
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
  HYBRID B3LYP
end

atoms
      1         O      2.546266     -2.783495     -4.377704
      2         O     -0.137086     -2.955937     -4.104457
      3         O     -0.346439     -4.758020     -6.246109
      4         O      0.559341     -2.123826     -6.708291
      5         O      1.835006     -5.039962     -4.132721
      6         O      2.636907     -7.615944     -5.288127
      7         O      0.783224     -6.126172     -1.502708
      8         O      0.067154     -7.184243     -4.208345
      9         O      2.012438     -8.512329     -2.669270
     10         O      3.401324     -6.136728     -2.740063
     11         O      4.737431     -4.568974     -4.610419
     12         O      2.361310     -3.964971     -1.374536
     13         O      3.586312    -10.548188     -2.379629
     14         O      1.237610    -10.449715     -0.619074
     15         O      2.162364      0.146699     -4.762398
     16         O      5.063658     -4.581177     -1.945431
     17         O      7.066881     -3.322747     -0.307230
     18        Mo      3.494724     -4.206368     -3.351274
     19         O      6.763756     -6.503095     -0.736841
     20        Mo      2.739581     -9.506994     -0.794126
     21         O      2.280769     -7.915928      0.031460
     22         H      1.310405     -6.786458     -0.972104
     23         O      4.170049     -2.438779     -2.661285
     24         O      3.840243    -10.287974      0.372744
     25         H      6.268971     -3.383872     -3.588396
     26         O      6.237189     -0.791826     -1.104672
     27         O      1.322839     -1.466126     -2.452319
     28         O      6.100327     -6.697841     -3.536072
     29         H      0.788506     -2.075024     -3.065342
     30         H      5.263351     -1.405012     -4.177365
     31         O      4.657742     -8.171641     -1.425805
     32         H      3.322491     -9.959859     -3.119474
     33         O      4.665042     -0.770109     -4.633875
     34         H      3.060624     -4.567054     -6.086969
     35         O      6.775906     -2.702201     -3.091808
     36         O      4.331964     -2.682053     -0.037843
     37         O      2.416546     -4.190916     -6.720306
     38         O      3.979808     -6.010498      0.084303
     39         O      3.366260      0.258892     -2.202840
     40        Mo      5.315946     -6.524041     -1.749089
     41        Mo      5.838697     -2.501617     -1.286159
     42        Mo      2.935863     -0.847966     -3.517383
     43        Mo      0.756318     -3.511024     -5.598088
     44        Mo      1.805062     -7.071037     -3.814637
     45         H      1.899995     -3.110877     -1.577643
     46         H      3.283117     -6.785844      0.064310
     47         H      3.495750     -5.234978     -0.295384
     48         H      3.563176     -3.135954     -0.532899
     49         H      1.353246     -5.284379     -1.474637
     50         H      5.650082     -5.974316     -4.074320
end

charge -8

