%chk=000266416.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266416

0 1
O 7.747644 0.559411 1.717898
O 8.133368 0.289788 -0.392673
N -5.009907 0.238694 -0.265758
N -1.440113 1.209476 0.457572
N -4.876694 2.561628 0.535271
N -2.828282 3.532944 1.071334
N -6.925935 1.624450 -0.169307
N 7.383565 0.369617 0.567814
C -3.667214 0.117284 -0.136810
C -3.141954 -1.242324 -0.431412
C -2.836002 1.188133 0.283162
C -2.615855 -2.022528 0.610140
C -3.202831 -1.750387 -1.736626
C -3.508329 2.421879 0.640383
C 3.196782 -0.039444 -0.145004
C -2.135136 -3.304931 0.336290
C -2.714446 -3.033246 -2.001801
C -5.571676 1.475722 0.047563
C -2.180017 -3.809055 -0.968531
C 3.673993 0.174512 1.161948
C 4.109057 -0.125280 -1.215576
C 5.935687 0.226929 0.321563
C 1.759272 -0.189417 -0.412041
C 5.039888 0.307547 1.399734
C 5.475338 0.010872 -0.988287
C 0.816948 0.569215 0.167876
C -0.617497 0.395181 -0.130048
H -2.587079 -1.628247 1.625881
H -3.641568 -1.150189 -2.534123
H -1.729078 -3.915043 1.141985
H -2.760035 -3.430932 -3.014696
H -1.804747 -4.809814 -1.177486
H 2.971714 0.227565 1.994771
H 3.742911 -0.291159 -2.229304
H 1.504168 -0.967837 -1.137850
H 5.422899 0.473089 2.412969
H 6.194213 -0.048356 -1.813166
H 1.065650 1.360656 0.883132
H -0.869296 -0.414382 -0.830602
H -1.838306 3.479721 1.265565
H -3.330988 4.357978 1.359726
H -7.397250 2.446877 0.174838
H -7.484762 0.811601 -0.382716


%chk=000266416-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266416

0 1
O 7.946915 0.996467 1.566096
O 8.286436 -0.387834 -0.220024
N -5.003912 0.303433 -0.468006
N -1.500610 1.175103 0.661703
N -4.948384 2.450482 0.714592
N -2.938479 3.219849 1.639960
N -6.881879 1.687113 -0.357139
N 7.515102 0.283729 0.574509
C -3.674836 0.102329 -0.211067
C -3.177418 -1.263879 -0.557518
C -2.878336 1.114013 0.427564
C -2.367616 -2.005080 0.344736
C -3.597576 -1.874794 -1.767186
C -3.616731 2.266814 0.935659
C 3.267335 0.142699 -0.112668
C -1.970573 -3.321676 0.030702
C -3.187163 -3.187074 -2.087569
C -5.562996 1.482359 -0.032611
C -2.370335 -3.914854 -1.191099
C 3.814047 0.909163 0.965636
C 4.175544 -0.573997 -0.953158
C 6.061156 0.234123 0.337038
C 1.835875 0.059860 -0.390659
C 5.195946 0.958239 1.193473
C 5.561923 -0.534978 -0.739280
C 0.821036 0.691861 0.301274
C -0.572006 0.549298 -0.047929
H -2.065464 -1.557416 1.297830
H -4.253155 -1.311937 -2.438999
H -1.357657 -3.887775 0.740787
H -3.510686 -3.644036 -3.029350
H -2.057398 -4.936217 -1.435033
H 3.148631 1.469711 1.629414
H 3.775290 -1.166420 -1.784041
H 1.549646 -0.574388 -1.242753
H 5.625036 1.539541 2.013755
H 6.262016 -1.079668 -1.377844
H 1.029798 1.334257 1.166305
H -0.815029 -0.082253 -0.920974
H -1.942077 3.063832 1.798001
H -3.436979 4.029348 2.000649
H -7.344917 2.536853 -0.046047
H -7.381423 0.961998 -0.865135


