
NumericalQuality Good

QTAIM
    Enabled Yes
End

Relativistic Scalar ZORA

SOLVATION
  Surf Delley
  Solv name=Water cav0=0.0 cav1=0.0067639
  Charged method=CONJ
  C-Mat POT
  SCF VAR ALL
  CSMRSP
  Radii
    H=1.30
    O=1.72
    Mo=1.992
    Ta=2.025
    W=1.992
    V=1.908
  SubEnd
end

XC
  GGA BP86
end

atoms
      1        Mo      0.209522      1.248786      2.765620
      2         O      1.273814     -0.334159      2.563817
      3         O     -0.658190      1.599318      1.306238
      4         O      1.274866      2.750075      3.302758
      5         O     -0.915572      0.942124      4.054106
      6         H      1.578276      3.309129      2.554071
      7         H      1.555526     -0.507454      1.638573
end

charge 0

