%chk=000225072.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225072

0 1
O -3.325419 2.627052 -0.036126
O -5.638665 -1.238371 -1.064002
N -0.987950 0.787215 0.841442
N -1.181604 -1.490745 0.696269
N -3.512406 -1.517011 -0.229260
N -4.482603 0.700433 -0.548485
C 4.560845 -0.401643 -0.058953
C 4.656532 1.059001 -0.545296
C 5.931629 -0.873767 0.470716
C 3.488383 -0.559400 1.039060
C 5.741284 1.212525 -1.620307
C 7.019091 -0.721653 -0.601718
C 7.104242 0.724158 -1.110265
C 2.067730 -0.418999 0.481064
C 1.016444 -0.600596 1.587936
C -0.361866 -0.437969 1.052252
C -2.268713 0.514455 0.325263
C -2.355673 -0.903926 0.247967
C -0.470893 2.132633 1.098259
C -3.327072 1.410252 -0.069832
C -4.621578 -0.718160 -0.645237
C -3.596653 -2.995470 -0.306452
C -5.664164 1.490032 -0.993961
H 4.281741 -1.046025 -0.928328
H 3.681529 1.389051 -0.947783
H 4.880058 1.726159 0.308117
H 6.209909 -0.292175 1.369494
H 5.870935 -1.929290 0.793360
H 3.660311 0.181226 1.842582
H 3.599353 -1.551764 1.519757
H 5.455338 0.644012 -2.526105
H 5.812960 2.270597 -1.933523
H 7.996994 -1.035220 -0.191384
H 6.809369 -1.404030 -1.447818
H 7.857737 0.797496 -1.916063
H 7.458418 1.386248 -0.297166
H 1.945289 0.567411 -0.006582
H 1.896193 -1.171983 -0.316235
H 1.199297 0.106625 2.423342
H 1.112352 -1.620429 2.031974
H 0.467610 2.310104 0.543624
H -1.211470 2.900629 0.771836
H -0.284197 2.286689 2.176201
H -4.580638 -3.300645 -0.711044
H -3.468054 -3.437507 0.697729
H -2.800063 -3.388745 -0.963075
H -5.457020 2.571489 -0.885865
H -6.549340 1.232286 -0.387151
H -5.894732 1.273144 -2.051330


%chk=000225072-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225072

0 1
O -3.492396 2.690009 0.141148
O -5.653828 -1.291019 -1.173798
N -1.087022 0.844798 0.929804
N -1.193701 -1.419397 0.638300
N -3.481650 -1.486870 -0.305319
N -4.551642 0.669293 -0.509606
C 4.597972 -0.424570 -0.063793
C 4.705465 0.983193 -0.708300
C 5.969550 -0.839326 0.532249
C 3.485143 -0.504595 1.012469
C 5.841228 1.059911 -1.757281
C 7.107434 -0.770171 -0.513516
C 7.200100 0.635553 -1.152749
C 2.050623 -0.332550 0.465161
C 0.976927 -0.506848 1.579126
C -0.425283 -0.372479 1.067657
C -2.351095 0.562275 0.382009
C -2.376038 -0.832120 0.217913
C -0.595782 2.182147 1.308589
C -3.447235 1.422385 0.024813
C -4.621400 -0.743364 -0.691189
C -3.476778 -2.953896 -0.461904
C -5.759375 1.418523 -0.926319
H 4.348117 -1.150058 -0.870855
H 3.745398 1.266592 -1.181986
H 4.899329 1.725970 0.095748
H 6.211229 -0.162269 1.379743
H 5.900347 -1.862876 0.952455
H 3.679322 0.263379 1.792028
H 3.552652 -1.489203 1.521537
H 5.596668 0.389493 -2.607562
H 5.907654 2.085772 -2.169383
H 8.072675 -1.042623 -0.043727
H 6.916757 -1.519243 -1.310218
H 7.988085 0.652043 -1.930656
H 7.499982 1.370400 -0.376548
H 1.936717 0.664002 -0.004201
H 1.859844 -1.081014 -0.328369
H 1.164448 0.228023 2.386437
H 1.075690 -1.513983 2.020917
H 0.354473 2.404783 0.794322
H -1.356655 2.920184 1.010671
H -0.440402 2.244058 2.400066
H -4.447388 -3.245892 -0.888213
H -3.328275 -3.438077 0.517799
H -2.656761 -3.259889 -1.132940
H -5.569276 2.482912 -0.725641
H -6.636549 1.066861 -0.359164
H -5.954499 1.255172 -1.998827


