
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     -7.355234      4.002151      2.865544
      2         O     -4.348957      8.556449      1.694679
      3         H     -2.867740      8.689140     -4.942662
      4         H     -2.574513      3.175980      6.201680
      5         O     -4.247535     -0.278777      2.392600
      6         O     -6.328019      6.962643      2.968971
      7         O     -6.516015      7.003012     -2.645633
      8         O     -5.307832     -2.478529     -0.361816
      9         O     -3.378475     10.911347      0.065445
     10         O     -2.614289     -1.083850     -2.583996
     11         O     -7.368531      3.854484     -2.736221
     12         O     -4.942266      4.842109     -1.701654
     13         O     -2.300122      3.817238     -6.520070
     14         O     -3.446361      6.143567      0.124231
     15         O      0.325867      6.822219      4.044424
     16         O     -1.627267      8.560202      2.554444
     17         O     -4.822023      2.815863      0.018143
     18         O     -4.294754      0.341049     -4.138122
     19         O     -4.508503      8.599689     -1.491327
     20         O     -3.263725     -1.302800      0.208884
     21         O     -2.163479      1.242183     -1.735438
     22         O     -3.492911      6.254004      2.938718
     23         O     -6.804546      1.289841     -1.604611
     24         O     -2.754553      2.647557      4.129391
     25         O      0.089581      2.389599     -6.488722
     26         O     -4.663142      2.668907     -2.699779
     27         O     -4.848980      0.803323      4.948748
     28         O     -1.867554      9.044388     -0.230140
     29         O     -4.719693      4.562731      4.724046
     30         O     -0.218874      2.814332      3.142069
     31         O     -6.002333      6.780371      0.148658
     32         O     -7.105187      3.632756      0.030884
     33         O     -2.547492     -3.632382     -1.352805
     34         O      0.856973      4.245712      5.284610
     35         H     -3.089243      3.331307     -6.207035
     36         O     -4.868452     -2.662386     -2.841428
     37         O     -1.521722     11.494609     -1.948271
     38         O     -4.194941     10.991713     -2.679302
     39         O     -1.526689      0.346764     -4.688644
     40         O     -2.433114      3.935161     -1.392464
     41         O     -4.777220      4.698968     -4.619056
     42         O     -3.575990      6.422702     -2.780165
     43         O     -1.784395      4.917511      4.033228
     44         O     -2.095368      8.955562     -2.891247
     45         O     -1.661932      3.461638      6.407714
     46         O     -2.174920      7.642687      4.938234
     47         O     -0.952268      6.272218      1.635287
     48         O     -4.944240      4.746348      1.799489
     49         O      0.039988      7.006572     -4.079522
     50         O     -1.110675      7.039190     -1.590486
     51         O     -2.507263      7.781661     -5.028497
     52         O     -1.952498      5.218165     -3.971527
     53         O      0.164692      5.200377     -5.816312
     54         O     -0.000161      3.191927     -3.838588
     55         O     -2.653587      2.857478     -4.088818
     56         O     -2.459065      3.807776      1.407201
     57         O     -3.359541     10.888225      2.733713
     58        Mo     -3.691825      4.237013      3.387538
     59         H     -2.077157      2.223099     -1.613095
     60        Mo     -2.168041      9.958773      1.496335
     61        Mo     -4.844712     -1.804227      1.330427
     62        Mo     -4.990988      6.920699      1.847333
     63        Mo     -6.290358      3.015067      1.634839
     64        Mo     -3.536859      0.808152      3.799943
     65        Mo     -0.421137      3.142083      4.879122
     66         O      1.206011      0.509212      8.222959
     67         O     -4.693495      2.574216      2.707486
     68         O     -2.326884     -0.161429      4.581754
     69        Mo     -1.290448      6.698249      3.483714
     70        Mo     -1.683501      7.120014     -3.381075
     71         O     -6.942399      1.410137      1.771664
     72        Mo     -0.707117      3.727232     -5.342529
     73         O      0.199452      1.468762      5.530549
     74         O     -1.602492      0.210489      7.763459
     75        Mo     -2.745739      0.941215     -3.594004
     76         O     -0.830733     11.044982      1.574806
     77         O     -6.659298     -1.348290      1.797830
     78        Mo     -6.169700      2.889115     -1.603925
     79        Mo     -5.159187      6.954673     -1.558003
     80        Mo     -3.447913      4.306517      0.035522
     81        Mo     -3.517465     -2.195134     -1.495274
     82        Mo     -2.733723     10.315721     -1.596584
     83        Mo     -3.705288      4.434104     -3.305281
     84         H     -7.095739      4.954074      2.970125
     85         H     -2.202092      1.092008      1.135334
     86         H     -1.276294      1.774275      2.249558
     87         H     -1.726677      6.426641      1.037079
     88         O      0.278979     -1.481900      6.374090
     89         H      0.680826      1.793897     -5.983053
     90         H     -7.201248      4.828166     -2.778973
     91         H     -4.273934     10.540806      2.648046
     92         H     -6.854842     -0.373377      1.781129
     93         O     -1.831224      0.967760      2.031365
     94         H     -3.059789      7.990756      4.702469
     95         H     -5.719101     -2.826818     -2.381084
     96         H     -4.968124     10.386765     -2.633920
     97        Mo     -0.015223      0.159304      6.982457
     98         O     -4.451458     -3.208549      2.261762
     99         H     -1.401744      7.789789     -0.935024
    100         H      0.196063      6.306946     -4.842077
end

charge -5

