Basis
  Core Small
  Type TZP
end

Charge -3

NumericalQuality Good

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
    Mo=1.992
    O=1.720
    H=1.300
    SubEnd
end

XC
  GGA PBE
end

atoms
      1        Mo      1.415876     -1.957530     -1.177691 
      2        Mo      2.170759      2.204098     -0.631470 
      3        Mo      3.422386     -0.432717      0.897134 
      4        Mo     -0.370837      0.280015      1.895397 
      5        Mo     -2.142948     -1.684348     -1.128527 
      6        Mo     -1.196882      1.701593     -1.272045 
      7        Mo     -3.759132     -0.038615      1.422804 
      8         O      0.060976     -1.271907      1.155371 
      9         O      0.180150      1.620520      0.808832 
     10         O      2.166120     -0.048445     -0.635605 
     11         O      0.616860      1.943016     -1.827084 
     12         O      2.882915     -2.128711      0.276038 
     13         O     -0.331059     -1.269959     -1.735076 
     14         O      5.125035     -0.501207      0.563308 
     15         O     -1.913697     -3.361437     -0.716323 
     16         O     -1.980531      1.466526     -2.814254 
     17         O     -2.205615      0.389351      2.517282 
     18         O     -4.477879      1.368317      0.679159 
     19         O      1.882201      3.812083     -0.005465 
     20         O      2.247693     -2.171052     -2.692182 
     21         O     -4.920234     -0.564496      2.617317 
     22         O     -1.924334      0.259290     -0.209015 
     23         O     -3.652030     -1.514311      0.249502 
     24         O      0.951375     -3.577995     -0.704098 
     25         O      3.417490      2.419333     -1.832365 
     26         O      0.659497      0.381138      3.332238 
     27         O      3.170412      1.508880      0.914537 
     28         O     -1.820202      3.213266     -0.670283 
     29         O     -3.058007     -1.655623     -2.605900 
     30         O      3.141383     -0.618858      2.780903 
     31         H      2.235916     -0.292848      3.083155 
end

