
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      3.063593      2.338898     10.446403
      2         V      4.297600      5.318287      9.504814
      3         V      4.609212      8.571163     13.807791
      4         O      4.267077      5.228296      7.843031
      5         O      5.821650      4.960068     10.053148
      6         O      1.479776      1.842520     10.539047
      7         O      3.806886      1.585712      9.164997
      8         O      3.798830      6.996395     10.023869
      9         O      4.882799     10.107001     14.391994
     10         O      5.407070      7.343448     14.901479
     11         O      2.978278      8.294258     13.714727
     12         O      3.080766      4.150934     10.212640
     13         O      3.951630      1.939320     11.988597
     14         V      2.092119      0.837048     15.992826
     15         V      2.408331      4.152270     16.390738
     16         V      4.952955      6.518710     16.468236
     17         O      1.652718      4.742103     17.750160
     18         O      1.416303      4.348168     15.077691
     19         O      2.784673     -0.429926     16.819660
     20         O      0.445148      0.810283     16.227352
     21         O      3.988093      5.019482     16.107836
     22         O      4.100763      7.554732     17.443154
     23         O      2.795563      2.384106     16.652982
     24         O      6.364523      6.065019     17.230027
     25         V      3.904355      0.556921     13.177316
     26         O      3.887080     -0.896746     12.365789
     27         O      5.266033      0.649610     14.123568
     28         O      2.400753      0.662094     14.202752
     29         V      4.735837      8.503080     10.457713
     30         O      3.710914      9.803110     10.303664
     31         O      6.026463      8.694235      9.427816
     32         O      5.385652      8.409383     12.162020
end

charge -8

