%chk=000218076.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218076

0 1
N 4.283325 -0.137006 -0.001033
C 2.895615 0.025022 -0.001068
C 4.939338 -1.270370 -0.698489
C 5.184233 0.822642 0.683183
C 2.052048 -0.930313 -0.626797
C 2.295143 1.150184 0.625614
C 0.076202 0.348116 0.009212
C 5.069201 -2.493852 0.210506
C 5.581891 1.980479 -0.234092
C 0.673060 -0.761878 -0.614884
C 0.915029 1.299024 0.621991
C -1.375033 0.543589 0.029378
C -2.278171 -0.447322 -0.046686
C -3.731253 -0.224628 -0.026194
C -4.316659 0.834769 -0.740460
C -4.553740 -1.095689 0.711719
C -5.700995 1.021658 -0.710812
C -5.935645 -0.900369 0.740248
C -6.513214 0.157623 0.029611
H 4.358972 -1.533423 -1.613996
H 5.943596 -0.945505 -1.052472
H 4.685235 1.214694 1.600490
H 6.091086 0.279899 1.033284
H 2.476723 -1.800222 -1.119354
H 2.910387 1.902212 1.111063
H 5.687018 -2.283908 1.090954
H 4.089779 -2.822064 0.583807
H 5.521755 -3.336752 -0.322122
H 6.130323 1.631902 -1.116504
H 4.700055 2.520658 -0.603939
H 6.217420 2.701292 0.290861
H 0.042930 -1.504522 -1.106758
H 0.473344 2.169347 1.109368
H -1.698724 1.584583 0.129867
H -1.974818 -1.494102 -0.112163
H -3.690132 1.505392 -1.325166
H -4.109339 -1.918714 1.267699
H -6.147804 1.843341 -1.267763
H -6.566218 -1.574354 1.317412
H -7.590064 0.305969 0.052386


%chk=000218076-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218076

0 1
N 4.361305 -0.141348 -0.013181
C 2.969434 0.012039 0.011618
C 4.995132 -1.405076 -0.437693
C 5.266471 0.952989 0.389367
C 2.088079 -1.087170 -0.265079
C 2.355503 1.270644 0.314488
C 0.078964 0.317682 0.069269
C 5.155156 -2.435592 0.705841
C 5.611686 1.929105 -0.760810
C 0.695425 -0.931507 -0.238868
C 0.958572 1.404893 0.343347
C -1.369713 0.530251 0.117891
C -2.355463 -0.398097 -0.112365
C -3.807687 -0.173395 -0.056350
C -4.402406 1.087559 0.253960
C -4.683893 -1.267512 -0.323634
C -5.801939 1.240129 0.293689
C -6.085306 -1.115479 -0.283812
C -6.655474 0.141230 0.025520
H 4.418467 -1.845837 -1.272030
H 5.991669 -1.160336 -0.851809
H 4.822506 1.504476 1.238867
H 6.198076 0.496545 0.774625
H 2.495976 -2.077319 -0.488392
H 2.969307 2.153532 0.514457
H 5.776125 -2.022585 1.521442
H 4.175253 -2.709282 1.133856
H 5.643247 -3.356135 0.334559
H 6.105903 1.395270 -1.592771
H 4.701852 2.408910 -1.161307
H 6.296845 2.721672 -0.405983
H 0.072410 -1.807084 -0.454912
H 0.528219 2.387260 0.578365
H -1.670909 1.557587 0.371336
H -2.059893 -1.426655 -0.365343
H -3.766339 1.954339 0.465741
H -4.250357 -2.246870 -0.564003
H -6.233930 2.218765 0.533968
H -6.732675 -1.974890 -0.493211
H -7.743696 0.264693 0.057247


