
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
    P=2.13
  SubEnd
end

XC
  METAGGA M06L
end

atoms
      1        Mo      0.581586     -2.736565      2.145015
      2         O     -2.500359     -2.874161     -0.112142
      3        Mo     -0.662331      3.658630     -0.602090
      4        Mo      3.478790      0.641203      0.329861
      5        Mo     -2.416516     -1.411197      0.806886
      6        Mo      1.130273      1.238312     -2.416108
      7        Mo      2.242973      3.547459      1.839206
      8         O      1.861366      1.532833     -3.933908
      9         O      2.840182      5.077867      2.328531
     10        Mo      2.040649      0.474053      3.503545
     11        Mo      1.332332     -2.320635     -1.221528
     12        Mo     -2.311625      1.031619     -2.102233
     13         O      0.083673     -1.102152      0.261237
     14         O     -1.379747      0.304475      1.606227
     15         O     -0.348698      1.275388     -0.543035
     16         O      1.151281      0.980549      1.422657
     17         O      0.230383      0.719836      4.090161
     18         O     -2.717749     -0.208670     -0.755942
     19         O      2.701035     -3.106595     -1.920872
     20         O      1.304511     -0.628136     -2.225608
     21         O      5.127268      0.612128     -0.140592
     22         O      2.882733     -0.972905     -0.078043
     23         O     -1.779386      3.250963      0.910850
     24         O      1.583379     -1.380972      2.935686
     25         O      0.850221      3.860289      0.610092
     26         O     -1.030427      5.279312     -0.970586
     27         O      2.543235      1.485371     -1.190492
     28         O     -3.888019     -1.319862      1.689469
     29         O     -0.018405     -3.080591     -1.974636
     30         O     -3.611425      0.895618     -3.215153
     31         O     -0.788939      0.802490     -3.101115
     32         O      2.138249      2.501081      3.370095
     33         O      1.301929     -3.337091      0.546277
     34         O     -2.246421      2.806883     -1.663341
     35         O      3.531571      0.431909      2.265889
     36         P     -0.107367      0.396913      0.730804
     37         O      2.842036      0.220170      4.983936
     38         O      3.555553      2.756372      0.927260
     39         O     -1.215912     -2.392711      2.208762
     40         O      0.414938      3.079632     -2.070015
     41         O      0.781570     -4.072019      3.201762
     42         H     -2.269369      4.046238      1.218946
     43         H      0.141091      0.634603      5.065744
end

charge -1

