Basis
  Core Small
  Type TZP
end

Charge -5

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         H      5.531421     -5.648100     -3.376838 
      2         H      3.249996     -8.877822      0.020068 
      3         O      6.130874     -6.126815     -2.733332 
      4        Mo      1.892266     -7.249347     -3.101324 
      5         O      1.582055     -4.774996     -3.186501 
      6         O      2.853333     -6.998428     -4.638376 
      7         O      1.202197     -6.645063     -1.160985 
      8         O      0.232864     -7.461037     -3.727967 
      9         O      2.407501     -8.836714     -2.528818 
     10         O      3.540921     -5.977099     -2.207477 
     11         O      4.364095     -4.897928     -4.443432 
     12         O      1.968246     -2.334149     -2.567739 
     13         O      3.774750    -11.540374     -2.306329 
     14         O      0.963570    -11.329588     -1.503724 
     15         O      2.844333    -12.742980      0.112954 
     16         O      5.821110     -8.235295     -1.020275 
     17         O      3.483729     -7.344345      0.014118 
     18        Mo      3.201666     -3.943301     -3.071974 
     19         O      5.789666     -5.590025      0.093030 
     20        Mo      2.657566    -11.307965     -0.935410 
     21         O      3.065160     -9.870000      0.280703 
     22        Mo      5.049842     -6.642335     -1.123367 
     23         O      3.580301     -2.561977     -4.522952 
     24         O      4.183992     -3.474514     -1.670043 
     25         H      1.253974     -5.672436     -1.264051 
     26         H      2.608149     -7.021043     -0.390830 
     27         H      2.587897     -1.623780     -2.308545 
     28         H      3.844708     -5.782092     -4.552006 
     29         H      4.141420     -3.100355     -5.123279 
end

