%chk=000254979.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254979

0 1
O 1.989857 0.086176 -0.064878
O -6.651206 -0.456889 -0.785488
O -5.287421 1.833481 -0.134946
N -3.542604 -0.745812 0.330130
C -4.226959 -0.776496 -1.001890
C -4.202679 0.161243 1.315751
C -2.113175 -0.485294 0.221177
C -5.603263 -1.443972 -0.867879
C -4.332862 1.638977 0.917139
C -1.285565 -1.230358 1.076022
C -1.544013 0.424671 -0.694143
C 0.648549 -0.174659 0.110503
C 0.103298 -1.078324 1.029741
C -0.166044 0.582666 -0.758164
C 2.937706 -0.631412 0.784630
C 4.297945 -0.163481 0.344532
C 5.369980 -0.238768 1.246797
C 4.505972 0.320496 -0.953832
C 6.645186 0.165123 0.843468
C 5.783167 0.728913 -1.348211
C 6.853859 0.649471 -0.452514
H -4.348901 0.239764 -1.449194
H -3.589472 -1.368136 -1.696252
H -5.218657 -0.257506 1.511102
H -3.642920 0.081084 2.274585
H -5.719955 -2.007434 0.079177
H -5.816597 -2.113660 -1.718143
H -4.653634 2.254638 1.778343
H -3.399137 2.058978 0.499546
H -1.731402 -1.937719 1.777201
H -2.183692 1.010477 -1.355247
H 0.727930 -1.661515 1.697393
H 0.297726 1.276982 -1.455725
H 2.720785 -0.374895 1.837558
H 2.810505 -1.717399 0.613647
H -6.729816 0.025854 -1.636317
H -6.056576 1.207944 -0.016702
H 5.214901 -0.608404 2.258066
H 3.663581 0.384542 -1.645429
H 7.478361 0.104904 1.541828
H 5.942614 1.109069 -2.356114
H 7.848231 0.965381 -0.761965


%chk=000254979-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254979

0 1
O 2.069186 -0.017203 -0.426120
O -6.735065 0.012375 -0.592104
O -5.191595 1.797820 0.887034
N -3.582883 -0.635765 0.012575
C -4.348044 -0.546980 -1.247056
C -4.265595 -0.477780 1.311411
C -2.180819 -0.440183 -0.062104
C -5.813748 -1.001192 -1.172912
C -4.399413 0.983608 1.805937
C -1.356163 -0.462250 1.102278
C -1.516595 -0.240586 -1.315593
C 0.678008 -0.159744 -0.229199
C 0.046444 -0.329526 1.025007
C -0.118895 -0.111332 -1.393968
C 2.915324 -0.061888 0.765283
C 4.370818 0.082779 0.352874
C 5.367596 0.107351 1.361473
C 4.757664 0.186273 -1.003608
C 6.731612 0.230966 1.019509
C 6.124489 0.311014 -1.345693
C 7.115572 0.333153 -0.338588
H -4.313243 0.481630 -1.676259
H -3.861298 -1.220636 -1.983183
H -5.277630 -0.910598 1.234884
H -3.741741 -1.080760 2.077440
H -5.923802 -1.902567 -0.548246
H -6.154445 -1.250351 -2.196295
H -4.858841 0.968337 2.820789
H -3.409796 1.466992 1.876985
H -1.797155 -0.589354 2.094478
H -2.084368 -0.167312 -2.246141
H 0.623906 -0.357004 1.954128
H 0.371054 0.040732 -2.361048
H 2.629166 0.757568 1.460165
H 2.761509 -1.026569 1.296884
H -7.083719 0.590492 -1.314335
H -5.896525 1.208446 0.483556
H 5.078885 0.029707 2.418102
H 3.984105 0.169288 -1.775607
H 7.491989 0.248509 1.808503
H 6.413830 0.391366 -2.399814
H 8.173821 0.429874 -0.606116


