
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
    Ta=2.025
    W=1.992
    V=1.908
  SubEnd
end

XC
  GGA BP86
end

atoms
      1         O      2.561136     -2.820884     -4.388116
      2         O     -0.097595     -2.859840     -4.199453
      3         O     -0.164894     -4.782147     -6.273052
      4         O      0.668667     -2.085846     -6.714098
      5         O      1.779941     -5.024701     -4.100978
      6         O      2.565551     -7.618189     -5.284881
      7         O      0.761643     -6.126159     -1.478694
      8         O      0.015247     -7.168198     -4.180486
      9         O      1.969884     -8.513330     -2.662496
     10         O      3.380242     -6.138483     -2.761301
     11         O      4.718962     -4.550790     -4.609199
     12         O      2.393854     -4.001876     -1.342534
     13         O      3.563173    -10.536933     -2.375439
     14         O      1.221488    -10.452609     -0.602485
     15         O      2.040636     -0.084920     -4.786091
     16         O      5.074931     -4.572573     -1.972403
     17         O      7.202817     -3.299861     -0.456990
     18        Mo      3.472977     -4.220227     -3.339663
     19         O      6.746319     -6.500040     -0.723027
     20        Mo      2.722339     -9.512555     -0.786182
     21         O      2.269340     -7.914579      0.030755
     22         H      1.283764     -6.793768     -0.951282
     23         O      4.110715     -2.417965     -2.632720
     24         O      3.825794    -10.286968      0.379558
     25         H      6.181010     -3.376269     -3.703813
     26         O      6.243323     -0.800979     -1.205543
     27         O      1.427187     -1.504104     -2.352616
     28         O      6.080408     -6.707583     -3.524709
     29         H      0.878157     -2.062331     -2.979508
     30         H      5.347466     -1.352026     -4.149827
     31         O      4.645709     -8.168035     -1.418358
     32         H      3.294740     -9.954231     -3.117881
     33         O      4.697932     -0.747350     -4.584194
     34         H      3.327416     -4.237807     -6.097838
     35         O      6.691761     -2.680427     -3.226853
     36         O      4.459125     -2.716551     -0.022836
     37         O      2.542543     -4.179504     -6.684686
     38         O      3.945404     -5.991838      0.043652
     39         O      3.325662      0.425017     -2.298845
     40        Mo      5.303469     -6.523095     -1.736068
     41        Mo      5.893579     -2.522010     -1.355411
     42        Mo      2.998361     -0.842135     -3.485979
     43        Mo      0.897203     -3.536076     -5.599081
     44        Mo      1.755724     -7.077262     -3.801892
     45         H      1.974932     -3.114331     -1.500469
     46         H      3.260592     -6.780096      0.043624
     47         H      3.440666     -5.225164     -0.339529
     48         H      3.675348     -3.161749     -0.483836
     49         H      1.339429     -5.291638     -1.445887
     50         H      5.643745     -5.982090     -4.066437
     51        Mo      0.284263      0.115161     -6.602113
     52         O     -0.758532     -0.482681     -5.080443
     53         O     -0.930098      0.103092     -7.878450
     54         O      0.450159      1.832681     -6.232947
     55         H      2.209001     -0.998091     -7.557878
     56         O      1.967358     -0.051601     -7.661875
     57         H     -0.489957     -1.402494     -4.713024
end

charge -8

