%chk=000194806.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194806

0 1
O 2.489718 1.717233 -1.463596
N -2.271565 0.586554 -0.088360
C -0.997168 -0.188165 0.006673
C 0.198380 0.759631 -0.282719
C 0.185674 1.997923 0.637686
C -0.768967 -0.922717 1.348231
C -1.166740 2.708807 0.548193
C -2.323010 1.744913 0.860550
C 1.509163 0.025825 -0.137220
C 0.466028 -1.822364 1.254606
C 1.647201 -1.159228 0.598599
C -3.486612 -0.281525 0.048655
C 2.669333 0.550619 -0.751081
C -3.705508 -1.054053 -1.265016
C 2.907248 -1.783291 0.709592
C 3.925281 -0.057160 -0.653061
C 4.029026 -1.236704 0.092051
C -4.990228 -1.875276 -1.217528
H -1.037856 -0.954462 -0.814610
H 0.102555 1.115673 -1.343418
H 1.001920 2.683272 0.335418
H 0.401222 1.701318 1.680507
H -1.657622 -1.524666 1.614187
H -0.640461 -0.186181 2.164131
H -1.198175 3.567534 1.242463
H -1.301976 3.124816 -0.471132
H -2.284865 1.433831 1.925871
H -3.291563 2.269211 0.708293
H 0.218397 -2.741318 0.678948
H 0.743897 -2.173584 2.269986
H -3.421952 -0.988444 0.904118
H -4.369573 0.366046 0.240669
H -3.736918 -0.336852 -2.110583
H -2.838749 -1.712972 -1.468736
H 3.002558 -2.701673 1.283159
H 4.795445 0.369747 -1.137031
H 4.997095 -1.728100 0.186011
H -4.974672 -2.609429 -0.404490
H -5.871905 -1.240532 -1.072511
H -5.137971 -2.426898 -2.153315
H 3.325813 2.013639 -1.897890


%chk=000194806-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194806

0 1
O 2.526026 1.819818 -1.438871
N -2.281337 0.626699 -0.063898
C -1.008825 -0.146956 0.004529
C 0.200836 0.791315 -0.259698
C 0.182443 2.026811 0.688777
C -0.779112 -0.960726 1.313182
C -1.170768 2.758852 0.584579
C -2.335218 1.787985 0.857252
C 1.525259 0.041306 -0.152561
C 0.437441 -1.892922 1.134071
C 1.657046 -1.194797 0.537693
C -3.520347 -0.186710 -0.014725
C 2.693055 0.600299 -0.742152
C -3.623395 -1.250607 -1.127975
C 2.927201 -1.820759 0.641810
C 3.956030 -0.022755 -0.647917
C 4.069861 -1.242073 0.055993
C -5.024868 -1.898075 -1.169162
H -1.037841 -0.877161 -0.828600
H 0.098592 1.185831 -1.289528
H 1.014463 2.698993 0.414994
H 0.357023 1.702026 1.733954
H -1.673246 -1.567552 1.552430
H -0.610420 -0.278817 2.167675
H -1.213469 3.600869 1.302707
H -1.287374 3.177371 -0.433942
H -2.315443 1.480438 1.935408
H -3.301040 2.303481 0.692355
H 0.150159 -2.728397 0.460390
H 0.713642 -2.361885 2.098409
H -3.669605 -0.688150 0.978021
H -4.368770 0.517602 -0.132083
H -3.396361 -0.767467 -2.097963
H -2.865113 -2.043946 -0.978024
H 3.012394 -2.769924 1.184506
H 4.838588 0.436069 -1.113325
H 5.046071 -1.731477 0.142554
H -5.277089 -2.367244 -0.198879
H -5.805187 -1.145894 -1.391226
H -5.080823 -2.681693 -1.946445
H 3.381420 2.101220 -1.848015


