Job Name
Calculation	&generate_template_list("orca", $username)
Method	Hartree-Fock MP2 RI-MP2 CCSD CCSD(T) BLYP PBE B3LYP PBE0 Other
Excited State Method	CIS CIS(D) TDDFT
Basis Set	Minimal: STO-3G Basic: 3-21G Routine: 6-31G(d) Accurate: 6-311+G(2d,p) def2-SVP def2-TZVP def2-TZVPP def2-aug-TZVPP def2-QZVPP cc-pVDZ cc-pVTZ cc-pVQZ aug-cc-pVDZ aug-cc-pVTZ aug-cc-pVQZ Other
Auxiliary Basis Set	None AutoAux def2-SVP/C def2-TZVP/C def2-TZVPP/C def2-QZVPP/C cc-pVDZ/C cc-pVTZ/C cc-pVQZ/C aug-cc-pVDZ/C aug-cc-pVTZ/C
ONIOM Method (Layer B)	None / Disable ONIOM PM3 HF 3-21G B3LYP 3-21G Other
Charge
Multiplicity	Singlet Doublet Triplet Quartet Quintet Sextet
Unrestricted

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

Solvent	None Water Acetonitrile Acetone Ethanol Methanol CH2Cl2 CCl4 DMF DMSO Pyridine Chloroform Hexane Toluene
Calculate spin-spin coupling
Use Symmetry
AIMD number of steps
AIMD step size (fs)
AIMD ensemble	Constant E / NVE Constant T / NVE
AIMD initial velocities	Zero Thermal / Boltzmann
AIMD temperature (K)
AIMD dump interval (fs)
Cartesian Coordinates
Additional Keywords

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