85
Coordinates from ORCA-job orca
  N   -3.82664246291481     -3.26294203192698      2.35830821088482
  C   -3.78994434585471     -3.99551260652824      1.07759781206126
  C   -3.07044795288671     -5.32076162358268      1.24218206919814
  N   -3.64981456323376     -6.04215304886127      2.39876481303248
  C   -4.86385103731373     -6.81854700974247      2.04729609581387
  C   -5.76597019321872     -6.80669273178773      3.27263924394134
  N   -5.98797576206758     -5.40672973424155      3.63912367619545
  Mo  -4.24688753447933     -4.43636125947008      3.91064991783453
  N   -2.57239131732033     -5.17008897957042      4.79380689125066
  C   -1.76960958173432     -6.06758318784560      3.94865028893195
  C   -2.66145210118059     -6.91129789964521      3.07225388582271
  H   -1.15419332181802     -6.75432481677691      4.55383234676269
  H   -1.05534474508698     -5.49809458173174      3.32203811945809
  H   -3.21736222972029     -7.62335181617417      3.69717501998223
  H   -2.07895397399707     -7.48841489017021      2.33052288205143
  H   -6.70077419707265     -7.34505435040398      3.05903803325957
  H   -5.28887260532184     -7.36362915038263      4.09943175635413
  H   -5.37815614241109     -6.30847548684410      1.22205334687608
  H   -4.58528667669799     -7.83551770304933      1.71569090849813
  H   -3.27130640512253     -3.42960041507518      0.28825952763566
  H   -4.81760732096130     -4.16974080250054      0.70385222753804
  H   -2.01138781495465     -5.12698099724610      1.46211986236690
  H   -3.12818524068722     -5.94026162066020      0.32887677288235
  C   -1.43739440298942      0.47722597375784      0.77679764851138
  C   -1.35785002492470     -0.34517305857729      1.83452662699266
  C   -0.59675771141853      0.04152043303634      3.07361376833554
  C   -1.98058784145963     -1.72230294696312      1.82822920215227
  C   -3.50044050226124     -1.81899420187699      2.21182263099949
  C   -4.38781048071655     -1.16093739578842      1.14042003284210
  C   -3.73881591093029     -1.07542390363500      3.52043209305894
  C   -6.86206820554783     -6.02122988584420      6.69502801325178
  C   -7.84464290911079     -5.33457033992283      6.09387396155739
  C   -8.58839731647944     -4.24078117233001      6.80973205461118
  C   -8.25248185283357     -5.63786242692130      4.67230597681315
  C   -7.39490434995361     -4.95640780525508      3.55154758007903
  C   -8.01148963085368     -5.33635662866232      2.18552554825697
  C   -7.49078376704726     -3.43096957928402      3.64373041148847
  C   -3.07353924470378     -6.29941219386004      8.85077832925612
  C   -2.69037977980849     -6.59153089372314      7.59836084438333
  C   -3.42429809453742     -7.61000021649043      6.77365072008988
  C   -1.49490592768714     -5.92667266029187      6.96591578453235
  C   -1.77993427008183     -4.73390780084329      5.98298618145709
  C   -0.41343052026336     -4.16420422650562      5.54246542151573
  C   -2.48806661737431     -3.64487596290680      6.77907491770030
  H   -0.98771077966990      1.47228699909179      0.79484796208493
  H   -1.95155353828101      0.18165780634121     -0.14004603213753
  H   -1.21957083701202     -0.04939677598481      3.97606904738704
  H   -0.21292244025836      1.06869407795303      3.01266645487694
  H   0.25775370198547     -0.64061749161626      3.21976348839079
  H   -1.44646502414683     -2.36698996258980      2.54443990615046
  H   -1.84401433735292     -2.16526833886186      0.83032445145324
  H   -4.16587353982480     -0.08737389729548      1.07240018457157
  H   -5.44552019528689     -1.27946523544695      1.41773594332952
  H   -4.24093418940297     -1.59428021515289      0.14186051347632
  H   -4.79382354371979     -1.12600040452324      3.81140569043955
  H   -3.13686699815680     -1.49365550016711      4.33815470898075
  H   -3.46915704387936     -0.01822428513579      3.39078278479235
  H   -6.33733572262397     -6.83107771661985      6.18664085517772
  H   -6.53983290374794     -5.78586124987821      7.71158605806734
  H   -9.66456204325708     -4.47656093268366      6.86378438010842
  H   -8.50653146000048     -3.27833215488075      6.28184781274400
  H   -8.21055484336419     -4.10149373613428      7.83116665609899
  H   -8.20701129350558     -6.72521168904796      4.50266173262512
  H   -9.30130269170630     -5.33857468633078      4.51204831436889
  H   -8.05321808940333     -6.41979332272797      2.01155850630822
  H   -7.43266098775188     -4.87327659289277      1.37288311691300
  H   -9.04225705467153     -4.95810198141169      2.13033569184067
  H   -8.52822665897574     -3.12012842439173      3.45375517291493
  H   -7.19580634408737     -3.04556852433815      4.62067092001769
  H   -6.84556407278626     -2.96644331609786      2.88319976083121
  H   -3.93962595849914     -6.78339880902541      9.30762724731351
  H   -2.53681250070514     -5.56507878865965      9.45498616446082
  H   -3.83532120915360     -7.13302513917703      5.87110113969175
  H   -2.73816554647167     -8.40285262463898      6.43104996611017
  H   -4.24451763212116     -8.07453356975360      7.33655796691109
  H   -0.85316488189449     -5.51309896814964      7.75862211298879
  H   -0.88939200535592     -6.68728291503189      6.44600312957665
  H   0.23938600966544     -4.92697702245255      5.09680215359082
  H   0.11327973127651     -3.74198756190717      6.41005945689137
  H   -0.56473575287368     -3.36061544223257      4.80586258653368
  H   -3.47101986901426     -3.97013678869891      7.13355486864929
  H   -1.87764726715557     -3.39220136549957      7.65828705494022
  H   -2.60789875378185     -2.73401551903792      6.18031038646015
  N   -4.89754069154781     -3.17758892459177      5.24129200097743
  N   -5.35204685444020     -2.48807637321392      6.03874822657382
