%chk=000245212.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245212

0 1
O -0.809386 3.342381 -1.344095
N 0.050741 1.444143 -0.647989
N 4.848539 -1.375632 0.542423
N -4.769587 -1.503306 0.066794
N 0.174094 2.711036 -1.072952
C 1.292999 0.739367 -0.363775
C -1.192911 0.712919 -0.454882
C 3.696876 -0.626912 0.159912
C -3.606676 -0.686126 -0.057416
C 1.497761 -0.546359 -0.893588
C -1.340499 -0.135341 0.656112
C 2.285385 1.346159 0.422409
C -2.253482 0.869039 -1.361975
C 2.684148 -1.221504 -0.632728
C -2.529833 -0.827454 0.851800
C 3.476027 0.671817 0.676275
C -3.446432 0.180360 -1.163897
C 5.243416 -2.489941 -0.363928
C 6.033357 -0.587915 0.983435
C -5.084108 -1.997899 1.436517
C -5.994445 -1.019016 -0.629200
H 0.725703 -1.014434 -1.507066
H -0.521166 -0.253191 1.367483
H 2.128932 2.347634 0.827087
H -2.150792 1.541405 -2.216974
H 2.821016 -2.221555 -1.040754
H -2.619157 -1.488883 1.711573
H 4.232260 1.157359 1.290530
H -4.253294 0.314933 -1.881866
H 4.401613 -3.197287 -0.468745
H 6.076521 -3.052665 0.088526
H 5.550162 -2.158558 -1.368303
H 6.817234 -1.274623 1.343081
H 5.753620 0.051553 1.839453
H 6.462418 0.049647 0.194638
H -5.328548 -1.197904 2.152657
H -4.224891 -2.570220 1.828956
H -5.935719 -2.696085 1.387326
H -6.377097 -0.061568 -0.242331
H -6.790710 -1.775975 -0.539975
H -5.784187 -0.903497 -1.707345


%chk=000245212-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245212

0 1
O -0.933329 3.449629 -0.842316
N 0.049535 1.413382 -0.471847
N 5.068608 -1.219828 0.210758
N -4.958032 -1.256573 0.144032
N 0.174486 2.810358 -0.735974
C 1.304888 0.741624 -0.270846
C -1.210684 0.728211 -0.336628
C 3.835559 -0.577382 0.049505
C -3.729723 -0.607853 -0.013306
C 1.467957 -0.612695 -0.655492
C -1.433843 -0.139574 0.762336
C 2.415472 1.434799 0.274331
C -2.259224 0.934331 -1.268348
C 2.702399 -1.264219 -0.492940
C -2.661309 -0.802381 0.921772
C 3.654864 0.791970 0.428040
C -3.491089 0.277196 -1.113562
C 5.221837 -2.623722 -0.186326
C 6.216467 -0.480799 0.748581
C -5.183220 -2.134729 1.298149
C -6.038690 -1.028160 -0.822939
H 0.623220 -1.157756 -1.088917
H -0.635087 -0.296414 1.495174
H 2.298103 2.478704 0.576180
H -2.111268 1.605711 -2.117176
H 2.784627 -2.309412 -0.803255
H -2.790266 -1.464506 1.782283
H 4.485335 1.359925 0.856048
H -4.275345 0.463418 -1.852090
H 4.527564 -3.286929 0.369563
H 6.249607 -2.955797 0.029585
H 5.037171 -2.771534 -1.270666
H 7.092913 -1.146461 0.793402
H 6.022165 -0.106035 1.774596
H 6.482489 0.389702 0.114027
H -5.076096 -1.590271 2.258934
H -4.475874 -2.989226 1.310832
H -6.204689 -2.543998 1.253406
H -6.342209 0.038265 -0.859673
H -6.920664 -1.621318 -0.534284
H -5.744725 -1.333752 -1.847745


