%chk=000240655.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240655

0 1
O 2.661403 -1.702893 0.878643
O 3.747313 1.908257 0.515508
O 0.131716 1.340796 -1.131790
O 4.977776 0.647954 -0.862423
N -0.662127 1.289806 1.005974
N -4.851299 -1.176766 -0.337735
C 1.543326 0.305205 0.544872
C 2.607689 0.122579 -0.581327
C 1.290922 -1.183005 0.987313
C 2.838366 -1.433637 -0.559070
C 0.617979 -1.915786 -0.178483
C 1.563490 -2.069678 -1.121460
C 0.297048 1.006855 0.030041
C 3.899454 0.856459 -0.359531
C -1.959532 1.892345 0.622074
C -2.976199 0.821558 0.296050
C -4.035107 0.542875 1.167955
C -2.862173 0.092564 -0.896143
C -4.950675 -0.462533 0.812201
C -3.818162 -0.894290 -1.175977
H 1.983550 0.880397 1.396703
H 2.189407 0.458860 -1.571584
H 0.932692 -1.351922 2.001986
H 3.817292 -1.804240 -0.871270
H -0.412654 -2.209641 -0.166595
H 1.517757 -2.521800 -2.092320
H -0.597051 0.922350 1.947768
H -1.806349 2.552560 -0.272717
H -2.305792 2.554845 1.446705
H 4.595167 2.414883 0.649916
H -4.158332 1.088718 2.098981
H -2.043419 0.297459 -1.591244
H -5.797005 -0.713859 1.462653
H -3.772370 -1.486575 -2.097875


%chk=000240655-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240655

0 1
O 2.776075 -1.825813 0.761691
O 3.602081 2.048449 0.837555
O 0.182923 1.153377 -1.334706
O 5.155034 0.781569 -0.326744
N -0.674065 1.157729 0.826350
N -5.278987 -1.023802 0.109774
C 1.538715 0.156444 0.469925
C 2.769326 0.187242 -0.487972
C 1.344085 -1.418566 0.666526
C 3.126530 -1.350222 -0.618092
C 0.918523 -2.029634 -0.672785
C 2.024223 -1.989686 -1.464478
C 0.311750 0.869029 -0.103486
C 3.964828 0.984748 -0.003284
C -1.943585 1.807448 0.449747
C -3.107315 0.827463 0.339944
C -4.236801 0.913455 1.187891
C -3.090093 -0.206467 -0.631944
C -5.286932 -0.023878 1.039197
C -4.183770 -1.095116 -0.709073
H 1.804843 0.585730 1.449880
H 2.458795 0.610755 -1.464457
H 0.801771 -1.718494 1.572118
H 4.176002 -1.567717 -0.844863
H -0.093149 -2.348453 -0.927714
H 2.119410 -2.260012 -2.517001
H -0.534990 0.882161 1.800385
H -1.758527 2.284610 -0.529846
H -2.175937 2.599051 1.185065
H 4.421465 2.559925 1.080908
H -4.307562 1.696591 1.952001
H -2.245863 -0.299239 -1.323879
H -6.172169 0.019939 1.684080
H -4.202534 -1.897916 -1.454913


