
AnalyticalFreq
end

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
    W=1.992
  SubEnd
end

ScanFreq -1000 0

XC
  GGA PBE
end

atoms
W 13.758176 10.948623 2.436048
O 13.103494 11.327484 0.637174
W 11.654667 11.323654 4.867264
W 9.669532999999999 11.243667 2.224927
O 11.543213 12.801587 5.808188
O 13.963998 9.207025 2.486159
O 10.370057 10.71157 0.645999
O 9.167985 12.922848 1.962592
O 13.5468 11.468462 4.298838
O 15.356821 11.651052 2.200506
O 11.724467 11.270921 2.787989
O 11.806405 9.948066000000001 5.964582
O 9.864865 11.135243 4.280828
O 8.178151 10.265957 2.289207
H 12.129266 11.072345 0.583518
end

charge -3

geometry
End

