%chk=000217065.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217065

0 1
O -1.483697 -0.022711 -1.910945
N -0.725100 0.002125 0.282135
N 0.587345 0.009243 -0.100030
C -3.168199 -0.021124 -0.181850
C -3.477849 1.254285 0.619124
C -3.457608 -1.286609 0.642097
C -3.245933 2.528158 -0.205925
C -3.204604 -2.571333 -0.159556
C -1.735478 -0.014556 -0.730472
C -3.635769 3.779864 0.574928
C -3.574983 -3.814762 0.643672
C 1.520114 0.024384 0.814895
C 2.935661 0.032004 0.393806
C 3.931824 0.048636 1.387541
C 3.308423 0.023135 -0.961168
C 5.280186 0.056226 1.025256
C 4.659802 0.030825 -1.314514
C 5.647311 0.047352 -0.324760
H -3.832515 -0.034657 -1.090383
H -2.879138 1.293243 1.548001
H -4.535114 1.219147 0.953493
H -4.515528 -1.262512 0.975429
H -2.858938 -1.298935 1.571727
H -3.824606 2.478963 -1.150271
H -2.182606 2.596555 -0.514941
H -2.140070 -2.628271 -0.466726
H -3.783193 -2.548578 -1.104973
H -4.695603 3.772956 0.853632
H -3.052173 3.883450 1.496572
H -3.462442 4.683861 -0.021913
H -2.990883 -3.892021 1.567575
H -3.386298 -4.726559 0.063587
H -4.635121 -3.819999 0.921257
H -0.996428 0.008345 1.271454
H 1.356190 0.032314 1.901996
H 3.657249 0.055651 2.440106
H 2.537060 0.010216 -1.736243
H 6.048087 0.069096 1.796713
H 4.942568 0.023888 -2.366323
H 6.699056 0.053304 -0.603503


%chk=000217065-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217065

0 1
O -1.581842 -0.033385 -2.079966
N -0.734792 -0.001281 0.107761
N 0.590207 0.005831 -0.283138
C -3.183502 -0.023686 -0.201050
C -3.461017 1.269639 0.619038
C -3.444458 -1.305724 0.641801
C -3.287051 2.576339 -0.187625
C -3.253744 -2.624142 -0.141680
C -1.780704 -0.020501 -0.838786
C -3.621886 3.832952 0.643882
C -3.578470 -3.869866 0.709856
C 1.502717 0.024834 0.666671
C 2.934495 0.034516 0.341580
C 3.889133 0.055679 1.395618
C 3.392129 0.023352 -1.008105
C 5.271537 0.065539 1.110988
C 4.771587 0.033230 -1.286680
C 5.717810 0.054361 -0.230551
H -3.869575 -0.035893 -1.069882
H -2.808277 1.302577 1.518982
H -4.500349 1.212842 1.002894
H -4.484502 -1.255474 1.024654
H -2.791351 -1.314529 1.542078
H -3.936118 2.536834 -1.084951
H -2.248068 2.646370 -0.565170
H -2.212757 -2.689449 -0.514477
H -3.899959 -2.606885 -1.041794
H -4.667300 3.805888 1.005624
H -2.962425 3.912652 1.529056
H -3.495170 4.754003 0.046651
H -2.921359 -3.928291 1.598469
H -3.440469 -4.799489 0.128617
H -4.625338 -3.847353 1.067710
H -0.983205 0.008217 1.109819
H 1.236183 0.034948 1.745242
H 3.545234 0.064452 2.438072
H 2.648913 0.007071 -1.811710
H 5.998019 0.081889 1.930925
H 5.116140 0.024511 -2.326766
H 6.790585 0.062018 -0.453161


