97
Coordinates from ORCA-job orca
  N   -2.25347297228141      3.19594770212672      5.81969511192679
  Mo  -2.45059666628965      1.21248798634639      5.51486049019261
  N   -2.94949966460595      0.22351862139249      7.13488347116734
  C   -2.04128997326021      0.01271544570694      8.25455881990442
  C   -1.05798321856800      1.16148159287994      8.33253124546176
  N   -0.56031086183364      1.48651568246398      6.97734508356470
  C   -0.07867205238353      2.89170379015986      6.87280785078232
  C   -0.86205470158559      3.59951383338412      5.75703643730256
  C   0.43815163858053      0.51389316471335      6.48484095006400
  C   0.44650587056507      0.58099103856152      4.97055374397904
  N   -0.93156428923271      0.46654534414778      4.48974362590192
  H   -0.44763671280613      3.32280272302610      4.77552167855525
  H   -0.74197381206470      4.69411857719146      5.83683685913353
  H   1.00642846202890      2.91321200870639      6.68696117780657
  H   -0.25664266410123      3.39189626291844      7.83461652217536
  H   1.06556211511360     -0.24002748810179      4.57559356724939
  H   0.91409843288379      1.52462638310976      4.62729825862556
  H   0.11805767353931     -0.49097102745829      6.79424623911144
  H   1.43305531429751      0.71599236159217      6.92156865549415
  H   -2.59357809960754     -0.03801604952868      9.20984300522381
  H   -1.52279417206331     -0.96141660983620      8.14776562246480
  H   -1.58736656515536      2.05015629684181      8.70039084891079
  H   -0.22396052128020      0.94119175860351      9.02338625227190
  C   -3.09288716643889      3.91925592115299      6.75316749824128
  C   -3.34742668279524      5.38074196053852      6.40113091904961
  O   -4.16868642489979      5.47043169731970      5.21242721124490
  C   -3.56510410640089      5.78728093730535      4.05645922105918
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  C   -4.56927533292137      5.73517867462276      2.92975051723846
  N   -5.42107725462646      4.72152319120073      2.95932388924601
  C   -6.34731615503284      4.66745350221006      1.96681624478820
  N   -6.51350165411921      5.53167698014502      0.98428055158074
  C   -5.63556518395866      6.57564731055603      0.93510675605201
  C   -5.76139267879457      7.53197314729786     -0.10268963155504
  C   -4.88447455637079      8.59328019724791     -0.17211516849928
  C   -3.85501737770036      8.74384616804346      0.78846059321173
  C   -3.70637755456682      7.83189042213620      1.81222727037329
  C   -4.59157904281518      6.72729085125988      1.90695623570157
  C   -1.11891743678248     -0.46056166745679      3.37157042621071
  C   -2.02834073135598      0.08205828920927      2.23201607228360
  O   -2.94978048526918      1.08766751010810      2.61898656142420
  C   -3.99147216954722      0.66939307931456      3.61651637546304
  O   -3.46175400642047     -0.27913621540281      4.44198113039849
  C   -5.25795346744568      0.20218238032313      2.87730582196201
  N   -5.90276759311286     -0.79080068589280      3.47445973378511
  C   -7.07085068935040     -1.20859189713071      2.92593430189109
  N   -7.66450843583432     -0.74253061593468      1.84421099442907
  C   -7.01104351831726      0.26941847354774      1.19656150240198
  C   -7.59292722293127      0.79862970382316      0.01787798115295
  C   -6.96148505649162      1.80909856176898     -0.67530231767956
  C   -5.73130593154138      2.32826606027965     -0.21271085561603
  C   -5.14767125128558      1.84341170858470      0.93988176726277
  C   -5.76728369365885      0.79900215939493      1.67675475150582
  C   -4.19752896893907     -0.52725573601125      7.25370348814988
  C   -5.21248473959986      0.17119865108096      8.15113585732229
  O   -5.61626541928421      1.44870534291456      7.59412284149407
  C   -6.68384482823887      1.41633897798227      6.77160008057857
  O   -7.31925726906043      0.41002810203497      6.50880332607722
  C   -7.05433854190665      2.79550989118222      6.27408741078353
  N   -6.62465349720707      3.82167971662603      6.99647922642052
  C   -7.04781073978831      5.05722825445153      6.62969003843451
  N   -7.87853290277804      5.36391063244738      5.65365496916915
  C   -8.32037503295297      4.32334824511958      4.88888939516698
  C   -9.20798548858338      4.59652704309029      3.81881542659054
  C   -9.64766688075716      3.57197101386741      3.00867731058925
  C   -9.20747350965237      2.24510356950979      3.22801924123221
  C   -8.35407496859715      1.94527461424202      4.26983195408961
  C   -7.90469846477069      2.97204031539048      5.13902398874364
  H   -2.66092678757803      3.92875334222750      7.78048861646822
  H   -4.06326805983072      3.40998890998107      6.83579561937948
  H   -2.42148891184152      5.94890839732219      6.24154048927365
  H   -3.93750410882206      5.85324113394252      7.19804605294648
  H   -7.02669354913521      3.81439124973017      2.00391339960105
  H   -6.56380068393517      7.39662219233921     -0.82898980711910
  H   -4.98195810109480      9.32818689571767     -0.97312154009878
  H   -3.17293904939347      9.59232634874447      0.71549938322770
  H   -2.90843795229417      7.94072796313181      2.54512572957417
  H   -1.54246238606535     -1.40597107878371      3.74347225018325
  H   -0.13302835050882     -0.68488950352782      2.92975101158403
  H   -2.53808899371860     -0.77692089546136      1.75734023008528
  H   -1.40719929404266      0.57347105138167      1.46793013606272
  H   -7.57447248742441     -2.02455426780136      3.45466469645889
  H   -8.54178943049221      0.37509176889293     -0.31478879329095
  H   -7.41131107329573      2.21359546492459     -1.58380499911756
  H   -5.24755843636576      3.13550954333430     -0.76461381307721
  H   -4.20220087324147      2.24764986108144      1.29266496543447
  H   -4.62180566512344     -0.67375323325358      6.25186607715900
  H   -4.00290971732450     -1.52871797697675      7.68487039166188
  H   -6.09809704715515     -0.46497014985215      8.28344261315344
  H   -4.78816517035681      0.42631193454989      9.13168893672128
  H   -6.66383356476301      5.88568306848020      7.23302648510034
  H   -9.50718945781507      5.63260264756200      3.65642499040606
  H   -10.32355799009528      3.78462545524324      2.17863504941643
  H   -9.54145759306839      1.44721587463421      2.56349956160384
  H   -8.02718292191289      0.92367303955597      4.44253615769780
  N   -4.16578306397988      1.79062997191039      4.49652393257625
  H   -4.20878640799005      2.69981156017244      4.02322581908933
