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         O      2.551166     -2.768875     -4.470492 
      2         O      5.906419     -4.450714     -2.440059 
      3         H      0.744096     -2.422914     -2.911299 
      4         H      1.208449     -4.748260     -1.264184 
      5         O      2.220018     -5.137641     -4.584015 
      6         O      3.330914     -7.570046     -4.636487 
      7         O      0.459303     -5.720305     -2.594446 
      8         O      0.432090     -7.640122     -4.746172 
      9         O      1.856927     -8.120280     -2.387900 
     10         O      3.456459     -5.687035     -2.487131 
     11         O      4.918430     -4.341215     -4.927280 
     12         O      1.562913     -4.091677     -0.601537 
     13         O      3.027573     -3.852344     -7.102463 
     14         O      0.614143     -2.056995     -6.411315 
     15        Mo      2.766719     -0.907435     -3.266576 
     16         O      0.402105     -4.853226     -6.651819 
     17         O      8.132368     -2.851298     -1.538702 
     18        Mo      3.731261     -4.183728     -3.607256 
     19         O      6.433286     -6.555439     -0.411576 
     20        Mo      0.923041     -3.566036     -5.534389 
     21         O     -0.248251     -3.572195     -4.153182 
     22        Mo      1.621599     -6.943471     -3.665989 
     23         O      3.993538     -2.735585     -2.484020 
     24         O      6.466503     -2.191381     -3.862010 
     25         H      6.187014     -2.978769     -4.386401 
     26         O      6.064644     -0.848900     -1.583872 
     27         O      1.267223     -1.885085     -2.263458 
     28        Mo      4.818351     -6.649818     -1.087967 
     29         H      1.581910     -3.245276     -1.137867 
     30         O      3.288756     -0.085038     -1.782557 
     31         O      4.032354     -7.940780     -0.200120 
     32         H      3.727304     -4.026808     -6.421470 
     33         O      4.367738     -0.683669     -4.341921 
     34         O      1.762712      0.232066     -4.144176 
     35         O      5.278304     -7.570828     -2.748293 
     36         O      5.688261     -3.082271     -0.054809 
     37         H      2.715859     -4.744979     -7.354966 
     38         O      4.069191     -5.113670     -0.017546 
     39        Mo      6.406655     -2.801005     -1.843015 
     40         H      3.198100     -4.744832     -0.361379 
     41         H      5.039616     -3.871084     -0.042639 
     42         H      0.167953     -4.943764     -3.163015 
     43         H      5.178882     -1.278229     -4.115904 
     44         H      4.551925     -7.530489     -3.449108 
     45         H      3.566868     -6.832367     -5.235127 
     46         H      5.103276     -0.617213     -1.649322 
end

