%chk=000291229.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291229

0 1
N 0.019413 -1.542521 -0.608687
C -2.251244 -0.831558 -0.977223
C -0.819661 -0.526805 -0.609767
C -0.411596 0.841969 -0.273992
C -3.127925 -0.932171 0.279850
C 0.940980 1.070822 0.076936
C 1.866505 -0.052069 0.085171
C -4.600405 -1.162947 -0.084627
C 1.368051 -1.332636 -0.264576
C -1.318170 1.930930 -0.293399
C 1.354686 2.388508 0.407758
C 3.238524 0.071145 0.422486
C 2.232188 -2.462532 -0.276146
C -5.476201 -1.267029 1.161688
C -0.895502 3.206158 0.031209
C 0.453318 3.435062 0.385950
C 4.068670 -1.033258 0.408658
C 3.562298 -2.307566 0.056890
H -2.640036 -0.062231 -1.673093
H -2.298926 -1.791857 -1.539968
H -3.027211 -0.017172 0.894930
H -2.761225 -1.762017 0.917944
H -4.965280 -0.340710 -0.730436
H -4.698157 -2.087709 -0.687472
H -2.359306 1.754837 -0.568662
H 2.395783 2.565193 0.679616
H 3.632382 1.051288 0.693812
H 1.818525 -3.434156 -0.550286
H -5.165506 -2.099030 1.804681
H -6.525886 -1.434443 0.895169
H -5.432334 -0.353717 1.765779
H -1.593154 4.041594 0.016373
H 0.773405 4.445158 0.640560
H 5.121381 -0.934905 0.668113
H 4.235718 -3.164028 0.052565


%chk=000291229-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291229

0 1
N 0.019618 -1.517620 -0.617948
C -2.265188 -0.783996 -0.966688
C -0.818043 -0.475750 -0.621573
C -0.386363 0.884104 -0.284540
C -3.174532 -0.901813 0.289728
C 0.991739 1.109801 0.076945
C 1.902573 -0.033711 0.088426
C -4.637459 -1.241767 -0.073855
C 1.364095 -1.320506 -0.269541
C -1.290461 1.990677 -0.308723
C 1.405566 2.436690 0.403320
C 3.286000 0.050772 0.427677
C 2.210346 -2.468331 -0.280616
C -5.546606 -1.369852 1.167301
C -0.859323 3.283040 0.015279
C 0.499798 3.504915 0.375534
C 4.104172 -1.088031 0.412885
C 3.565354 -2.357985 0.056004
H -2.682491 -0.020181 -1.651824
H -2.273010 -1.749473 -1.502034
H -3.149269 0.042746 0.869955
H -2.763391 -1.689014 0.951779
H -5.038959 -0.458237 -0.749352
H -4.658625 -2.189288 -0.649482
H -2.335044 1.825851 -0.588937
H 2.446573 2.631341 0.678873
H 3.726779 1.013880 0.704985
H 1.757472 -3.424580 -0.559802
H -5.183629 -2.166570 1.843454
H -6.586319 -1.615640 0.882975
H -5.567925 -0.425812 1.744107
H -1.562992 4.122080 -0.008995
H 0.838621 4.515425 0.629323
H 5.163944 -1.000795 0.676941
H 4.211083 -3.242773 0.046221


