# runs are executed in the same order as in this file
# the second field tells which test should be run in order to compare with the last available output
# see regtest/TEST_FILES
"CH3-BP-McWeeny.inp"                    = [{matcher="E_total", tol=2e-13, ref=-7.40042056396486}]
"CH3-BP-NONE_DM.inp"                    = [{matcher="E_total", tol=5e-13, ref=-7.39772202069834}]
"CH3-BP-NONE_DM_OT_OFF.inp"             = [{matcher="E_total", tol=5.0E-14, ref=-7.39804787149080}]
"CH4-BP-NONE_DM.inp"                    = [{matcher="E_total", tol=2e-13, ref=-8.07712026700795}]
"CH4-BP-NONE_DM_OT_OFF.inp"             = [{matcher="E_total", tol=5e-14, ref=-8.07712135364825}]
"2H2O-BLOCKED-NONE_DM.inp"              = [{matcher="E_total", tol=3e-13, ref=-34.07863705853961}]
"H2+-BLOCKED-NONE_DM.inp"               = [{matcher="E_total", tol=2e-12, ref=-0.45795647554813002}]
#EOF
