%chk=000265826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265826

0 1
S 0.337755 -0.398133 -0.000151
N -4.667339 -0.789297 -0.000992
N -3.805272 1.543301 0.001488
N -1.365881 1.666009 0.001881
C -2.387436 -0.513151 -0.000489
C -3.662095 0.173340 0.000061
C -1.253212 0.322696 0.000593
C 1.479646 1.023810 0.001297
C -2.672819 -1.918654 -0.002089
C 2.835766 0.403481 0.000587
C -4.048326 -2.065147 -0.002264
C 3.478280 0.111719 -1.213761
C 3.478395 0.109206 1.214270
C -2.637065 2.220174 0.002253
C 4.751050 -0.464337 -1.210739
C 4.751161 -0.466844 1.209937
C 5.389861 -0.753904 -0.000731
H 1.292389 1.668480 0.884369
H 1.292325 1.670345 -0.880400
H -1.935864 -2.700408 -0.002854
H -5.654654 -0.605646 -0.000853
H -4.639242 -2.965194 -0.003222
H 2.984096 0.330918 -2.159234
H 2.984300 0.326455 2.160240
H -2.682526 3.320995 0.003460
H 5.245914 -0.688823 -2.154424
H 5.246115 -0.693290 2.153107
H 6.381376 -1.202200 -0.001239


%chk=000265826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265826

0 1
S 0.290523 -0.663179 0.000010
N -4.795996 -0.674808 -0.001269
N -3.802820 1.572067 0.001288
N -1.353987 1.550253 0.001800
C -2.518098 -0.571574 -0.000536
C -3.726825 0.211403 -0.000031
C -1.314108 0.190055 0.000398
C 1.480337 0.845901 0.001644
C -2.905279 -1.961350 -0.001797
C 2.904507 0.348688 0.000793
C -4.300942 -1.988869 -0.002550
C 3.586914 0.113641 -1.221298
C 3.587590 0.111357 1.222062
C -2.580885 2.170023 0.002337
C 4.923011 -0.344151 -1.223552
C 4.923693 -0.346430 1.222709
C 5.595626 -0.575545 -0.000822
H 1.223916 1.432707 0.896066
H 1.223585 1.434852 -0.891274
H -2.250029 -2.829912 -0.002355
H -5.774282 -0.390188 -0.001304
H -4.978359 -2.840463 -0.003702
H 3.066672 0.290668 -2.170340
H 3.067882 0.286605 2.171726
H -2.567483 3.263354 0.002995
H 5.438735 -0.518109 -2.174554
H 5.439950 -0.522166 2.173094
H 6.632852 -0.928927 -0.001438


