%chk=000276964.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276964

0 1
O 2.284428 -1.553249 0.388844
N -0.672233 0.219502 -0.202834
N 0.683195 0.164973 0.288254
C -1.498374 1.283667 0.477141
C 1.567638 1.285586 -0.191735
C -1.119414 -1.143126 -0.283255
C 1.136058 -1.230075 0.190077
C -0.067077 -2.000104 -0.123358
C -2.090867 0.816533 1.808104
C -2.573571 1.763020 -0.501911
C 2.067068 1.049499 -1.620319
C 2.725115 1.401787 0.802210
C -2.523254 -1.482005 -0.599706
H -0.798878 2.145651 0.681413
H 0.956946 2.228928 -0.165492
H -0.049001 -3.067114 -0.224034
H -2.598851 1.638344 2.324931
H -2.820378 0.007481 1.684667
H -1.303819 0.443665 2.479680
H -2.158146 1.921844 -1.506322
H -2.998592 2.716927 -0.167133
H -3.404598 1.057985 -0.601744
H 2.668299 1.892001 -1.975851
H 2.700714 0.152652 -1.680297
H 1.235885 0.909328 -2.320375
H 2.367945 1.579295 1.822815
H 3.403265 2.214168 0.527035
H 3.315444 0.468796 0.836669
H -3.215394 -1.143024 0.189216
H -2.658942 -2.570204 -0.706891
H -2.847111 -1.021932 -1.547398


%chk=000276964-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276964

0 1
O 2.321497 -1.614333 0.246181
N -0.723240 0.179171 -0.241057
N 0.671400 0.115713 0.140915
C -1.514517 1.279535 0.415045
C 1.583390 1.246077 -0.216057
C -1.165327 -1.157665 -0.345140
C 1.108438 -1.253877 0.108698
C -0.100738 -2.023532 -0.163822
C -1.931129 0.918875 1.860540
C -2.691708 1.743254 -0.467698
C 2.228766 1.027680 -1.605387
C 2.631278 1.438815 0.901474
C -2.594319 -1.525782 -0.640558
H -0.810080 2.128327 0.474575
H 0.952298 2.153827 -0.265501
H -0.122295 -3.105920 -0.263487
H -2.336077 1.810152 2.373327
H -2.709692 0.135838 1.878076
H -1.057802 0.555256 2.430341
H -2.352173 1.941270 -1.499325
H -3.108541 2.678793 -0.052654
H -3.509256 1.005378 -0.503829
H 2.849652 1.901138 -1.876017
H 2.871931 0.131576 -1.587591
H 1.453453 0.895157 -2.381618
H 2.140389 1.632349 1.872016
H 3.284890 2.296207 0.657721
H 3.245977 0.529395 0.996483
H -3.283117 -1.259380 0.182438
H -2.658419 -2.616189 -0.785673
H -2.961428 -1.036307 -1.560013


