psi:(
label = "cc-pVTZ SCF H2"
jobtype = sp
wfn = scf
maxiter = 80
reference = twocon
basis = "cc-pVTZ"
multp = 3
charge = 2
socc = ( 1 0 1 0 0 0 0 0)
docc = (0     0     0     0 0 0 0 0)
subgroup = c2v
unique_axis = x
freeze_core = no
units = bohr
geometry = (
 ( H	0	0	-0.37 )
 ( H	0	0	0.37 )
)
origin = (0.0 0.0 0.0)
 )