
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         O      2.393202     -2.827380     -4.242550
      2         O      5.279001     -4.478997     -2.208917
      3         H      0.813295     -2.224738     -2.843880
      4         H      1.233812     -5.221784     -1.892375
      5         O      2.068535     -5.212563     -4.321649
      6         O      3.119233     -7.543002     -4.913988
      7         O      0.645386     -6.049516     -2.223999
      8         O      0.236248     -7.661355     -4.500220
      9         O      2.074731     -8.548397     -2.589101
     10         O      3.475726     -6.071128     -2.553600
     11         O      4.624710     -4.313985     -4.805837
     12         O      2.127783     -4.146172     -1.533177
     13         O      2.612725     -3.760968     -6.721642
     14         O      0.190515     -2.227291     -6.164707
     15        Mo      2.902703     -0.886124     -3.331871
     16         O      0.173552     -5.015271     -6.451444
     17         O      7.885130     -3.295400     -1.285053
     18        Mo      3.579410     -4.222279     -3.342024
     19         O      6.508926     -6.309775     -0.455580
     20        Mo      0.961020     -3.697557     -5.557481
     21         O     -0.219318     -3.714112     -3.894800
     22        Mo      1.625240     -7.122752     -3.545948
     23         O      4.022249     -2.445493     -2.532602
     24         O      6.567573     -2.584063     -3.717402
     25         H      6.011891     -3.264270     -4.175150
     26         O      6.277471     -0.994081     -1.490742
     27         O      1.227567     -1.548394     -2.252461
     28        Mo      4.887882     -6.570391     -1.123816
     29         H      1.837252     -3.200039     -1.536375
     30         O      3.132838      0.310910     -2.040238
     31         O      4.309907     -8.029023     -0.304356
     32         H      3.397934     -3.809576     -6.115990
     33         O      4.600601     -0.671913     -4.410367
     34         O      2.036416     -0.036835     -4.634258
     35         O      5.627500     -7.457056     -2.805279
     36         O      5.354753     -3.043868      0.088992
     37         H      3.302539     -6.646082     -5.266173
     38         O      3.859523     -5.279486      0.029571
     39        Mo      6.236075     -2.765010     -1.671333
     40         H      3.151332     -4.788175     -0.537929
     41         H      4.828097     -3.904601      0.073043
     42         H      0.091909     -4.477484     -3.346518
     43         H      5.285832     -1.311866     -4.066477
     44         H      4.884981     -7.374354     -3.449258
end

charge -7

