
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
  METAGGA M06L
end

atoms
      1        Mo      1.902696      0.990263     -2.277965
      2        Mo     -0.155568     -0.353135      0.271942
      3         H     -0.454914      5.331251     -2.267288
      4         O     -0.789651      4.323042      1.231829
      5         O     -1.139726     -1.708646      0.750349
      6        Mo      1.025835      1.397452      5.466238
      7         O      3.180029      2.210155     -2.341221
      8         O      2.780272      0.956551      6.192339
      9         O      2.981486      1.765412     -5.994619
     10         O     -0.106401      2.491533      4.439055
     11         O      3.628577      2.544638      1.052906
     12         O      1.489595      1.369668     -0.185279
     13         O     -1.166897      6.164918     -1.000330
     14         O     -0.034250     -0.392734     -1.538540
     15        Mo      1.085594      2.187767     -5.868977
     16        Mo      0.267331      3.044460     -0.104208
     17         O      1.003346     -0.032119      1.954963
     18         O      0.998219      4.863729      3.580403
     19         O      1.319179      0.920490     -3.998227
     20         O      0.612830     -0.222632      4.592903
     21         O     -2.163545      2.315285      2.717119
     22        Mo     -1.331581      3.081921     -3.208920
     23         O      2.588909      1.614299      3.598394
     24        Mo     -2.541085      4.992341     -0.001325
     25         O     -2.546442      6.668738      1.034364
     26         O      0.868179      2.646005      1.764130
     27         H      1.702371      4.072164      5.034538
     28         O      0.326712      0.864068     -6.705778
     29         H     -2.842952      2.905926      2.299394
     30         H     -1.852631      1.748451      1.949347
     31         O      2.749909     -0.548847     -1.984677
     32         O      3.580759     -0.148024      1.401643
     33         O      0.169444      1.230006      6.942151
     34        Mo      2.389266      1.307475      1.869488
     35         H     -0.818502      6.949709     -0.535209
     36         H      2.841922      3.481799      5.965415
     37         O      1.071726      3.493223     -7.017230
     38         H      2.509086      3.395207     -3.619238
     39         O     -1.732523      4.859935      3.839220
     40         O     -1.166368      1.124928      0.544205
     41         O      1.393153      4.296157     -0.447608
     42         O      0.247580      2.340556     -1.952283
     43         H     -1.317594      0.740278     -2.285416
     44         O     -0.664536      2.758908     -4.874144
     45         H      3.661773      2.552892      0.068807
     46        Mo     -0.437673      3.953182      3.123704
     47         H      3.181346      0.958899     -5.473328
     48         O      1.791382     -1.802037      0.064329
     49         O     -2.921745      3.797293     -3.411138
     50         O     -1.987744      1.316227     -2.746390
     51         O     -0.277744      4.746509     -3.076511
     52         O     -1.560022      3.549753     -0.931660
     53         O     -3.877813      5.102977     -1.329584
     54         O     -3.498055      4.254210      1.272085
     55         H      3.484105      1.047635      5.513069
     56         H      3.082924     -0.958342      1.115308
     57         H      2.186699     -1.509235     -0.825258
     58         H      1.567503     -2.750074     -0.027793
     59         O      1.873199      3.473100      5.817974
     60         O      1.965039      3.853448     -4.311426
     61         H      1.235650      4.300191     -3.787555
     62         H     -3.580222      4.759113     -2.233963
     63         H      0.711096     -0.222350      3.577239
     64         H     -3.021557      6.503624      1.877447
end

charge -2

