%chk=000227525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227525

0 1
N 0.317799 0.134418 1.421687
N -4.024341 0.735107 -0.283976
N -0.505747 -1.400710 -0.205149
N -3.775875 1.765126 0.590299
N -2.760545 -1.248481 -1.146357
C 4.043453 -0.344103 0.590865
C 2.633130 0.250002 0.494430
C 5.019153 0.383720 -0.343505
C 1.665000 -0.487244 1.433199
C 6.432361 -0.208913 -0.250537
C -0.679285 -0.269370 0.559686
C -1.917238 0.440731 0.491642
C 7.407825 0.511858 -1.178130
C -2.922675 -0.109744 -0.384861
C -2.519517 1.608097 1.067646
C -5.313363 0.613928 -0.977463
C -1.545656 -1.825942 -1.000200
H 4.410130 -0.288146 1.634026
H 4.015197 -1.422286 0.335675
H 2.659002 1.330256 0.731019
H 2.262297 0.176689 -0.549120
H 5.048256 1.462402 -0.097133
H 4.656744 0.324416 -1.388326
H 2.034006 -0.469125 2.482945
H 1.584233 -1.561729 1.135143
H 6.797978 -0.151398 0.793360
H 6.405591 -1.287378 -0.502680
H 0.234211 1.044752 1.863833
H 7.095667 0.440971 -2.226471
H 7.488588 1.576715 -0.932135
H 8.413243 0.081792 -1.106565
H -2.083046 2.289639 1.778794
H -6.139860 0.512506 -0.249457
H -5.508634 1.509024 -1.597019
H -5.303286 -0.279287 -1.632895
H -1.349896 -2.742092 -1.583767


%chk=000227525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227525

0 1
N 0.295651 0.249635 1.439552
N -4.083196 0.657650 -0.271885
N -0.447636 -1.229738 -0.243387
N -3.957568 1.666872 0.690737
N -2.699651 -1.145589 -1.224891
C 4.046942 -0.314458 0.591939
C 2.647292 0.336355 0.525572
C 5.070656 0.357444 -0.350786
C 1.640678 -0.353379 1.476200
C 6.470988 -0.295159 -0.294282
C -0.698762 -0.165080 0.587518
C -1.988227 0.469526 0.547653
C 7.487711 0.379097 -1.240523
C -2.921643 -0.084388 -0.386962
C -2.690849 1.546751 1.181550
C -5.328889 0.481908 -1.013973
C -1.445275 -1.653447 -1.083191
H 4.428485 -0.272894 1.634422
H 3.962298 -1.390217 0.332707
H 2.725215 1.413778 0.779128
H 2.252308 0.273030 -0.506506
H 5.158769 1.433800 -0.093124
H 4.690618 0.317407 -1.392772
H 2.010343 -0.310729 2.519111
H 1.531689 -1.412561 1.188542
H 6.849944 -0.255037 0.747625
H 6.381324 -1.370463 -0.550975
H 0.115455 1.072859 2.014183
H 7.148188 0.322488 -2.292080
H 7.616309 1.448689 -0.987647
H 8.480368 -0.103913 -1.179869
H -2.366704 2.239503 1.957083
H -6.159639 0.263787 -0.322206
H -5.566493 1.394490 -1.585806
H -5.187917 -0.364057 -1.704686
H -1.193879 -2.507757 -1.719468


