! DLPNO-CCSD(T) def2-TZVPP def2-TZVPP/C VeryTightSCF TightPNO
%maxcore 6500

%pal nprocs 8 
end

%scf HFTyp UHF
end

*xyzfile -1 1 PFPeS_P3A_S_Reactant.xyz