%chk=000271319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271319

0 1
O 5.280283 0.600491 1.501991
O 3.132034 1.367873 1.378660
N -0.897622 -0.652732 -0.698265
N -1.635510 -1.606642 -1.390189
N 1.514477 -0.513208 -0.025885
N -0.901013 -2.601187 -1.738804
N 1.683356 -4.319349 -2.014918
N 3.838168 -0.714504 0.442735
C -1.419014 0.628733 -0.143807
C -2.466759 0.379927 0.927508
C -1.928057 1.540141 -1.247249
C 0.427478 -1.104008 -0.610596
C 0.417517 -2.374810 -1.291168
C -2.238082 0.900622 2.210931
C -1.350056 2.813104 -1.373971
C -3.642685 -0.336364 0.669389
C -2.951161 1.153092 -2.122442
C 1.639243 -3.104117 -1.377400
C 2.657647 -1.248293 -0.134693
C 2.768865 -2.513824 -0.782319
C -3.184017 0.712347 3.221765
C -1.800697 3.691506 -2.362590
C -4.584359 -0.526029 1.684858
C -3.395955 2.033526 -3.112835
C -4.358590 -0.000794 2.960707
C -2.824252 3.303672 -3.233366
C 3.944517 0.518431 1.126937
C 5.653617 1.817820 2.243975
C 7.129684 1.626575 2.511738
H -0.513525 1.120582 0.342879
H -1.321353 1.450080 2.426219
H -0.545561 3.120844 -0.705594
H -3.823384 -0.753856 -0.324158
H -3.399140 0.160057 -2.037088
H 3.724535 -3.021714 -0.816238
H -3.003243 1.119881 4.214920
H -1.350843 4.678471 -2.455601
H -5.495165 -1.085944 1.479031
H -4.189559 1.726112 -3.791897
H -5.093763 -0.148042 3.749458
H -3.173149 3.988307 -4.003973
H 2.532649 -4.848238 -2.086578
H 0.850219 -4.710116 -2.430048
H 4.697047 -1.272203 0.358073
H 5.427359 2.684327 1.598636
H 5.036723 1.853627 3.158672
H 7.544494 2.476692 3.067365
H 7.317941 0.715659 3.097137
H 7.698358 1.523675 1.576889


%chk=000271319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271319

0 1
O 5.249922 0.690732 1.365225
O 3.097629 1.569754 0.978967
N -0.978080 -0.879069 -0.513871
N -1.749514 -1.792505 -1.287527
N 1.400453 -0.609357 0.041891
N -0.910191 -2.739400 -1.757776
N 1.699623 -4.235893 -2.281876
N 3.755514 -0.645662 0.350697
C -1.498909 0.370424 0.100166
C -2.673890 0.159620 1.059431
C -1.759174 1.428868 -0.987176
C 0.354195 -1.248121 -0.540065
C 0.380421 -2.432973 -1.317974
C -2.789597 1.063818 2.146901
C -0.713051 2.322890 -1.327211
C -3.658016 -0.846853 0.895807
C -2.999446 1.515437 -1.664049
C 1.636991 -3.080506 -1.536798
C 2.587431 -1.225584 -0.194102
C 2.755301 -2.434866 -0.950228
C -3.865377 0.967972 3.055191
C -0.906118 3.294431 -2.334787
C -4.731395 -0.946377 1.811075
C -3.189835 2.484326 -2.673609
C -4.842454 -0.041430 2.890387
C -2.145289 3.377068 -3.010975
C 3.913075 0.629676 0.900097
C 5.644634 1.992120 1.972959
C 7.107715 1.859665 2.383942
H -0.632318 0.722420 0.693144
H -2.032925 1.846764 2.281884
H 0.250779 2.250814 -0.806892
H -3.575154 -1.551717 0.063096
H -3.812651 0.832019 -1.397658
H 3.760991 -2.845178 -1.092397
H -3.937307 1.672788 3.891185
H -0.093790 3.984423 -2.589250
H -5.482329 -1.733476 1.677241
H -4.151780 2.545876 -3.195033
H -5.676658 -0.122411 3.596438
H -2.297236 4.131246 -3.791654
H 2.580018 -4.710762 -2.459694
H 0.840936 -4.615968 -2.675847
H 4.610123 -1.205134 0.336364
H 5.487226 2.791681 1.226164
H 4.981445 2.191017 2.834336
H 7.450685 2.801445 2.849685
H 7.240059 1.043269 3.114457
H 7.747015 1.652878 1.508521


