
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
    Si=2.48
    W=1.992
    P=2.13
  SubEnd
end

XC
  GGA BP86
end

atoms
      1        Mo      0.645685      1.351651     -0.018451
      2         O     -0.297926      2.390788      1.050011
      3         O      1.742717      0.349017      0.935294
      4         O     -0.431956      0.294721     -0.935320
      5         O      1.650725      2.535064     -1.205158
      6         H      2.250661      2.062441     -1.817377
end

charge -1

