%chk=000252026.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252026

0 1
O 4.618057 1.130152 0.599237
O -5.196699 0.727902 -0.046974
O -1.623212 -2.411869 -0.265974
O 1.228655 1.443032 -1.976682
N 2.809615 -0.695136 -0.721998
N -2.489979 0.208836 0.737127
C 1.405652 -0.576070 -0.670506
C 3.501039 -1.049695 0.555106
C 3.614716 0.306339 -1.478742
C -1.372699 -0.037767 -0.039721
C -3.562450 -0.807154 0.935879
C -3.063205 1.587777 0.778241
C 0.613424 -1.616232 -0.271707
C 3.831040 0.209081 1.376916
C 3.971863 1.533419 -0.628311
C -0.853273 -1.476293 -0.195806
C -4.678499 -0.617700 -0.104187
C -4.187411 1.733826 -0.261359
C 0.703810 0.689989 -1.180389
C -0.611528 0.937607 -0.614046
C 1.120989 -2.981554 0.053877
H 4.440370 -1.582998 0.279806
H 2.892835 -1.757705 1.159225
H 3.080566 0.614816 -2.409444
H 4.543025 -0.218542 -1.803827
H -3.965425 -0.666491 1.965675
H -3.159959 -1.847529 0.889477
H -2.272146 2.353881 0.624215
H -3.466281 1.747750 1.805698
H 2.921637 0.721837 1.734982
H 4.500544 -0.011853 2.227708
H 4.745106 2.163379 -1.102944
H 3.084565 2.145672 -0.389098
H -4.331659 -0.832854 -1.130251
H -5.573347 -1.223729 0.127153
H -4.758093 2.671651 -0.134079
H -3.809923 1.657221 -1.296412
H -0.951600 1.968545 -0.704930
H 1.580571 -3.018651 1.052387
H 1.878260 -3.306275 -0.677672
H 0.312949 -3.731715 0.031049


%chk=000252026-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252026

0 1
O 5.394569 0.650294 0.147006
O -5.545062 0.545887 -0.359799
O -1.499411 -2.361701 0.643311
O 1.330585 2.054940 -0.980343
N 2.750815 -0.361233 -0.474894
N -2.822988 0.230218 0.596600
C 1.366981 -0.310936 -0.337079
C 3.631720 -1.083252 0.474918
C 3.537173 0.407277 -1.476580
C -1.510560 0.055555 0.187929
C -3.836625 -0.834241 0.839991
C -3.488558 1.556196 0.570678
C 0.605528 -1.418557 0.065326
C 4.591394 -0.066579 1.142482
C 4.508292 1.381322 -0.782504
C -0.828545 -1.306450 0.331890
C -4.903328 -0.779890 -0.276681
C -4.535464 1.594184 -0.567124
C 0.667993 1.020299 -0.593766
C -0.746104 1.104692 -0.331193
C 1.160011 -2.831075 0.118781
H 4.228429 -1.848724 -0.060666
H 3.028926 -1.578959 1.249941
H 2.863966 0.959476 -2.143960
H 4.126317 -0.330997 -2.060545
H -4.319007 -0.627245 1.814980
H -3.341652 -1.814597 0.869223
H -2.760068 2.373756 0.476352
H -4.018403 1.679038 1.535103
H 4.002086 0.653472 1.750997
H 5.314597 -0.591827 1.789236
H 5.180863 1.857426 -1.514213
H 3.929893 2.154888 -0.240438
H -4.437466 -1.036017 -1.252370
H -5.722192 -1.485977 -0.063504
H -5.091073 2.546287 -0.562950
H -4.034603 1.460151 -1.549893
H -1.167112 2.089997 -0.543560
H 1.448852 -3.147968 1.140043
H 2.036864 -2.940122 -0.541191
H 0.374266 -3.534110 -0.202833


