%chk=000181026.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181026

0 1
O -0.182163 -2.272938 0.391976
N -4.181296 -0.862500 0.228590
N 1.783899 1.892099 -0.077727
C -1.850138 0.888971 -0.318587
C -1.702749 -0.421792 0.491228
C -0.775317 1.927509 0.089908
C -3.262160 1.472380 -0.132021
C -2.810132 -1.417750 0.077512
C 0.553662 1.268091 0.061281
C -0.316683 -1.066068 0.334000
C 0.774944 -0.115761 0.171162
C -4.330226 0.425454 -0.504535
C 2.191259 -0.346177 0.089109
C 2.802905 0.899745 -0.059081
C 2.846984 -1.678249 0.175551
C 4.227482 1.269562 -0.176449
C 3.758721 -1.967370 -1.015946
H -1.701995 0.645871 -1.401035
H -1.810164 -0.189883 1.580357
H -0.982077 2.317336 1.109644
H -0.820786 2.802989 -0.586289
H -3.388347 2.374386 -0.757624
H -3.407940 1.805262 0.912086
H -2.667397 -1.730730 -0.980254
H -2.728303 -2.349597 0.681085
H -5.347827 0.823633 -0.307147
H -4.285411 0.206016 -1.594571
H -4.384549 -0.716231 1.223822
H 1.945539 2.875115 -0.178768
H 3.421166 -1.748308 1.123225
H 2.060819 -2.471429 0.244745
H 4.637486 1.616609 0.783508
H 4.824497 0.388804 -0.484559
H 4.404806 2.052386 -0.925152
H 3.196709 -1.937791 -1.957622
H 4.211155 -2.961325 -0.932814
H 4.569929 -1.230019 -1.091407


%chk=000181026-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181026

0 1
O -0.013704 -2.292369 0.389368
N -4.084753 -0.943376 0.047995
N 1.835180 1.974796 0.073738
C -1.789262 0.917372 -0.319340
C -1.623744 -0.438343 0.431501
C -0.742232 1.959588 0.158123
C -3.238277 1.440802 -0.166101
C -2.699824 -1.456421 -0.051281
C 0.617572 1.324795 0.138893
C -0.195507 -1.031803 0.329556
C 0.888476 -0.059496 0.205579
C -4.264181 0.365752 -0.620552
C 2.335615 -0.241036 0.177740
C 2.899537 1.037418 0.096224
C 3.073750 -1.558973 0.208857
C 4.328688 1.495604 0.029374
C 3.026400 -2.312335 -1.147348
H -1.601115 0.722683 -1.397855
H -1.801088 -0.243631 1.515758
H -1.007254 2.290055 1.186279
H -0.783299 2.861983 -0.485262
H -3.372700 2.369224 -0.759066
H -3.424417 1.700707 0.897779
H -2.498112 -1.709096 -1.111317
H -2.610082 -2.394358 0.520135
H -5.297865 0.716012 -0.444044
H -4.156208 0.205002 -1.712742
H -4.415298 -0.923795 1.022956
H 1.959352 2.984819 0.009006
H 4.128865 -1.393568 0.502383
H 2.617080 -2.209921 0.976632
H 4.583162 2.196491 0.848688
H 5.005187 0.629765 0.115533
H 4.564007 2.001256 -0.928015
H 1.981247 -2.553750 -1.405669
H 3.590235 -3.261673 -1.085804
H 3.460874 -1.701883 -1.960500


