%chk=000268981.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268981

0 1
O -6.025908 1.791028 1.890553
O 6.788542 0.400592 1.379401
N -4.232133 0.459178 1.551497
N 5.186173 -0.883068 0.436417
C -0.050029 -1.640268 -1.728480
C -1.151396 -1.066885 -0.877295
C 1.319307 -1.430304 -1.137570
C -3.085529 0.399110 -0.601155
C 2.991201 0.029741 -0.116025
C -2.037099 -0.132081 -1.390555
C 1.702224 -0.185963 -0.654084
C -3.208835 -0.047995 0.739304
C 3.897739 -1.062178 -0.086058
C -1.291415 -1.503491 0.466265
C 2.236725 -2.509207 -1.095884
C -4.041536 1.380466 -1.105011
C 3.428128 1.320711 0.409243
C -2.298319 -1.007109 1.266175
C 3.506247 -2.335885 -0.581904
C -5.022926 1.853752 -0.293843
C 4.682989 1.462419 0.909056
C -5.187006 1.428732 1.087522
C 5.648119 0.375087 0.956417
C -3.928450 1.853665 -2.516053
C 2.481526 2.473901 0.390104
H -0.249790 -2.723821 -1.886102
H -0.066737 -1.199367 -2.750160
H -1.931558 0.204761 -2.422538
H 0.990663 0.641796 -0.684708
H -0.584479 -2.236264 0.861308
H 1.934459 -3.486433 -1.475556
H -2.402453 -1.343059 2.296454
H 4.208242 -3.167175 -0.553517
H -4.317685 0.132548 2.517241
H 5.836550 -1.672271 0.454848
H -5.757702 2.587134 -0.629925
H 5.049654 2.408331 1.311052
H -2.956708 2.333479 -2.704899
H -4.700989 2.592357 -2.777654
H -4.034959 1.021617 -3.228598
H 2.175373 2.727138 -0.636023
H 2.916241 3.386534 0.824430
H 1.568337 2.255646 0.965210


%chk=000268981-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268981

0 1
O -6.256730 1.827449 1.840208
O 7.014767 0.344088 1.328843
N -4.347377 0.524938 1.519249
N 5.308483 -0.912496 0.352946
C -0.049131 -1.598365 -1.698337
C -1.173038 -1.014752 -0.846718
C 1.357332 -1.419153 -1.124489
C -3.190606 0.408979 -0.625003
C 3.092396 0.011373 -0.085474
C -2.115316 -0.123935 -1.392781
C 1.776476 -0.186599 -0.585560
C -3.300915 0.015014 0.749227
C 4.012698 -1.089265 -0.136290
C -1.307614 -1.383875 0.524234
C 2.290947 -2.492665 -1.157910
C -4.186369 1.334739 -1.169621
C 3.552974 1.282612 0.480254
C -2.352460 -0.881742 1.312153
C 3.600007 -2.336305 -0.673557
C -5.198566 1.801849 -0.352034
C 4.849592 1.388813 0.946282
C -5.341160 1.422645 1.056556
C 5.815821 0.286857 0.909623
C -4.102582 1.769539 -2.618480
C 2.607920 2.464387 0.549345
H -0.226883 -2.681488 -1.852752
H -0.092346 -1.138761 -2.706287
H -2.021588 0.168369 -2.444917
H 1.061167 0.641848 -0.543710
H -0.576039 -2.068362 0.969023
H 1.982990 -3.461675 -1.569035
H -2.443137 -1.178268 2.363936
H 4.305031 -3.175424 -0.705694
H -4.434699 0.247985 2.502179
H 5.972524 -1.692487 0.321304
H -5.959748 2.492473 -0.726051
H 5.226028 2.321923 1.374987
H -3.140447 2.271997 -2.833039
H -4.915537 2.470422 -2.867436
H -4.177425 0.903183 -3.302617
H 2.255901 2.756115 -0.458205
H 3.101352 3.338337 1.004105
H 1.710102 2.226583 1.150447


