118
Coordinates from ORCA-job /scratch/magstr/orcajob__5655479-p4My/orca
  N   -3.33189179032140     -3.36978637561729      1.84522676161086
  C   -2.97131636824672     -4.24507029690248      0.72990042109905
  C   -2.77958978989225     -5.68757733421239      1.19441556127891
  N   -3.75929820405305     -6.01308213939021      2.25206039774578
  C   -5.13272487507625     -6.16547509897949      1.70553754114442
  C   -6.13805545216442     -5.86436635973505      2.80507296353008
  N   -5.72426640284743     -4.64868107532078      3.51501030970036
  Mo  -3.78836048800786     -4.29769525803338      3.58254319864938
  N   -3.03385202983452     -5.65379119764129      4.87741117269816
  C   -2.42493804427006     -6.77647323849380      4.16597252435013
  C   -3.35270572117786     -7.21050723223849      3.03073843484621
  H   -2.25640273028958     -7.64467359583250      4.82628533090130
  H   -1.43618237939288     -6.51576456966591      3.74872819244734
  H   -4.25851961458190     -7.64507363738801      3.47426151200539
  H   -2.88203645487604     -7.96669011390646      2.37797798442860
  H   -7.12898331003999     -5.75433173227984      2.33933377678083
  H   -6.20947659316114     -6.72255860030145      3.50459957604073
  H   -5.26230329681859     -5.42055052546903      0.91098453021946
  H   -5.27583127102420     -7.17150530110312      1.27462874732677
  H   -2.02197053752420     -3.92594794739030      0.26135697997374
  H   -3.73672212560942     -4.19827704868485     -0.07547815152175
  H   -1.77850157673215     -5.78670240434471      1.63522340413113
  H   -2.85901637674808     -6.39174651763991      0.34606350755991
  C   -4.19638236447397     -1.03011247584138      1.69604022254535
  C   -2.99382733680277     -1.97324292822676      1.56903214272816
  C   -1.83469211938136     -1.45759429137439      2.47433877071693
  C   -0.67808022491670     -2.41058206306709      2.50984180359248
  C   -0.75368959468372     -3.58787509802833      3.26720817900122
  C   0.32493707514551     -4.46985979221350      3.32575089483534
  C   1.47777382260233     -4.21601755804443      2.57465417264269
  S   2.77996797111773     -5.42426975730567      2.61994699174065
  C   4.25975930728168     -4.46118038367231      2.80916626818152
  C   5.44675006389538     -4.99879010801548      2.29334184872856
  C   6.65419686138006     -4.32506892884134      2.47838913884642
  C   6.68558415574433     -3.10897323021891      3.16371373906472
  C   5.50074882428351     -2.57778340677009      3.67961095856821
  C   4.29188866025418     -3.25147834360457      3.51626270002257
  C   1.54702938325339     -3.07161597846796      1.76848064586302
  C   0.48329384108382     -2.17350394322770      1.76183197463592
  C   -7.88441968378089     -4.73539189480566      4.78677029861550
  C   -6.80746760408876     -3.87546039816784      4.10676801356864
  C   -7.44472626199285     -2.84056169372933      3.11636180133362
  C   -8.01943679661879     -3.41559132036416      1.85495212866331
  C   -7.22384567513636     -3.52689007714456      0.70458617112058
  C   -7.71790974811483     -4.10580680269744     -0.46373105323567
  C   -9.03832206320250     -4.56589387177022     -0.50865698155136
  S   -9.66234887508200     -5.24111913337049     -2.03378219065445
  C   -10.39307479427104     -6.78245379725442     -1.52692600220473
  C   -11.47974024735221     -7.26024902003094     -2.27225053503019
  C   -12.05912811618518     -8.48771396631258     -1.95099964596569
  C   -11.56970369720659     -9.24073497945408     -0.88210122214165
  C   -10.48339555278311     -8.76412931207424     -0.14355073417764
  C   -9.88688347709529     -7.54575763436102     -0.46545920269455
  C   -9.86217043594488     -4.42081710708562      0.61569527892948
  C   -9.35065015847088     -3.85796662310238      1.78168743940187
  C   -4.69064595668082     -5.75252598977628      6.71430081512755
  C   -3.20731991974742     -5.83634534852664      6.31461164151105
  C   -2.39968969854436     -4.84535904334460      7.19531918912732
  C   -0.91035000750405     -4.83657607885463      6.96802064073688
  C   -0.15415753775741     -6.01104833428960      7.11021825264990
  C   1.22860080999843     -6.00894400268511      6.95953850633232
  C   1.90217456953855     -4.80600732921953      6.70790430028120
  S   3.66556610096530     -4.72631135830458      6.50166463542503
  C   4.30274637131427     -5.86064662829013      7.71173408474740
  C   3.75749610811362     -5.98546757350966      8.99733208468283
  C   4.34233861866007     -6.85747252971618      9.91409417428882
  C   5.48101260877436     -7.59132068721546      9.56897243564753
  C   6.03341137776694     -7.45014194410048      8.29471624699321
  C   5.44550039489181     -6.59343391879538      7.36337090372967
  C   1.16428098788589     -3.62917774950837      6.54400637933630
  C   -0.22682542868042     -3.65508264618997      6.65985233468879
  H   -4.67346904222064     -1.16233151730324      2.67537510367530
  H   -3.88115488264164      0.01814126539581      1.59509751965136
  H   -4.94051058564175     -1.24200114825826      0.91700027555324
  H   -2.62652396202430     -1.90517578490037      0.52912876267479
  H   -2.23307574592325     -1.32249381968941      3.48593218371932
  H   -1.50697682899402     -0.47817187402450      2.09806279103888
  H   -1.68411266845087     -3.79559451143722      3.83854438561807
  H   0.30384054096902     -5.34212786624168      3.98030141516179
  H   5.41748540575556     -5.94522265844493      1.75131116701491
  H   7.57388832169610     -4.75027121700764      2.07413329580892
  H   7.62904347792272     -2.57931212945623      3.29890275687278
  H   5.51727518035558     -1.63641739214957      4.23075736311098
  H   3.37538136969680     -2.84641060464189      3.94624776090492
  H   2.43404309273325     -2.88007971412311      1.16512250856056
  H   0.55172254798741     -1.26842811726043      1.15400643535484
  H   -8.54930055256020     -4.09287898172112      5.37930040422143
  H   -7.41942092137340     -5.46620642737745      5.46145564310795
  H   -8.49861385250025     -5.28194924956127      4.05855243089309
  H   -6.35565807449188     -3.24949552469514      4.89118593510769
  H   -6.65123840227545     -2.13118270297080      2.84887088056502
  H   -8.22406800595549     -2.29746771750183      3.67215248634224
  H   -6.18983330403756     -3.17941095021304      0.74591192192901
  H   -7.08601305815914     -4.20690276982970     -1.34743280554669
  H   -11.86782723118468     -6.66433296699244     -3.09953980639548
  H   -12.90610926123788     -8.85092010584196     -2.53460785154112
  H   -12.03126379888318    -10.19471328056368     -0.62566805352586
  H   -10.08787469281634     -9.34968936180552      0.68780773890438
  H   -9.03220261597289     -7.18452452913228      0.10626110932000
  H   -10.89917973339615     -4.75463539399124      0.57401513938759
  H   -10.00196170343711     -3.75087639733365      2.65122739218781
  H   -5.24796593043789     -6.59171957400666      6.27510138305363
  H   -5.12720823797829     -4.82131654888770      6.33115315528799
  H   -4.81117544934908     -5.78584934680365      7.80612519153330
  H   -2.85422289110058     -6.84903289095197      6.57997195339311
  H   -2.59030737487173     -5.14049057317427      8.24026853845787
  H   -2.79837318233090     -3.83132462426761      7.05984744923326
  H   -0.65763778366068     -6.95232981015365      7.34200467873219
  H   1.79070260028221     -6.93673942531039      7.05399703496693
  H   2.87789375160430     -5.40455083602847      9.27391165741410
  H   3.91043308776482     -6.95502888263263     10.91127471286560
  H   5.93604072909881     -8.26901923289915     10.29199156484391
  H   6.92211864958066     -8.01830317569310      8.01653379194371
  H   5.86500643745478     -6.48691344080693      6.36139473550199
  H   1.68493439055940     -2.69570550727464      6.32216156562300
  H   -0.78749033643859     -2.72674983372752      6.53526028620353
  N   -3.86499178221456     -2.69733802999905      4.82019976531648
  N   -3.90339079566303     -1.79843313676648      5.51890492800820
