
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      0.916413      4.997504      3.172600
      2        Mo     -0.723215      2.466991      7.397777
      3        Mo     -1.191177      2.612867      3.943554
      4        Mo      0.877482      5.396129      6.420999
      5         O     -0.658035      0.980148      3.625142
      6         O      0.289292      6.928955      7.020803
      7         O     -0.239626      3.541178      2.533163
      8         O     -0.324905      4.285451      7.620669
      9         O      0.036738      4.101885      4.911839
     10         O      2.431568      4.522768      2.427401
     11         O     -1.596838      1.874296      8.797458
     12         O      0.234824      6.323403      2.247443
     13         O      0.760242      1.547696      7.216679
     14         O     -1.781083      2.286771      5.861783
     15         O      1.593600      5.996889      4.719217
     16         O     -2.819777      2.765095      3.327055
     17         O      2.373197      5.044078      7.251036
end

charge -2

