
! RKS RI-PBE-QIDH RIJCOSX def2-QZVPPD AutoAux TightSCF DEFGRID3 D4

%MaxCore    4000

%pal
nproc 4
end

%scf
 MaxIter=100
end

%method
 D3S6 0.610
 D3A1 0.402
 D3S8 0.665
 D3A2 5.941
end

*xyzfile  0 1 1s.xyz
