%chk=000276582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276582

0 1
O 4.759388 -1.209355 0.085238
O -0.207153 4.007211 -1.530839
O 3.521031 -0.845350 -1.744696
O 1.098896 3.862314 0.281803
N 0.108530 -1.326011 3.123018
C -0.052302 -0.369917 0.675141
C 1.112796 -1.002808 -0.129016
C 0.076884 1.175703 0.763584
C -1.414632 -0.726477 0.076933
C 2.489425 -0.739369 0.484658
C -0.020210 1.856041 -0.601627
C 0.029074 -0.904434 2.051645
C -2.557785 -0.695167 0.892349
C -1.553303 -1.041627 -1.281904
C 3.568703 -0.924777 -0.539564
C 0.378196 3.298265 -0.506172
C -3.814264 -0.991131 0.358416
C -2.812738 -1.336476 -1.813367
C -3.945646 -1.314184 -0.995839
H 0.945883 -2.097613 -0.217147
H 1.092294 -0.614493 -1.173727
H 1.042550 1.444404 1.249382
H -0.711252 1.574362 1.437016
H 2.561477 0.299290 0.889937
H 2.673834 -1.396900 1.365805
H -1.048951 1.763539 -1.022545
H 0.639284 1.355575 -1.349931
H -2.477972 -0.443163 1.950444
H -0.686210 -1.061332 -1.942364
H -4.693876 -0.970267 1.001669
H -2.907972 -1.584620 -2.870244
H -4.925375 -1.546623 -1.410432
H 5.515060 -1.321146 -0.553619
H 0.042937 4.970535 -1.526207


%chk=000276582-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276582

0 1
O 4.926545 -1.084187 0.034817
O 0.144792 4.130912 -1.548307
O 3.504392 -1.907671 -1.606064
O -0.396128 4.035788 0.708098
N 0.225959 -1.425260 3.082419
C 0.005745 -0.372400 0.626867
C 1.173909 -0.951923 -0.237448
C 0.108267 1.192818 0.795677
C -1.390226 -0.732856 0.045035
C 2.573697 -0.713208 0.356761
C 0.083789 1.948789 -0.545055
C 0.113458 -0.961421 1.988670
C -2.540704 -0.557653 0.858234
C -1.564061 -1.183134 -1.286992
C 3.660057 -1.303237 -0.522146
C -0.084499 3.443463 -0.347390
C -3.830912 -0.821354 0.354091
C -2.858044 -1.446438 -1.794515
C -3.996097 -1.264724 -0.979180
H 1.018744 -2.037633 -0.369027
H 1.133030 -0.508820 -1.247672
H 1.024431 1.447954 1.358801
H -0.736491 1.537136 1.416961
H 2.797852 0.362987 0.483974
H 2.667447 -1.159842 1.365236
H -0.759573 1.601312 -1.174512
H 0.998878 1.786386 -1.142900
H -2.426914 -0.230429 1.899042
H -0.702055 -1.347123 -1.940493
H -4.704395 -0.686172 1.001139
H -2.971644 -1.797207 -2.826211
H -4.997121 -1.472050 -1.372693
H 5.621701 -1.484566 -0.555272
H 0.002774 5.105761 -1.402146


