
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
    Si=2.48
    W=1.992
    Ta=2.025
    Nb=2.025
    V=1.908
  SubEnd
end

XC
  GGA BP86
end

atoms
      1         W     13.724575     11.100981      2.494729
      2         W     14.177460      8.188188      4.388532
      3         W     11.876236     10.217696      5.437531
      4         W      9.490504     11.330193      3.276195
      5         W     11.384808      8.785821      2.243794
      6         O     13.299886     11.738390      0.907745
      7         O     13.422612      9.166342      2.246609
      8         O     13.667401      6.496530      3.531023
      9         O     13.898008     10.095375      4.689748
     10         O     14.470387      7.611296      6.033545
     11         O     11.649726     10.715620      3.160302
     12         O     12.059662      8.446924      4.440973
     13         O     10.060415     10.387788      5.220473
     14         O      7.768268     11.071285      3.712752
     15         O      9.405222     11.698456      1.530483
     16         O      9.666944      9.156142      2.798262
     17         O     12.356840     11.952164      5.719836
     18         O     12.001662      9.536760      7.071766
     19         O     11.445415      6.975410      2.226556
     20         O     15.809974      8.263043      3.691696
     21         O     11.267975      9.153139      0.515368
     22         O     15.495038     11.072386      2.415480
     23         O     13.517716     12.695129      3.567146
     24         O      9.851953     12.935561      3.968041
     25         H     12.999388     12.484033      4.436841
     26         H     12.769369      6.585162      3.073173
end

charge -6

