%chk=000268004.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268004

0 1
O 0.490548 -1.328461 -2.143434
O 4.520116 1.545252 -0.200238
O -5.159892 1.496933 1.294797
O 1.943818 2.240356 -1.380388
O -6.025871 -0.296617 0.001906
O 5.877600 -0.158788 0.735326
N 0.131086 1.196921 -0.494430
C 0.338011 -1.146728 0.332767
C -0.420086 0.199373 0.467266
C -0.025553 -1.919917 -0.959000
C -1.910046 -0.008656 0.289707
C -1.546575 -2.111811 -1.097761
C 1.826782 -0.932407 0.437559
C -2.418596 -1.075739 -0.454640
C 2.370707 0.306738 -0.023443
C 1.520038 1.338254 -0.677606
C -2.769501 0.923628 0.939715
C 2.630704 -1.926468 0.983454
C -3.825140 -1.256254 -0.616153
C -0.768335 2.214211 -1.085721
C 3.735313 0.461881 0.124232
C -4.117504 0.736836 0.777986
C -4.641504 -0.343851 0.000932
C 4.550775 -0.571189 0.697164
C 4.032378 -1.766857 1.124853
C 5.900116 1.182287 0.149295
C -6.393656 0.868013 0.816858
H -0.001364 -1.785199 1.193775
H -0.231832 0.589881 1.510098
H 0.495704 -2.909921 -0.965760
H -1.824737 -3.111731 -0.699054
H -1.777417 -2.164248 -2.189094
H -2.369588 1.742954 1.532985
H 2.190296 -2.865210 1.317070
H -4.224953 -2.079739 -1.201923
H -1.586415 1.731297 -1.643810
H -0.197018 2.853102 -1.790886
H -1.198587 2.871326 -0.313394
H 0.191485 -0.396794 -2.249477
H 4.652449 -2.551740 1.550131
H 6.245099 1.885175 0.918837
H 6.480676 1.139094 -0.782353
H -6.908359 1.585139 0.163763
H -6.948371 0.503274 1.691388


%chk=000268004-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268004

0 1
O 0.361381 -1.172196 -2.229408
O 4.564579 1.593050 -0.167160
O -5.244848 1.455847 1.332497
O 2.022270 2.410123 -1.141940
O -6.119698 -0.366795 0.037717
O 5.938905 -0.143518 0.753187
N 0.131665 1.153942 -0.565020
C 0.339603 -1.170603 0.300998
C -0.433263 0.163831 0.437882
C -0.042318 -1.905605 -1.023650
C -1.937572 -0.044993 0.283095
C -1.552813 -2.228193 -1.037859
C 1.832985 -0.941874 0.447569
C -2.456141 -1.145925 -0.453812
C 2.382801 0.309939 0.013117
C 1.532186 1.377619 -0.592019
C -2.818539 0.878253 0.927037
C 2.658627 -1.949011 0.987548
C -3.867153 -1.311521 -0.596426
C -0.717517 2.269532 -1.039593
C 3.776059 0.468337 0.146823
C -4.188045 0.694181 0.770359
C -4.703713 -0.379785 0.012409
C 4.586231 -0.557203 0.688069
C 4.063037 -1.774985 1.119467
C 5.974054 1.170300 0.060212
C -6.483817 0.905413 0.720600
H -0.000005 -1.827229 1.126167
H -0.245598 0.575536 1.453999
H 0.529004 -2.849462 -1.081958
H -1.723425 -3.164500 -0.465916
H -1.834707 -2.445267 -2.084642
H -2.426131 1.706015 1.524867
H 2.207765 -2.891555 1.317148
H -4.277364 -2.155025 -1.159410
H -1.638621 1.877837 -1.497323
H -0.137216 2.840712 -1.779584
H -0.991903 2.959228 -0.217069
H 0.203400 -0.201411 -2.063326
H 4.705445 -2.550110 1.543964
H 6.467135 1.909788 0.710029
H 6.471292 1.051825 -0.919891
H -6.863472 1.620866 -0.032558
H -7.211747 0.688191 1.517102


