
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
  HYBRID B3LYP
end

atoms
      1         O      5.018915      9.163466     -1.312225
      2         O      5.001065     -4.399456     -1.439757
      3         O     -7.989213     -0.106495     -1.373721
      4         O      2.585321     -4.784840      4.548005
      5         O      0.071072      8.077834     -0.632621
      6        Ta     -2.499467      2.631456     -1.739141
      7         O      0.908528     -3.075883      3.289581
      8         O      8.015580     -4.180370     -1.868635
      9         O      5.754426     -8.690988      1.272772
     10         O      4.185606     -6.573378      2.773570
     11        Ta      3.564626     -4.724021     -0.264000
     12        Ta      3.840070     -4.744155      3.242539
     13         O      0.667022      6.930582      1.981661
     14        Ta      1.959691     -2.651609      1.658805
     15         O      5.521544     -4.456854      4.108739
     16        Ta     -3.696898     -0.496239      0.194208
     17        Ta     -6.429119     -1.040081      1.848872
     18         O     -4.395508     -1.716317     -1.260209
     19         O     -8.540434     -5.307573      2.475232
     20        Ta     -6.223387     -0.722357     -1.773009
     21         O      6.259789     -2.357688     -0.157793
     22         O      6.668337     -6.240319     -0.191562
     23        Ta      0.971112      3.539204      0.181869
     24        Ta      5.164543     -2.168921      1.374455
     25        Ta      5.557088     -6.916468      1.309060
     26        Ta     -4.994978     -3.485190     -0.099268
     27         O     -6.004179     -0.023387      3.256213
     28         O     -0.637820      9.755773     -3.039617
     29         H      1.052377     -4.814083     -1.213433
     30         O    -10.753651     -0.498348     -0.214027
     31         O      7.971076     -4.152453      1.107429
     32         O     -5.865619     -4.578729      1.153830
     33        Ta     -7.880904     -4.058593      1.375345
     34        Ta      3.485101      1.168235      1.753199
     35        Ta     -9.146738     -1.287075     -0.181695
     36         O     -0.817724      6.705481     -2.805010
     37        Ta      6.861572     -4.308993     -0.511322
     38        Ta     -1.280975     -3.703354      0.299850
     39        Ta     -7.640797     -3.749414     -2.033469
     40        Ta      1.147134      6.769543      0.267118
     41        Ta      0.116107      5.086506     -2.574410
     42        Ta      7.171506     -4.347922      2.911380
     43         O      3.377093     -2.625385      0.204669
     44         O      3.043523      6.273099     -6.119388
     45         O      8.546669     -4.236790      4.043864
     46         O      1.775477      6.287780     -2.003496
     47         O      4.703963      2.527533      1.212502
     48        Ta      0.417104      8.371282     -2.618915
     49        Ta      3.395777      4.660151     -1.642475
     50        Ta      3.675304      8.021745     -1.626381
     51        Ta      2.545165      6.356566     -4.400837
     52         O      2.418821     -4.596622      1.552288
     53         H      4.661510      2.830123      0.214610
     54         O     -9.374908     -2.831968      1.052788
     55         O     -1.132109     -4.430229      2.074399
     56         O     -5.665204     -4.306107     -1.665354
     57         O     -6.737958     -2.135184     -2.938874
     58         O     -8.154830     -0.363280      1.320929
     59         O      2.025894     -0.548786      1.716915
     60         O     -2.908312      0.096869      1.919901
     61         O     -3.489406      2.018948     -3.259487
     62         O      1.197240      7.798697     -4.351426
     63         O     -7.096601     -2.658743      2.632739
     64         O     -5.558048      0.550067     -2.880972
     65         O     -0.115487      5.172757     -0.412265
     66         O     -8.136027     -4.774432     -3.416373
     67         H     -4.341116      1.443812     -3.119442
     68         O      0.028284      3.669696      1.918821
     69         O      3.660547     -2.639132      2.823162
     70         O     -1.920494     -1.746042     -0.173931
     71         O      5.097987     -4.347496      1.302331
     72         O     -2.849860      0.896887     -0.766245
     73         O     -1.278476      3.766767     -2.766006
     74         O      3.551552      4.781027     -3.532611
     75         O      2.136812      9.178907     -2.121783
     76         O      1.521849      3.598950     -1.773334
     77         O     -0.666107      2.333071     -0.576945
     78         O      6.527009     -2.395660      2.657250
     79         O      0.941021      5.031169     -4.270651
     80         O     -8.112440     -4.820871     -0.439578
     81         O     -5.516255      0.170467      0.185596
     82         O      1.945976      1.980231      0.778510
     83         O      3.857569      7.544081     -3.553916
     84         O      4.482344      3.269146     -1.205640
     85         O      6.934851     -6.272472      2.570818
     86         O      2.786597      7.778922      0.175302
     87         O      4.468899      6.187903     -1.229711
     88         O      2.366547      4.884046      0.354345
     89         O      2.053184     -4.815054     -1.416127
     90         O     -6.766797     -2.332394     -0.152962
     91         O      3.948554     -6.543470      0.076300
     92         O     -4.558296     -1.973981      1.365522
     93         O     -3.151935     -4.114539     -0.006061
     94         O      0.376891     -2.573517      0.606734
     95         O      4.758983     -0.306611      1.452726
     96         O     -9.181153     -2.577026     -1.699696
     97         H     -1.111025     -1.203880     -0.081495
     98         O      3.364488      1.482071      3.487743
     99         O     -3.547316      3.750239     -0.861533
    100         O     -0.512235     -4.789072     -0.905762
    101         H     -0.903466      1.637146      0.066030
    102         H      1.237114     -0.173378      1.277611
    103         H     -2.545747      1.002952      1.922568
    104         H      0.303885      3.016742      2.590452
    105         H      1.409804     -3.682597      3.924090
    106         H     -0.409345     -4.007091      2.638960
end

charge -14

