%chk=000245687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245687

0 1
O -3.977446 0.894638 -0.005747
O 3.977355 0.894608 0.004588
N -2.432377 -0.851127 -0.000651
N 2.432274 -0.851151 0.000752
N -1.213477 1.223998 0.000054
N 1.213393 1.223985 0.000779
C -1.207899 -0.148911 -0.000230
C 1.207799 -0.148934 0.000617
C -0.000052 -0.886592 0.000072
C -3.756551 -0.285058 -0.002364
C 3.756452 -0.285087 0.001955
C -0.000033 1.843426 0.000517
C -4.814593 -1.356710 0.000380
C 4.814486 -1.356748 -0.000193
H -0.000064 -1.967213 -0.000160
H -2.348667 -1.871478 0.000349
H 2.348561 -1.871502 -0.000110
H -0.000035 2.948320 0.000673
H -4.768946 -2.000414 -0.887604
H -5.813932 -0.887101 -0.001057
H -4.769170 -1.995456 0.891971
H 4.768842 -1.999943 0.888161
H 5.813829 -0.887145 0.000965
H 4.769051 -1.996003 -0.891416


%chk=000245687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245687

0 1
O -4.113161 0.902415 -0.005037
O 4.113075 0.902383 0.004743
N -2.430276 -0.771322 -0.000605
N 2.430174 -0.771339 -0.000100
N -1.225081 1.306240 0.000166
N 1.224994 1.306232 0.000445
C -1.213475 -0.062177 -0.000377
C 1.213379 -0.062186 0.000053
C -0.000051 -0.800940 -0.000420
C -3.773397 -0.301253 -0.002811
C 3.773300 -0.301280 0.001688
C -0.000041 1.901353 0.000488
C -4.778572 -1.459585 0.000507
C 4.778465 -1.459626 0.000322
H -0.000055 -1.897786 -0.000835
H -2.331715 -1.789853 0.000868
H 2.331606 -1.789869 -0.001546
H -0.000038 2.995802 0.000848
H -4.657944 -2.099025 -0.893959
H -5.794084 -1.039440 -0.000710
H -4.657938 -2.093872 0.898628
H 4.656788 -2.098524 0.895034
H 5.793979 -1.039492 0.002464
H 4.658868 -2.094454 -0.897554


