Job Name
Calculation	&generate_template_list("nwchem", $username)
Theory	HF DFT MP2 CCSD CCSD(T) Other
DFT Functional	B3LYP PBE0 BLYP Other
Basis Set	Minimal: STO-3G Basic: 3-21G Routine: 6-31G(d) Accurate: 6-311++G(d,p) cc-pVDZ cc-pVTZ cc-pVQZ aug-cc-pVDZ aug-cc-pVTZ aug-cc-pVQZ Other
ONIOM Method (Layer B)	None / Disable ONIOM HF/3-21G B3LPY/3-21G Other
Charge
Multiplicity	Singlet Doublet Triplet Quartet Quintet Sextet
Charge (Layer A)
Multiplicity (Layer A)	Singlet Doublet Triplet Quartet Quintet Sextet
Charge (Layer B)
Multiplicity (Layer B)	Singlet Doublet Triplet Quartet Quintet Sextet
Unrestricted

'' if ($version !~ /p|e$/)

Calculate spin-spin coupling
Basis Set Type	Cartesian Spherical
Cartesian Coordinates
Additional Keywords

'' if ($version !~ /p|e$/)