%chk=000223919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223919

0 1
O -0.464467 -2.349969 0.971510
O -2.358595 -1.131040 -0.938587
N 0.977419 -0.608728 1.513437
N -1.313357 -0.183772 0.881450
C 2.061360 -1.622579 1.692637
C 2.705091 -2.007176 0.352720
C 1.492871 0.653435 0.910374
C 3.050788 -0.807452 -0.481733
C 2.455757 0.443460 -0.236357
C -3.510823 0.716247 0.101485
C -0.264984 -1.158690 1.047476
C -4.414129 0.298476 1.277603
C 3.959632 -0.943216 -1.543274
C 2.777436 1.539970 -1.049604
C -3.014652 2.162302 0.266100
C -2.374018 -0.300359 -0.061468
C 4.275293 0.152585 -2.347885
C 3.683948 1.396398 -2.101415
C -5.079619 -1.052025 1.036185
C -1.952142 2.527355 -0.728909
C -0.918806 3.316177 -0.441285
H 2.813433 -1.185040 2.384846
H 1.633430 -2.523722 2.189694
H 3.599091 -2.635698 0.534978
H 1.998922 -2.652536 -0.222871
H 2.018818 1.206395 1.728403
H 0.650521 1.304135 0.581186
H -4.109716 0.652080 -0.848113
H -3.828540 0.264276 2.217849
H -5.191524 1.073803 1.431943
H 4.418500 -1.910228 -1.742966
H 2.317506 2.509116 -0.864178
H -3.876796 2.854941 0.131740
H -2.671624 2.342241 1.305240
H -1.273251 0.652237 1.470815
H 4.980673 0.038369 -3.169360
H 3.928253 2.250051 -2.730231
H -5.713510 -1.044168 0.141469
H -4.340711 -1.854405 0.893025
H -5.710039 -1.342196 1.884362
H -2.089052 2.103706 -1.727863
H -0.168723 3.589121 -1.170921
H -0.746164 3.763927 0.525697


%chk=000223919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223919

0 1
O -0.830056 -2.541135 1.019823
O -2.891034 -1.307188 -0.828519
N 0.825337 -0.889617 0.913902
N -1.457306 -0.275577 0.713031
C 1.886491 -1.859888 1.256695
C 2.771763 -2.118478 0.022335
C 1.272540 0.441192 0.459471
C 3.300515 -0.807414 -0.543605
C 2.588458 0.401430 -0.322913
C -3.677630 0.746696 0.263256
C -0.495171 -1.335737 0.872045
C -4.413109 0.464835 1.609177
C 4.508185 -0.766727 -1.286011
C 3.094318 1.618698 -0.842476
C -3.089793 2.190910 0.251705
C -2.655619 -0.371133 -0.023334
C 5.004895 0.445472 -1.808349
C 4.293033 1.647972 -1.584373
C -5.128510 -0.901506 1.655979
C -2.291282 2.528421 -0.991631
C -1.107850 3.192523 -1.006940
H 2.497063 -1.446980 2.084283
H 1.392091 -2.783205 1.596144
H 3.612000 -2.784629 0.294070
H 2.168288 -2.651768 -0.738029
H 1.399109 1.127282 1.327503
H 0.489029 0.873984 -0.189185
H -4.413436 0.661279 -0.559199
H -3.684103 0.531927 2.442862
H -5.148913 1.279243 1.768383
H 5.061821 -1.699337 -1.451489
H 2.540670 2.550885 -0.667847
H -3.955206 2.882381 0.328812
H -2.481176 2.381217 1.161065
H -1.279122 0.604648 1.202244
H 5.939062 0.456058 -2.380621
H 4.669902 2.596063 -1.983399
H -5.862553 -0.993706 0.834720
H -4.413309 -1.736242 1.553883
H -5.666606 -1.026534 2.613131
H -2.735698 2.204703 -1.945695
H -0.591423 3.423819 -1.944982
H -0.632165 3.542965 -0.080718


