
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      3.979010      3.546062      6.923338
      2         W      6.711876      3.567245      9.999770
      3         W      4.182876      1.665630      9.685215
      4         W      3.214758      6.771933      8.060766
      5         W      7.047922      7.293239      9.471519
      6         W      4.496667      9.308632      9.619470
      7         O      5.263116      3.215920      8.774605
      8         O      6.741544      5.349715      9.456379
      9         O      3.232069      2.146574      8.033511
     10         O      4.379133      5.344683      7.355361
     11         O      2.071676      5.790499      8.942883
     12         O      8.006381      7.544023      8.039339
     13         O      3.957354      9.694444     11.241581
     14         O      6.408417      9.068281      9.931512
     15         O      7.354573      3.924947     11.772186
     16         O      5.227761      2.934612      5.867815
     17         O      4.556266     10.794664      8.690695
     18         O      4.997503      7.362379      8.966897
     19         O      2.886769      8.519101      8.888032
     20         O      2.583395      3.740923      5.888915
     21         O      8.095904      2.837543      9.269325
     22         O      2.844142      1.773219     10.808165
     23         O      5.659490      2.134871     10.867335
     24         O      8.172367      7.219228     10.811677
     25         O      2.480606      7.180491      6.527318
     26         O      4.520022     -0.022953      9.379554
     27         H      6.704712      3.960291     12.503036
end

charge -3

