%chk=000211178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211178

0 1
N 5.151451 0.360106 -0.372763
N -5.028387 -0.689918 0.407193
C 2.750884 0.253019 -0.952164
C -2.677522 -0.449556 1.026838
C 3.803262 -0.065968 0.140920
C -3.726428 -0.128749 -0.068433
C 1.350176 0.069961 -0.440597
C -1.276760 -0.265246 0.517827
C 0.612462 -1.075647 -0.777128
C -0.689204 -1.241648 -0.302239
C 0.763330 1.046104 0.379315
C -0.539127 0.880094 0.853935
C 3.842918 -1.567940 0.446541
C -3.775995 1.378734 -0.360286
C 6.160012 0.492998 0.714420
C -6.059091 -0.764365 -0.664333
H 2.939396 -0.389315 -1.837752
H 2.880217 1.290531 -1.321242
H -2.824178 -1.498496 1.368576
H -2.859701 0.170439 1.925233
H 3.523442 0.485330 1.077575
H -3.440754 -0.670898 -1.007981
H 1.057567 -1.841308 -1.410524
H -1.252103 -2.135126 -0.568421
H 1.324532 1.938442 0.648465
H -0.982725 1.644902 1.488355
H 4.494524 -1.788210 1.298016
H 4.231020 -2.134666 -0.409604
H 2.842939 -1.949558 0.680735
H -4.482100 1.610416 -1.163481
H -2.791046 1.744509 -0.677612
H -4.066847 1.961887 0.518285
H 5.073032 1.258906 -0.861418
H -5.391199 -0.131625 1.186814
H 7.119407 0.803241 0.269285
H 6.327322 -0.491759 1.182103
H 5.896138 1.207744 1.507908
H -5.700138 -1.415889 -1.478005
H -6.345471 0.203406 -1.101845
H -6.963054 -1.238286 -0.247211


%chk=000211178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211178

0 1
N 5.197904 0.430472 -0.342248
N -5.135392 -0.655563 0.396165
C 2.807810 0.303695 -0.900422
C -2.745176 -0.519696 0.976124
C 3.878151 0.010674 0.193514
C -3.816328 -0.191703 -0.107172
C 1.377486 0.096255 -0.429035
C -1.312864 -0.306630 0.511838
C 0.623764 -1.037305 -0.828009
C -0.695650 -1.235431 -0.365836
C 0.761254 1.024069 0.450207
C -0.558370 0.825957 0.911970
C 3.896504 -1.480583 0.585217
C -3.780276 1.304042 -0.519939
C 6.324578 0.401937 0.610429
C -6.235478 -0.687252 -0.585823
H 3.032393 -0.337371 -1.773214
H 2.938244 1.356463 -1.230389
H -2.907096 -1.573993 1.268915
H -2.950377 0.102502 1.871539
H 3.602431 0.603027 1.105961
H -3.590115 -0.807912 -1.001995
H 1.079300 -1.771568 -1.504061
H -1.253937 -2.125195 -0.684130
H 1.319646 1.912846 0.771487
H -1.012541 1.559579 1.590045
H 4.600125 -1.674660 1.414196
H 4.206828 -2.091144 -0.282589
H 2.893354 -1.805072 0.912489
H -4.550497 1.525671 -1.281089
H -2.796478 1.578290 -0.940880
H -3.968426 1.952170 0.358997
H 5.125003 1.345530 -0.808169
H -5.399388 -0.157275 1.258022
H 7.213027 0.857045 0.137307
H 6.587670 -0.640155 0.864448
H 6.125867 0.942935 1.569018
H -5.961885 -1.364991 -1.416124
H -6.507893 0.298509 -1.034646
H -7.140967 -1.101574 -0.106818


