99
Coordinates from ORCA-job orca
  N   -3.00944746505952      1.26781268428720      5.12233426288376
  Mo  -3.33622709450131      3.29141285381294      4.78715362959923
  N   -4.44076016244084      3.36280019883121      6.43533376068775
  C   -3.62033594495165      3.49303405908567      7.64334277068601
  C   -2.30371112383888      2.73069450160340      7.46336631449726
  N   -1.63334260658716      3.06844522056291      6.14573133100326
  C   -0.76885275508761      1.93913149649659      5.67991485890375
  C   -1.62511800571889      0.90059468578944      4.92255088054043
  C   -0.85318000504379      4.35734944142109      6.24246131235240
  C   -1.27595336351026      5.24492465713056      5.07833568162719
  N   -2.73636574901810      5.18669179087914      5.06617643314382
  H   -1.34797753795295      0.91570464879905      3.84840528322866
  H   -1.42911414255144     -0.11817188101364      5.30028830219028
  H   -0.01228224188982      2.36272498136608      5.00873896419729
  H   -0.25076755551422      1.51213563589567      6.55244945544090
  H   -0.90276470614517      6.27219830418704      5.22109307699733
  H   -0.87547123824703      4.85861572122190      4.12824368651612
  H   -1.12684110943024      4.84017651647981      7.19061188279177
  H   0.22426159889390      4.13779694131013      6.27340137011410
  H   -4.13788746644480      3.05848931440744      8.51606865163848
  H   -3.43328743290176      4.55538179185239      7.88767877808906
  H   -2.51487037392476      1.65724146807222      7.43474096459389
  H   -1.59395417176504      2.94040659153594      8.27958643335275
  C   -3.95998536501709      0.92462367984396      4.12037756252242
  C   -5.02389238410918     -0.10503754171730      4.51427470162130
  C   -6.23529243893194     -0.08406962545192      3.55932446768646
  C   -5.82300989996311     -0.09496361825956      2.11160583135144
  N   -5.75015259696628      1.08762571524786      1.50480711368893
  C   -5.30062312215309      1.10639623747888      0.22116706637106
  N   -4.90119498715257      0.08430878673328     -0.50761979661598
  C   -4.97816621849854     -1.14478201080587      0.08836368559309
  C   -4.57627942767025     -2.29088995848117     -0.63949622055013
  C   -4.64534228074825     -3.53855622559194     -0.05503513189471
  C   -5.11660137489675     -3.69049221475728      1.27082916170060
  C   -5.51451733528338     -2.59067755126782      2.00292498877960
  C   -5.45400014985225     -1.29458196697374      1.43098401190212
  C   -3.34782138486059      6.23370019402642      5.88532220842185
  C   -3.51742081549731      7.52871007501381      5.07217139838370
  C   -4.59938800141146      7.40957199366590      4.00311709443415
  C   -6.01163054642758      7.42455313711616      4.53861170261174
  N   -6.20080292256713      7.82975125634236      5.78812069482305
  C   -7.47326682826262      7.82241432308558      6.26735972363747
  N   -8.56714672725585      7.43850119870312      5.64146639744721
  C   -8.40410717734107      7.03113377423363      4.34498030746257
  C   -9.53797273256843      6.61164186120180      3.60733880439739
  C   -9.39777857104311      6.20488543150706      2.29718036518371
  C   -8.12631793740046      6.19988711310703      1.67739469920456
  C   -7.00408838404945      6.59410625243489      2.37685394460589
  C   -7.11524624416533      7.01544047568896      3.72546281713980
  C   -5.85761807846181      3.09037475311116      6.59553572890593
  C   -6.72982646587278      4.35244515464394      6.59349661473145
  C   -8.22248034784794      4.05043290340726      6.50372601970196
  C   -8.69846381832252      3.58968316480425      5.14710569319077
  N   -7.80859376626514      3.44164888419337      4.17351769897609
  C   -8.26647406638308      3.03892402783632      2.95442973067156
  N   -9.50801901893754      2.76677577777338      2.61299925259622
  C   -10.44889497374777      2.92018810839121      3.59506756926601
  C   -11.80862586511905      2.66680377277794      3.29282504898712
  C   -12.77445275120825      2.82851834601612      4.26518901108077
  C   -12.42047014362719      3.24472630386158      5.56988700529656
  C   -11.10123995911591      3.49532530371883      5.89107394697469
  C   -10.08814317038071      3.33862228260755      4.91320075666115
  H   -3.49624863383740      0.67003166001092      3.14816188257005
  H   -4.58537151840530      1.87197704111530      3.86713204764717
  H   -5.36179073305777      0.09738014012617      5.54030977322118
  H   -4.54219687019748     -1.09529614712374      4.51606143442321
  H   -6.89399324749967     -0.93296159019847      3.78894694322948
  H   -6.80540838115422      0.83927920949587      3.73132367934381
  H   -5.26601938401575      2.09460422719681     -0.24957617429898
  H   -4.22252101199523     -2.15285488438129     -1.66196246973177
  H   -4.33904070031624     -4.42104993735016     -0.61897564536439
  H   -5.16868079228149     -4.68681089128774      1.71202056678626
  H   -5.88265298928483     -2.71918528411007      3.02134837439042
  H   -4.33356912426387      5.89740969258968      6.22873738863883
  H   -2.74067988617308      6.45261897863791      6.78425888792749
  H   -2.56017362426192      7.79201088935177      4.59689564669052
  H   -3.77293229696362      8.33913061016336      5.76909604527944
  H   -4.50742304096017      8.23240525243422      3.27274504136455
  H   -4.44204921731278      6.48415140166434      3.42466885891798
  H   -7.58872888710880      8.16786538913812      7.29979992262906
  H   -10.50875111767396      6.62411900507326      4.10457551316077
  H   -10.27085063058552      5.87506139733341      1.73249459595912
  H   -8.03696899378217      5.87359271991562      0.64025088081890
  H   -6.02893344400562      6.58672180112574      1.88905582647089
  H   -6.02721384740007      2.51347917125989      7.52408887260879
  H   -6.18652137058104      2.45975598822878      5.75414953060271
  H   -6.52939985066014      4.94869378089374      7.49672505090870
  H   -6.43881798975098      4.96246484990853      5.72736924185826
  H   -8.51422721767161      3.29498154038553      7.25499948153495
  H   -8.79369236593835      4.95648645805023      6.76526924004548
  H   -7.49758429061187      2.91066544908650      2.18680949317495
  H   -12.05918683535609      2.34876484099400      2.27987526765922
  H   -13.82238203211377      2.63621605251410      4.02924315461593
  H   -13.19817747256192      3.37002865652075      6.32460370644699
  H   -10.83951970209469      3.82162256231484      6.89788299999940
  N   -2.56977625377741      3.22566470170091      3.11361715116347
  N   -2.30968369931257      3.12116142858577      1.85407672138232
  H   -2.28170277370688      2.20626873144786      1.39668558033935
  H   -2.35999484030989      3.94498990790539      1.25030672555909
