%chk=000217008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217008

0 1
N 2.400535 0.256605 0.004866
N 0.629108 -1.290130 -0.198503
N -1.016925 -2.890204 -0.573606
C 1.030016 0.037799 0.003303
C 2.961380 1.605820 0.271216
C 3.373750 -0.847038 -0.212902
C -1.288350 0.767794 0.169357
C 0.090889 1.064665 0.196226
C -1.728035 -0.569163 -0.062891
C -0.693737 -1.562256 -0.254497
C 3.059135 2.432182 -1.011267
C 3.795351 -1.491875 1.107437
C -2.280223 1.788832 0.369063
C -3.122223 -0.850941 -0.108742
C -3.614716 1.481456 0.327336
C -4.048309 0.145141 0.083660
H 2.328937 2.134421 1.022723
H 3.967001 1.491393 0.735068
H 2.915943 -1.616600 -0.881212
H 4.257049 -0.438945 -0.751267
H 0.405219 2.087141 0.360066
H 3.715152 1.959488 -1.751468
H 2.076488 2.548040 -1.489559
H 3.450349 3.434426 -0.807987
H 4.256741 -0.773516 1.792253
H 2.925334 -1.922213 1.624014
H 4.510474 -2.303396 0.937193
H -1.942617 2.806225 0.551027
H -3.451655 -1.870684 -0.305416
H -4.369380 2.253418 0.477828
H -5.113305 -0.064118 0.050049
H -0.260715 -3.563825 -0.558857
H -1.901562 -3.251741 -0.255809


%chk=000217008-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217008

0 1
N 2.415636 0.276079 0.003649
N 0.642510 -1.253093 -0.185599
N -0.964373 -2.905692 -0.386412
C 1.037242 0.066486 -0.015582
C 2.983630 1.606701 0.278038
C 3.356310 -0.841606 -0.223869
C -1.298560 0.795355 0.131353
C 0.092252 1.110984 0.128093
C -1.726155 -0.578753 -0.030080
C -0.668548 -1.563792 -0.200370
C 3.116467 2.497369 -0.980752
C 3.753487 -1.572812 1.077872
C -2.312874 1.804138 0.285004
C -3.118938 -0.892633 -0.019013
C -3.668443 1.470731 0.287539
C -4.083462 0.110096 0.136988
H 2.369161 2.118368 1.043210
H 3.982261 1.459235 0.730975
H 2.878128 -1.557888 -0.911286
H 4.255677 -0.431359 -0.723671
H 0.398712 2.154823 0.224044
H 3.770980 2.018389 -1.731366
H 2.131903 2.667719 -1.449991
H 3.553582 3.479358 -0.719128
H 4.211542 -0.879756 1.808028
H 2.858370 -2.024343 1.538448
H 4.482941 -2.377205 0.864725
H -2.000492 2.848599 0.404625
H -3.457566 -1.930582 -0.130328
H -4.424699 2.255159 0.407771
H -5.149309 -0.141461 0.144206
H -0.184022 -3.548315 -0.498301
H -1.916251 -3.252100 -0.430115


