
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
    Ta=2.025
    Nb=2.025
    V=1.908
  SubEnd
end

XC
  GGA BP86
end

atoms
      1         W      3.140353      1.913280     11.737673
      2         W      4.607386      5.265095     11.416858
      3         W      3.364320      8.453677     12.750362
      4         O      4.798677      5.181821      9.700676
      5         O      6.193402      5.434411     12.084079
      6         O      1.554317      1.846699     12.423484
      7         O      2.993502      1.636059     10.035496
      8         O      3.577540      6.798957     11.824939
      9         O      4.769677      8.783682     13.705426
     10         O      2.017633      8.310698     13.825254
     11         O      3.140033      9.929050     11.598889
     12         O      3.867961      3.646746     12.060446
     13         O      4.216135      0.522195     12.416973
     14         H      4.005385      0.181135     13.312864
     15         H      2.223176     10.215181     11.397627
end

charge 0

