%chk=000266321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266321

0 1
O 1.015623 -0.634156 -0.524007
O 3.028648 1.898157 2.029938
O 4.538089 -0.022666 0.417673
O 2.826956 -2.532557 -2.209083
O -1.334837 0.735267 -2.545422
O -4.744577 -1.040910 -0.041813
N -0.995540 0.449466 -0.256878
N -1.446280 0.023354 0.953165
N -3.077690 -0.154142 -1.315141
C 2.596229 1.406489 0.755670
C 3.118689 -0.037288 0.541579
C 1.066695 1.411936 0.835640
C 2.450533 -0.675617 -0.695053
C 0.470637 0.705583 -0.379638
C 2.760550 -2.175193 -0.828699
C -1.764412 0.354444 -1.479884
C -2.663712 -0.436555 1.077677
C -3.623323 -0.598649 -0.066716
C -3.169353 -0.833927 2.421184
H 2.984368 2.099825 -0.022909
H 2.959187 -0.649843 1.462808
H 0.754624 0.921362 1.789411
H 0.684485 2.448467 0.928900
H 2.715643 -0.137189 -1.633349
H 0.643812 1.260140 -1.340416
H 2.002399 -2.788576 -0.306365
H 3.777235 -2.414341 -0.452661
H 3.980409 1.677216 2.170040
H 4.825452 0.357013 -0.440618
H 1.930276 -2.500438 -2.611439
H -3.664191 -0.219956 -2.161352
H -4.008093 -0.190093 2.733314
H -2.392341 -0.768005 3.199689
H -3.544088 -1.871116 2.410857


%chk=000266321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266321

0 1
O 1.095731 -0.815142 -0.482652
O 3.052371 1.969938 2.004629
O 4.662976 0.158507 0.371646
O 2.463418 -2.715996 -2.121884
O -1.235357 0.730127 -2.579035
O -4.925793 -0.684825 -0.064962
N -0.977993 0.286177 -0.270889
N -1.484806 -0.120717 0.957433
N -3.077557 0.031733 -1.308637
C 2.542040 1.363462 0.777747
C 3.202492 -0.008782 0.529801
C 1.018221 1.229390 0.918970
C 2.563336 -0.713575 -0.685741
C 0.465038 0.518782 -0.324613
C 3.030558 -2.156885 -0.896017
C -1.724119 0.373017 -1.478511
C -2.767986 -0.438363 1.051354
C -3.701536 -0.389932 -0.109676
C -3.313543 -0.868268 2.383995
H 2.781931 2.014013 -0.100576
H 3.103405 -0.632530 1.435329
H 0.778077 0.646567 1.822720
H 0.564326 2.231040 1.024191
H 2.756549 -0.124745 -1.614508
H 0.650960 1.107466 -1.245276
H 2.749560 -2.758573 -0.005809
H 4.124207 -2.188990 -1.021724
H 4.039634 1.853984 2.001983
H 4.845200 0.621633 -0.488198
H 1.479087 -2.599345 -2.072633
H -3.662025 0.088044 -2.150185
H -4.126715 -0.193120 2.706715
H -2.512586 -0.868864 3.138652
H -3.756998 -1.877727 2.312463


