%chk=000278932.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278932

0 1
O -2.407258 2.295062 -0.818079
O -2.056462 -0.248754 -2.839107
O -4.476479 2.677821 1.403340
O -2.724126 -2.780106 -0.808077
O 3.651027 -0.297888 -0.685450
N -0.091812 2.170257 -1.245353
N -2.153653 -1.038834 0.547575
N 1.883450 3.359461 -1.300997
N 0.240180 1.037048 0.982238
N -2.669185 -4.267855 1.704777
N 2.369246 1.640432 2.035305
N 3.916190 3.133629 1.051829
C -2.629507 -0.064745 -0.448760
C -1.567966 0.171787 -1.565855
C -2.873072 1.328230 0.179979
C -1.431242 1.712406 -1.678689
C -4.351062 1.668021 0.400143
C 0.588900 1.866491 -0.056241
C -2.204838 -2.398008 0.232120
C 0.746587 3.104921 -1.950909
C -1.585348 -3.354200 1.268137
C 1.821741 2.609064 -0.113442
C -0.372290 -4.057259 0.611633
C 2.723356 2.468756 0.984504
C 0.692529 -3.070460 0.226958
C 1.174523 0.981927 1.974981
C 0.775435 -2.602041 -1.089874
C 1.609589 -2.603707 1.189383
C 1.747031 -1.666692 -1.460854
C 2.584356 -1.676367 0.847025
C 2.642206 -1.212525 -0.485676
C 3.775564 0.298368 -2.000070
H -3.568497 -0.465634 -0.926099
H -0.602868 -0.348236 -1.365403
H -2.271405 1.511432 1.100939
H -1.658187 2.109286 -2.699475
H -1.530021 -0.675586 1.274441
H -4.908714 0.813389 0.834316
H -4.834629 2.005605 -0.535807
H -2.355352 -1.195288 -2.782506
H 0.445046 3.521894 -2.902687
H -1.238202 -2.796956 2.179523
H -4.067534 3.515730 1.089744
H -0.710137 -4.632482 -0.277611
H 0.039330 -4.814834 1.308597
H -2.300898 -5.020093 2.278976
H -3.139964 -4.689942 0.904211
H 0.942506 0.331628 2.835963
H 0.072987 -2.967149 -1.841984
H 1.556435 -2.974690 2.212833
H 4.544795 2.987961 1.826936
H 4.209627 3.732090 0.295226
H 1.799109 -1.318877 -2.487410
H 3.301588 -1.298455 1.574580
H 4.636393 0.965449 -1.862708
H 3.989405 -0.469005 -2.748545
H 2.875876 0.873321 -2.241440


%chk=000278932-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278932

0 1
O -2.575429 2.341098 -0.777258
O -2.230483 -0.307439 -2.763034
O -4.530309 3.048169 1.209145
O -2.624955 -2.674924 -0.960736
O 3.932690 -0.395470 -0.574245
N -0.192454 2.189856 -1.240619
N -2.249994 -1.025920 0.620660
N 1.813136 3.298633 -1.434767
N 0.153913 1.163135 1.021871
N -2.735367 -4.299587 1.490452
N 2.334655 1.780842 1.980604
N 3.881868 3.167508 0.858734
C -2.723471 -0.012904 -0.325030
C -1.710306 0.200715 -1.500116
C -2.951152 1.376527 0.308115
C -1.547362 1.734145 -1.618821
C -4.401943 1.695289 0.666226
C 0.519709 1.919618 -0.059440
C -2.204416 -2.332137 0.201693
C 0.631824 3.025985 -2.013987
C -1.631489 -3.378419 1.167525
C 1.749963 2.616681 -0.203844
C -0.383953 -4.073820 0.507386
C 2.675315 2.527294 0.877385
C 0.758502 -3.124359 0.185498
C 1.125204 1.150681 1.986821
C 0.909653 -2.572795 -1.110073
C 1.690050 -2.731214 1.186378
C 1.946043 -1.658661 -1.412906
C 2.728282 -1.824321 0.907109
C 2.859406 -1.283091 -0.397179
C 4.125810 0.176702 -1.909819
H -3.664666 -0.378027 -0.778527
H -0.749087 -0.285550 -1.248436
H -2.282879 1.548650 1.172385
H -1.728583 2.066511 -2.653868
H -1.682953 -0.710096 1.413180
H -4.753866 1.021129 1.465503
H -5.039277 1.559197 -0.233692
H -2.487289 -1.256156 -2.582932
H 0.315239 3.392671 -2.988605
H -1.306523 -2.880217 2.102011
H -4.135460 3.673389 0.547995
H -0.746006 -4.574546 -0.409797
H -0.048722 -4.861755 1.210240
H -2.492592 -5.033148 2.162442
H -3.208308 -4.660931 0.655047
H 0.904661 0.564809 2.884351
H 0.206925 -2.864458 -1.900411
H 1.609326 -3.154207 2.196025
H 4.512930 3.052315 1.649068
H 4.145361 3.733039 0.054649
H 2.032174 -1.261047 -2.428844
H 3.446215 -1.518182 1.674183
H 5.032365 0.794096 -1.827718
H 4.281927 -0.615594 -2.667679
H 3.270443 0.815088 -2.203192


