345 -0.386745
C 5.092074 1.032819 0.043333
C 4.663144 -1.375880 -0.048671
C 5.554352 -0.298561 0.165730
C -0.131965 -2.188344 0.636815
H 1.275099 1.450141 -1.367709
H 0.958112 -0.322702 -1.463855
H -2.905131 3.511510 0.179953
H -4.543055 1.658963 -0.248714
H 0.717011 2.922749 1.043407
H 0.144848 3.731808 -0.441925
H -0.624804 4.116605 1.114158
H -2.015356 -2.262204 -0.237688
H 3.384348 2.314917 -0.386482
H 2.628808 -1.964190 -0.546502
H 5.780365 1.869405 0.206917
H 5.016746 -2.408283 0.045168
H 6.600898 -0.494830 0.424471
H 0.550659 -1.482119 1.138745
H -5.974235 -1.270519 -0.672536


