%chk=000290268.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290268

0 1
O -7.101186 1.956712 1.518597
N -0.721042 -0.606635 -1.096339
N -3.998675 1.113789 -0.342568
N 4.667920 2.547933 0.733978
C 0.459505 0.072060 -0.651124
C 1.320096 -0.900549 0.023178
C 0.598859 -2.171014 0.034149
C -0.664061 -1.950130 -0.607807
C 0.860814 1.382822 -0.850361
C 2.559136 -0.538426 0.503496
C -2.025507 0.045856 -1.320227
C 2.136646 1.770197 -0.319075
C 2.972210 0.827186 0.345371
C -2.674198 0.516629 0.000582
C -1.605807 -2.970985 -0.745318
C 0.902843 -3.438741 0.519243
C 0.047453 2.392555 -1.591908
C 3.470045 -1.510400 1.175671
C 2.619100 3.117638 -0.430396
C 4.238262 1.296149 0.847944
C -1.270819 -4.233049 -0.243645
C -0.036914 -4.466443 0.378177
C 3.844825 3.460725 0.088105
C -4.866149 1.281501 0.860479
C -6.265701 1.708090 0.381618
H -1.879712 0.904259 -2.023324
H -2.701483 -0.670442 -1.844457
H -2.822034 -0.358847 0.672463
H -1.994973 1.212635 0.538538
H -2.562485 -2.798762 -1.229349
H 1.865090 -3.624153 1.003364
H 0.672525 2.987901 -2.274994
H -0.730708 1.932786 -2.223585
H -0.448203 3.088231 -0.900632
H 4.431489 -1.590409 0.646294
H 3.679729 -1.212789 2.213811
H 3.052158 -2.530604 1.219352
H 2.005008 3.865188 -0.928004
H 4.911565 0.598494 1.364003
H -1.985320 -5.050454 -0.339711
H 0.194231 -5.460312 0.755692
H -3.855021 2.028099 -0.788144
H 4.249262 4.476190 0.024779
H -4.481759 2.020632 1.596742
H -4.933231 0.311156 1.399386
H -6.729206 0.948598 -0.271865
H -6.257283 2.685658 -0.135793
H -7.302796 1.123773 1.987914


%chk=000290268-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290268

0 1
O -7.722768 1.983519 0.673125
N -0.738006 -0.463096 -0.419562
N -4.223382 1.035024 -0.415127
N 5.139405 2.389597 -0.015162
C 0.533385 0.149022 -0.275635
C 1.485224 -0.890140 0.105575
C 0.734309 -2.142290 0.223083
C -0.626424 -1.835819 -0.109390
C 0.913681 1.496739 -0.429239
C 2.849362 -0.606885 0.292283
C -1.995408 0.099954 -0.931225
C 2.318924 1.783625 -0.291636
C 3.284339 0.747261 0.065426
C -2.969906 0.542882 0.187211
C -1.639321 -2.817983 -0.119481
C 1.069114 -3.477899 0.558847
C -0.061120 2.636736 -0.688103
C 3.797866 -1.716161 0.708930
C 2.850323 3.103879 -0.506241
C 4.664120 1.145207 0.183842
C -1.276824 -4.140798 0.217111
C 0.062093 -4.468231 0.555179
C 4.212331 3.357761 -0.364544
C -5.329441 1.287874 0.534752
C -6.623869 1.621965 -0.233144
H -1.771800 0.942441 -1.605431
H -2.502119 -0.665204 -1.546332
H -3.209663 -0.330003 0.823310
H -2.465448 1.286704 0.851889
H -2.676149 -2.576499 -0.374238
H 2.092455 -3.756928 0.818790
H 0.284214 3.561983 -0.197571
H -0.173514 2.864282 -1.766588
H -1.058959 2.426777 -0.275220
H 4.834680 -1.376375 0.839121
H 3.476296 -2.163608 1.668193
H 3.807931 -2.527383 -0.043402
H 2.194021 3.926244 -0.802758
H 5.424291 0.404511 0.451450
H -2.043096 -4.924008 0.219228
H 0.316862 -5.500885 0.815967
H -4.057831 1.851879 -1.020950
H 4.620821 4.360183 -0.532234
H -5.123204 2.111622 1.258904
H -5.481854 0.364623 1.130399
H -6.893268 0.775617 -0.897323
H -6.482023 2.521902 -0.857548
H -7.976153 1.190681 1.209771


