%chk=000221604.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221604

0 1
O 4.202871 0.802211 0.111873
O 5.197436 -2.641407 -0.353201
O 2.896155 2.592036 -0.351773
O -2.597790 -0.676898 0.099453
O -6.081898 -0.374613 -0.132655
O -4.799882 -2.074997 0.288433
N 1.963874 0.418797 0.055941
N 0.673244 0.744477 -0.065486
N -4.993886 -0.902311 0.031089
C 4.063806 -0.639934 0.359720
C 2.548239 -0.915542 0.392851
C 4.834539 -1.329398 -0.777252
C 2.986150 1.431397 -0.098029
C -0.284309 -0.134358 0.095688
C -1.646299 0.339740 -0.071761
C -2.258873 1.545937 -0.359014
C -3.834118 -0.035640 -0.097351
C -3.667429 1.306066 -0.375686
H 4.561062 -0.806567 1.341673
H 2.231921 -1.682751 -0.344202
H 2.210145 -1.255600 1.395896
H 5.812864 -0.822690 -0.937997
H 4.281551 -1.350060 -1.730307
H -0.190411 -1.201292 0.346060
H 4.455602 -3.268423 -0.482622
H -1.768067 2.489628 -0.536676
H -4.443495 2.031592 -0.567864


%chk=000221604-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221604

0 1
O 4.274324 0.842050 0.250856
O 4.412031 -2.772453 -0.530305
O 2.909025 2.652612 -0.345801
O -2.555450 -0.698574 0.166857
O -6.100552 -0.316873 -0.204123
O -4.844633 -2.133572 0.450788
N 2.026062 0.472486 0.124281
N 0.723887 0.823233 -0.076266
N -4.971517 -0.906910 0.059533
C 4.079963 -0.628278 0.439997
C 2.550142 -0.829311 0.598208
C 4.661665 -1.347666 -0.783624
C 3.035930 1.466402 -0.035518
C -0.221594 -0.078540 0.142080
C -1.594021 0.306426 -0.078829
C -2.236726 1.484245 -0.493416
C -3.794601 -0.108649 -0.106148
C -3.640165 1.217182 -0.510027
H 4.631845 -0.916203 1.347065
H 2.200411 -1.671425 -0.024617
H 2.252020 -1.011317 1.647687
H 5.742117 -1.118869 -0.860831
H 4.151658 -1.002166 -1.707502
H -0.051215 -1.111819 0.483797
H 4.892468 -3.326738 -1.192699
H -1.730901 2.412726 -0.746466
H -4.449172 1.891400 -0.778174


