%chk=000239582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239582

0 1
O -1.292590 -2.085482 0.503297
N -2.268182 -0.378339 -0.650906
C -4.510090 -0.010647 0.402643
C -4.993241 1.241814 -0.339761
C -3.636090 -0.921671 -0.471610
C -5.891640 2.106234 0.541838
C -1.164876 -1.014054 -0.075031
C 0.137692 -0.316931 -0.259813
C 2.587209 -0.229258 0.143022
C 1.252792 -0.835686 0.272642
C 2.769338 1.159318 0.247405
C 3.699560 -1.060830 -0.077251
C 4.048983 1.708452 0.128232
C 4.974020 -0.504837 -0.203986
C 5.151258 0.879391 -0.100439
H -3.957035 0.278512 1.318532
H -5.382937 -0.591611 0.762280
H -5.541978 0.948004 -1.256504
H -4.126465 1.838514 -0.683204
H -4.092285 -1.066312 -1.475957
H -3.559856 -1.935704 -0.003440
H -5.370072 2.441587 1.445812
H -6.229727 3.001167 0.007315
H -6.786183 1.561328 0.865327
H -2.201409 0.549166 -1.049676
H 0.141916 0.600006 -0.845019
H 1.211016 -1.777873 0.841163
H 1.914294 1.807767 0.431789
H 3.566151 -2.139346 -0.156101
H 4.186508 2.785319 0.213869
H 5.832534 -1.151227 -0.381349
H 6.146787 1.309426 -0.195918


%chk=000239582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239582

0 1
O -1.392075 -2.022255 0.307461
N -2.343286 -0.286299 -0.926446
C -4.587264 -0.192345 0.233833
C -4.849510 1.316332 0.025657
C -3.707182 -0.836469 -0.865213
C -5.767169 1.915603 1.113403
C -1.262209 -0.919320 -0.317537
C 0.039640 -0.205524 -0.467582
C 2.535704 -0.158650 0.039810
C 1.177656 -0.720581 0.085277
C 2.859034 1.057401 -0.631272
C 3.585008 -0.861194 0.699534
C 4.178924 1.547841 -0.638372
C 4.907630 -0.370823 0.693062
C 5.210804 0.837094 0.023686
H -4.106419 -0.359379 1.217045
H -5.556028 -0.732559 0.255671
H -5.306333 1.475498 -0.973627
H -3.883410 1.861283 0.024971
H -4.186576 -0.708649 -1.855868
H -3.598161 -1.916868 -0.666749
H -5.321580 1.790093 2.117927
H -5.937790 2.995669 0.950812
H -6.753266 1.414119 1.119765
H -2.192459 0.607373 -1.396270
H 0.048996 0.737226 -1.032088
H 1.050863 -1.669178 0.628423
H 2.074841 1.620616 -1.149628
H 3.351670 -1.798242 1.219679
H 4.409782 2.483981 -1.159139
H 5.698922 -0.927267 1.207245
H 6.236642 1.221670 0.015732


