69
Coordinates from ORCA-job /scratch/magstr/orcajob__5670617-XbhJ/orca
  N   -3.28234517384303     -3.97732317550931      1.49992468979094
  C   -3.29224738490920     -4.88040414710188      0.36964007395829
  C   -2.77619616343441     -6.21182313148442      0.86958515595955
  N   -3.55979981358205     -6.61624508376059      2.05054395044770
  C   -4.87206199948856     -7.16691988921194      1.64634868326646
  C   -5.90389979814170     -7.00678482170669      2.74751511838810
  N   -5.96499535705194     -5.60286831797154      3.14249667683089
  Mo  -4.12029773405716     -4.72576743890204      3.56028007511664
  N   -2.68927376202096     -5.92702809887026      4.61612726554249
  C   -1.87321489035617     -6.89629551848444      3.83986001916828
  C   -2.80637239487995     -7.59645244067597      2.87153702415183
  H   -1.41555561233258     -7.63485535506661      4.51655956006788
  H   -1.07284254937591     -6.34769632982741      3.32341505971851
  H   -3.52745730455603     -8.18981537953500      3.44369207579611
  H   -2.23899711909947     -8.28239441764668      2.22094728777338
  H   -6.86911349063414     -7.35424829878418      2.35247062037617
  H   -5.64159969612085     -7.62144924834913      3.62727785987239
  H   -5.21398144617474     -6.60701961959941      0.76625287434983
  H   -4.77125289678749     -8.22799553926089      1.35573126513158
  H   -2.64039269810272     -4.52868243811744     -0.44701284698093
  H   -4.30882945483322     -4.99118226251244     -0.05888422770395
  H   -1.72949141151803     -6.09016546523726      1.18135321457190
  H   -2.81674853020112     -6.99274331808403      0.08903354151685
  C   -3.18709443511745     -2.65840597132117      1.22863386202654
  C   -3.50234866122540     -2.12869485320948     -0.06288059230709
  C   -3.46746005025595     -0.77671561542798     -0.32660742606407
  C   -3.08205502566718      0.11221502717367      0.68847335650640
  F   -3.09499680715863      1.44400495188555      0.42064222580778
  C   -2.71111958593422     -0.32686110447855      1.93369880053858
  C   -2.73360303674802     -1.70886024122163      2.23035660340211
  C   -2.21117151592317     -2.22044786278826      3.46366498946124
  O   -2.49861413260976     -3.38523718798757      3.90041264024990
  C   -1.18455679950512     -1.50907827178520      4.26473635750718
  F   -1.11155478270007     -2.04134785382619      5.51149292683036
  S   -0.13657041071264     -0.33991274646594      3.83933253790135
  C   -7.16669925267259     -5.12313557676254      3.58575286819055
  C   -8.19920888073785     -6.01578431101343      3.99336245168510
  C   -9.37956492906375     -5.56395414286308      4.54821203883894
  C   -9.58401748180411     -4.18577787833689      4.68806563686759
  F   -10.72856088370596     -3.75592645217753      5.27461753466613
  C   -8.65319252147604     -3.26980770873102      4.26616742289306
  C   -7.44081020631094     -3.70854244872201      3.68838415068235
  C   -6.50441249875508     -2.77996224551591      3.11943949000685
  O   -5.26203193364648     -3.07145836829338      2.97638541946329
  C   -6.90341755515319     -1.47708739748002      2.56635125275623
  F   -5.80676990277370     -0.71139735857587      2.31689266175269
  S   -8.37586699455219     -0.89803688458062      2.16542009384780
  C   -2.12866108274230     -5.32141470924104      5.78757646986042
  C   -0.75948731255753     -5.46369163231985      6.03510427388005
  C   -0.17517724836207     -4.95305299574286      7.18903013051526
  C   -0.99657931143276     -4.28842848635742      8.09230122545127
  F   -0.44753971091626     -3.76637340492327      9.21913340473356
  C   -2.34673351384798     -4.10945897126273      7.86724270239835
  C   -2.96375391608610     -4.60724940015046      6.69896437867660
  C   -4.35473641440125     -4.18415051732645      6.44959720948622
  O   -4.80606760173326     -3.88498064057024      5.26112707259991
  C   -5.30366944559923     -3.97348536840187      7.51868849557033
  F   -6.38871248941917     -3.25557487585570      7.08863228409291
  S   -5.32746956543393     -4.57833979612724      9.04561214615759
  H   -3.85513020024063     -2.80181805204084     -0.84195048312438
  H   -3.76534996594605     -0.38430958802573     -1.29995817093367
  H   -2.42293589796418      0.39579621583994      2.69299767082263
  H   -8.02744220208705     -7.08868869864999      3.95857354642008
  H   -10.13109336385079     -6.26361616462426      4.91525196543685
  H   -8.84427305949837     -2.20830074339996      4.39894113907407
  H   -0.12809300980798     -5.98924946054196      5.32198515885897
  H   0.89062965479122     -5.06497443493450      7.38518746672298
  H   -2.92788584437037     -3.53554952218893      8.58478791522692
  N   -4.04726453278255     -6.23610751494958      4.70110367745098
