%chk=000230943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230943

0 1
O -0.947645 -1.894042 -0.328917
N 0.297290 -1.819458 1.594436
N 0.648228 1.168691 1.947324
N -2.479774 0.286848 0.301855
N -0.454836 2.108068 -0.009951
N -3.556209 -0.134037 0.769125
C -1.281714 0.021707 1.151025
C 1.070396 -3.035440 1.242926
C 2.308251 -2.703470 0.442343
C -0.628035 -1.307128 0.687536
C -0.265775 1.168040 1.013956
C 1.723553 2.165627 2.040056
C 2.554660 2.345840 0.789846
C 3.566958 -2.670020 1.055850
C 2.191180 -2.435565 -0.930174
C 3.080860 1.231411 0.120421
C 2.816767 3.635484 0.304872
C 4.705849 -2.386145 0.294994
C 3.331275 -2.154848 -1.685585
C 4.590772 -2.133860 -1.075108
C 3.858263 1.408607 -1.026638
C 3.598782 3.807379 -0.841036
C 4.118812 2.695185 -1.509892
C -4.754469 0.044779 -0.020225
C -4.803604 -0.221608 -1.399032
C -5.915230 0.405800 0.688237
C -6.026096 -0.125007 -2.067963
C -7.125268 0.507194 0.000325
C -7.183091 0.241615 -1.373112
H -1.550021 -0.074468 2.248049
H 1.324247 -3.565148 2.189140
H 0.412226 -3.728865 0.659042
H 0.719978 -1.206735 2.301206
H 2.389053 1.804677 2.866215
H 1.308561 3.140994 2.388979
H 3.664650 -2.867474 2.121541
H 1.202637 -2.446196 -1.399607
H 2.884180 0.224035 0.494414
H 2.418726 4.507088 0.821417
H 5.684196 -2.364325 0.772277
H 3.239016 -1.956531 -2.752332
H 0.344551 2.655107 -0.303847
H -1.090753 1.879052 -0.765374
H 5.479949 -1.925176 -1.666742
H 4.262708 0.537766 -1.542854
H 3.803579 4.810454 -1.211676
H 4.726523 2.830121 -2.402226
H -3.896812 -0.510287 -1.933524
H -5.864591 0.601544 1.759248
H -6.075035 -0.335575 -3.135864
H -8.029717 0.790835 0.537420
H -8.132606 0.318462 -1.900696


%chk=000230943-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230943

0 1
O -1.359773 -2.179443 0.440947
N 0.469677 -1.515993 1.749136
N 0.795080 1.155810 2.083516
N -2.424643 0.417321 0.457413
N -0.565093 2.247603 0.401974
N -3.528952 -0.162113 0.811900
C -1.319331 0.132672 1.396360
C 1.202418 -2.791993 1.646875
C 2.305956 -2.764232 0.590401
C -0.725975 -1.317343 1.116040
C -0.263186 1.248262 1.300085
C 1.801639 2.245957 2.073976
C 2.549321 2.452983 0.750024
C 3.672883 -2.800951 0.959866
C 1.968058 -2.691185 -0.787256
C 2.966965 1.346978 -0.034752
C 2.867826 3.762730 0.308291
C 4.688646 -2.763973 -0.024748
C 2.979592 -2.655776 -1.771521
C 4.344262 -2.691516 -1.393687
C 3.693213 1.548134 -1.228906
C 3.596817 3.966597 -0.887053
C 4.012110 2.858044 -1.659683
C -4.625109 -0.002139 -0.106932
C -4.498474 0.461329 -1.445474
C -5.893066 -0.383026 0.400741
C -5.646272 0.561405 -2.254127
C -7.040155 -0.271505 -0.413021
C -6.918958 0.202139 -1.740610
H -1.696044 0.079142 2.437644
H 1.631681 -3.026442 2.638267
H 0.456484 -3.569126 1.398971
H 0.903193 -0.648458 2.161145
H 2.536118 1.998113 2.863199
H 1.331979 3.209783 2.373333
H 3.945381 -2.859648 2.021414
H 0.910671 -2.668629 -1.076951
H 2.718610 0.328473 0.284216
H 2.555496 4.627974 0.908150
H 5.742206 -2.793009 0.275717
H 2.705758 -2.608855 -2.831805
H 0.120237 2.958092 0.149687
H -1.414545 2.109236 -0.155488
H 5.129316 -2.670395 -2.158273
H 4.008057 0.679470 -1.818131
H 3.837264 4.985151 -1.212860
H 4.576157 3.012346 -2.586465
H -3.504926 0.713017 -1.829422
H -5.949354 -0.759897 1.427159
H -5.556501 0.908447 -3.289613
H -8.020643 -0.559935 -0.019647
H -7.806676 0.279376 -2.378320


