
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
  HYBRID B3LYP
end

atoms
      1         O      0.063454     -0.156967      0.012465
      2         O      1.811138     -2.622251     -2.484679
      3         W      1.967722     -0.017056      1.463415
      4         W      1.038914      1.589812     -1.359756
      5         W     -1.940010     -0.001017     -1.290021
      6         W     -0.908607      1.762418      1.404482
      7         W      0.877371     -1.645620     -1.150468
      8         O      2.305608      1.322734      0.072970
      9         O     -0.738628      1.331824     -2.074011
     10         O     -2.670852     -1.390272     -0.185912
     11         O      1.171228     -1.401843      2.523426
     12         O     -2.271977      1.270940      0.140888
     13         O      0.736556      1.260756      2.260166
     14         O      2.320940     -1.354054      0.100798
     15         O     -0.783105     -1.345113     -2.086161
     16         O     -1.740850      0.296902      2.577846
     17         O      0.045667      2.632977      0.051005
     18         O      1.591496     -0.025194     -2.152027
     19         O      0.239583     -3.090692     -0.243831
     20         O     -1.531068      3.093842      2.293938
     21         O     -3.245233      0.215274     -2.393560
     22         O      1.730287      2.839117     -2.332583
     23         O      3.449079      0.192349      2.317614
     24         O     -1.565063     -2.636439      2.322334
     25         O     -4.948860     -2.985523      0.015977
     26         W     -2.379906     -1.147382      3.484887
     27         W     -2.541049     -4.382928      3.695577
     28         W     -0.593146     -4.555657      0.930079
     29         W      0.437534     -2.791997      3.624393
     30         W     -3.468158     -2.776736      0.871477
     31         O     -3.094122     -2.768171      4.487051
     32         O     -1.547403     -5.426006      2.283184
     33         O      0.770255     -4.063073      2.193501
     34         O     -0.719686     -1.448698      4.420820
     35         O     -3.822816     -1.439877      2.235036
     36         O     -2.237972     -4.053943      0.073647
     37         O     -0.763934     -4.125811      4.408401
     38         O     -3.806807     -4.116099      2.261614
     39         O      1.741530     -3.010220      4.729054
     40         O      0.030077     -5.887115      0.041201
     41         O     -3.232512     -5.632582      4.667935
     42         O     -3.311985     -0.169217      4.819251
     43         H     -3.282523      0.810658      4.785736
     44         H      1.794196     -3.602263     -2.445260
end

charge -2

