% Created by MoleCuilder
psi: (
	label = "unknown job"
	jobtype = sp
	wfn = scf
	maxiter = 80
	reference = rhf
	basis = "cc-pVTZ"
	freeze_core = yes
	units = angstrom
	geometry = (
	( O	-1.506	0	0 )
	( H	-0.747	0	0.504 )
	( H	-0.747	0	-0.504 )
	( O	0.494	0	0 )
	( H	1.253	0	0.504 )
	( H	1.253	0	-0.504 )
	)
	origin = (0.0	0.0	0.0)
)