110
Coordinates from ORCA-job /scratch/magstr/orcajob__5661756-mVJc/orca
  N   -3.30783754990457     -3.79991693457743      2.32720475159403
  C   -3.23675526691034     -4.85585939179888      1.30997729939580
  C   -2.81339920434291     -6.17409294714119      1.93285719992930
  N   -3.69954964300086     -6.46106995902709      3.08171518408139
  C   -4.96902757138312     -7.10501610832312      2.67226449161158
  C   -6.06797599176210     -6.64031733403256      3.61442752431428
  N   -6.07213507601757     -5.17482106498252      3.62555969814656
  Mo  -4.25802501190995     -4.41147739110349      4.00355495067661
  N   -3.20030020116064     -5.25966876405537      5.53434954749450
  C   -2.23940025559413     -6.23677619471798      5.01558715762063
  C   -2.99303092271462     -7.22098598348522      4.13694303248507
  H   -1.73519696886278     -6.80464783372221      5.80884838375631
  H   -1.42676787539365     -5.76196768535942      4.42770467032635
  H   -3.74548103701377     -7.73342142320379      4.75333586438130
  H   -2.33194511494607     -7.98328692534488      3.68398412026490
  H   -7.02895324218879     -7.06015241176776      3.28828621207494
  H   -5.88591990201663     -7.06230913972522      4.62298392565496
  H   -5.20870456312931     -6.76592261127370      1.65475900315028
  H   -4.85928938149265     -8.20509200811356      2.65814888151748
  H   -2.53390121142239     -4.62470787209090      0.49952937388790
  H   -4.22295098528486     -4.98567717643576      0.82300174029664
  H   -1.78671061344505     -6.07694409044939      2.31375064555888
  H   -2.83605031979977     -7.00891013458804      1.20654196128128
  C   1.54323771442440     -1.91926320850748      1.86209014819531
  N   0.48606536823754     -1.09009493652100      2.42999999320243
  C   -0.24013122020803     -1.74325653428566      3.52208202371231
  C   -1.16357971118176     -2.89402391095284      3.10722807020441
  C   -2.38205743331098     -2.62155617183039      2.17812290328547
  C   -1.89667332589011     -2.39602259096024      0.72656458878132
  C   -3.01803673663299     -2.03965871667249     -0.25308480792108
  C   -3.77942949027997     -0.79602658778188      0.21342026958039
  C   -4.26006913244974     -0.97646466471641      1.65350309041876
  C   -3.10356473509584     -1.32309115995117      2.59028283790265
  C   -10.20263419452625     -6.17428427102439      5.91371079156075
  N   -8.79873372470374     -6.50636807631666      5.69612001497099
  C   -7.88338291263204     -5.40862207850315      6.02571370498032
  C   -7.89518272267778     -4.23024062652597      5.05578028308824
  C   -7.38776776111767     -4.47266114859609      3.60838976862774
  C   -8.45761159655462     -5.22784318010696      2.78726957588880
  C   -8.08141570830001     -5.45137469863139      1.31397453327060
  C   -7.33749545054086     -4.24285568658204      0.71222352307693
  C   -7.69255768500330     -2.97515778221475      1.48503832574577
  C   -7.20628402746678     -3.07356143223316      2.93642264002430
  C   -3.45217015075251     -0.54683835233951      8.89938892801051
  N   -3.31849901216821     -1.53501083351623      7.83652169991858
  C   -2.26843735667521     -2.51968455458113      8.10285311130048
  C   -2.16153858492171     -3.53072286649843      6.95640643687527
  C   -3.05263181407363     -4.81804443742664      6.95750435318697
  C   -2.36692989532259     -5.91723041747126      7.82698975569397
  C   -2.73651749821068     -5.85307379429179      9.31132031525142
  C   -4.23142276106666     -6.17956943023378      9.50568677655868
  C   -5.02878828799266     -5.83632092887899      8.23762689236444
  C   -4.47023937830327     -4.58780932321577      7.55710204108741
  H   2.22837087618807     -2.34971666003134      2.62440854091151
  H   2.13864692731377     -1.32442329209037      1.15581915761571
  H   1.10392829899973     -2.75752002754270      1.30164198031683
  H   0.89724063137166     -0.22618933846681      2.78581387336881
  H   0.46184104881065     -2.15596820762474      4.28315714638828
  H   -0.83605885184736     -0.97213212808945      4.03282533825159
  H   -0.57284163332831     -3.71302989133533      2.66055580442482
  H   -1.57262092992668     -3.29884092455565      4.04636286333304
  H   -1.30968063974514     -3.25521001876750      0.36410427265517
  H   -1.18172745384366     -1.55997706360737      0.78372066731687
  H   -2.59372439933208     -1.87633235595488     -1.25714993012745
  H   -3.72632686560914     -2.87980042012082     -0.34290882143440
  H   -4.63033637756399     -0.59416494644205     -0.45731284154643
  H   -3.11129221963337      0.08202085885945      0.15560448561824
  H   -4.77443165009181     -0.06886301215055      2.00897403498828
  H   -4.99611461181005     -1.79453646250025      1.68047786101710
  H   -3.45747952475172     -1.42308436314248      3.62623579245948
  H   -2.36651970919531     -0.50417268872734      2.55779698808888
  H   -10.40684083078567     -5.73785701431647      6.91570028822856
  H   -10.53941222244461     -5.44558639589010      5.16172394265214
  H   -10.81756933020147     -7.07761146420167      5.79729668141360
  H   -8.55645685602131     -7.30795256602818      6.28054057890433
  H   -8.09268173710215     -5.00325328963993      7.04206211103727
  H   -6.86483181507168     -5.81908290791268      6.05813353984079
  H   -7.23289668397752     -3.46572498041914      5.49415025841971
  H   -8.90199452645903     -3.78057396606580      5.00648433513062
  H   -8.73087035669164     -6.16885338595414      3.28200304350612
  H   -9.36354539776876     -4.60133757143898      2.83594648184295
  H   -9.00711797113642     -5.64203236314174      0.74701686066899
  H   -7.46851609871390     -6.35933563692460      1.20564349354896
  H   -7.57356982386702     -4.13514787904525     -0.35750362065349
  H   -6.24910225111282     -4.39918107433319      0.78330519800664
  H   -8.78507159227356     -2.82242856311828      1.45326698429530
  H   -7.24515696118333     -2.08732580735195      1.01060350595508
  H   -6.13426609950015     -2.83202788576412      2.95716387080211
  H   -7.70889158401014     -2.30713928571012      3.54730443636585
  H   -3.82179081593565     -1.03918182112500      9.81250286633277
  H   -4.18638547256249      0.21663361864665      8.60720319333400
  H   -2.49998579509242     -0.03629563017378      9.15902443011959
  H   -3.10259007851911     -1.06346093408964      6.95425029903500
  H   -2.51194204912019     -3.01089347353772      9.05789142292335
  H   -1.28105223512308     -2.03025548550063      8.25782436231175
  H   -2.38289487165484     -2.98480832339399      6.02720840994171
  H   -1.11479374681677     -3.86392958004226      6.86550165391437
  H   -1.27436028364196     -5.86954288011299      7.70211703124638
  H   -2.68392209254376     -6.90900905819674      7.46580741421062
  H   -2.11101916476634     -6.56249616031574      9.87461682374810
  H   -2.50459541911034     -4.85937205120774      9.72005993588655
  H   -4.35821804750765     -7.24605581251352      9.75171957425091
  H   -4.62972177437022     -5.61250547268394     10.36194354929749
  H   -6.09123354790222     -5.68929818798638      8.48272320608165
  H   -4.99404428045010     -6.67759604733504      7.52380966664984
  H   -4.44064175728079     -3.76312524339365      8.28537240743345
  H   -5.14464476634259     -4.26271829607179      6.75649209118345
  N   -4.70164657635000     -2.69172134991421      5.01676812372450
  H   -5.33141414300048     -1.96932709006559      4.66528640001125
  H   -4.52738372449728     -2.50712395475099      6.00593872640466
