%chk=000246903.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246903

0 1
O -4.252766 -0.587980 -0.222539
O -3.082683 0.132024 -2.014182
N -2.754126 1.072158 1.750629
C 0.531257 0.141267 0.488380
C -0.717423 0.367250 -0.384681
C 0.195129 0.264055 1.989425
C -1.896653 -0.519046 0.043537
C -2.252127 -0.321449 1.543076
C -1.003898 -0.591104 2.407164
C 1.607718 1.172669 0.119519
C 1.243482 -1.176558 0.161849
C 2.789641 0.525224 -0.345428
C 2.565430 -0.926664 -0.319264
C -3.076270 -0.255004 -0.871348
C 1.546095 2.553797 0.190550
C 0.784593 -2.477526 0.273371
C 3.898963 1.263395 -0.732456
C 3.405455 -1.970930 -0.676151
C 2.672960 3.300168 -0.203267
C 1.638348 -3.536984 -0.089410
C 3.829466 2.666072 -0.656181
C 2.927797 -3.288630 -0.555631
C -5.509750 -0.407999 -0.946069
C -5.911080 1.052436 -0.921057
H -0.477225 0.192969 -1.452973
H -1.023004 1.434382 -0.307720
H -0.024716 1.328984 2.215472
H 1.082252 -0.006382 2.593339
H -1.614816 -1.598585 -0.102996
H -3.040008 -1.080162 1.805854
H -0.741183 -1.666209 2.342429
H -1.233471 -0.405868 3.474120
H 0.647744 3.059736 0.539457
H -0.221825 -2.687499 0.632652
H -2.784187 1.305123 2.737227
H -3.700632 1.159218 1.384079
H 4.801814 0.774348 -1.088268
H 4.410892 -1.780608 -1.042851
H 2.634751 4.387099 -0.152950
H 1.280564 -4.561508 -0.003514
H 4.691054 3.259575 -0.957110
H 3.575582 -4.118491 -0.832402
H -5.382517 -0.793453 -1.973967
H -6.185429 -1.058265 -0.362164
H -6.893405 1.205958 -1.383374
H -5.955648 1.447554 0.100323
H -5.187943 1.669244 -1.477803


%chk=000246903-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246903

0 1
O -4.371877 -0.318917 -0.073903
O -3.074778 -0.371121 -2.006449
N -2.729956 0.983775 1.940748
C 0.538252 0.070194 0.528940
C -0.775033 0.279778 -0.296455
C 0.216301 0.198422 2.057055
C -1.955964 -0.605537 0.182507
C -2.263433 -0.401172 1.693399
C -0.976336 -0.669923 2.512409
C 1.568883 1.136721 0.123247
C 1.294140 -1.229355 0.170815
C 2.753661 0.541154 -0.393738
C 2.585071 -0.922359 -0.366558
C -3.146838 -0.410870 -0.757050
C 1.456665 2.535435 0.211281
C 0.910347 -2.580140 0.299059
C 3.835639 1.340631 -0.824032
C 3.473157 -1.942107 -0.770569
C 2.540411 3.341234 -0.219146
C 1.800524 -3.607064 -0.107017
C 3.720930 2.747237 -0.732479
C 3.073256 -3.291542 -0.638987
C -5.595941 -0.176654 -0.926365
C -5.851735 1.292301 -1.273744
H -0.581876 0.094614 -1.367221
H -1.083258 1.334907 -0.181575
H -0.023454 1.258443 2.259955
H 1.119855 -0.055897 2.642211
H -1.670785 -1.670014 0.042052
H -3.025027 -1.159018 1.990505
H -0.720774 -1.743889 2.443683
H -1.183832 -0.473322 3.584217
H 0.546646 3.004241 0.603993
H -0.062952 -2.863794 0.710813
H -2.682597 1.251308 2.930163
H -3.662449 1.148705 1.545713
H 4.749649 0.886028 -1.222958
H 4.459036 -1.695577 -1.180963
H 2.466083 4.432852 -0.156760
H 1.497747 -4.655594 -0.007547
H 4.549099 3.385214 -1.061442
H 3.749131 -4.096582 -0.948689
H -5.455872 -0.783316 -1.837971
H -6.397053 -0.603721 -0.301727
H -6.792376 1.379977 -1.848771
H -5.949665 1.907381 -0.361927
H -5.032420 1.694735 -1.892028


