
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         V      3.642089      1.897709     10.301635
      2         V      5.587143      4.590394     10.392032
      3         V      5.379436      9.846505     14.609292
      4         O      4.636048      5.921994      9.595081
      5         O      6.529678      3.845895      9.245443
      6         O      2.833480      2.392032      8.937652
      7         O      4.801251      0.792237      9.882693
      8         O      6.550223      5.182238     11.598805
      9         O      6.542604     10.399722     13.564397
     10         O      5.856868      8.139222     15.115082
     11         O      5.316076     10.839754     15.942004
     12         O      4.411893      3.362812     11.132971
     13         O      2.424658      1.145800     11.427410
     14         V      1.853253      1.666139     15.669359
     15         V      2.881264      4.699169     14.521250
     16         V      5.025675      6.868979     16.090907
     17         O      1.571100      5.474408     15.093490
     18         O      2.663515      4.596714     12.750790
     19         O      2.625433      0.714109     16.784499
     20         O      0.449756      2.252831     16.321546
     21         O      4.366792      5.540673     14.958599
     22         O      3.798691      7.519385     16.985121
     23         O      2.982448      3.068607     15.220923
     24         O      6.136121      6.163656     17.105505
     25         V      2.521823      0.040757     12.877907
     26         O      1.970906     -1.471408     12.455454
     27         O      4.073554     -0.067841     13.441005
     28         O      1.421730      0.718006     14.179364
     29         V      3.238067      9.730833     12.052128
     30         O      1.590577      9.493367     12.033196
     31         O      3.591156     11.151751     11.268046
     32         O      3.751706      9.847431     13.811157
     33         V      4.661432      7.751040      9.634946
     34         O      6.200476      8.309189      9.345384
     35         O      4.070754      8.334212     11.252132
     36         O      3.645525      8.288438      8.432864
     37         H      3.378029      4.120734     12.209081
end

charge -8

