100
Coordinates from ORCA-job orca
  N   -2.72549721007099      2.61937668884643      4.15009559569854
  Mo  -3.91298063829110      3.73003648239706      5.31539344019522
  N   -4.82227086628741      2.66688298666323      6.71151884162562
  C   -4.07792907793430      2.25017497100961      7.90016714700798
  C   -2.60763095604221      2.08268014965238      7.54780272424191
  N   -2.15889909718292      3.24240764960447      6.74241147830733
  C   -1.01062465984553      2.93067818888218      5.86334901637515
  C   -1.48034990258467      2.08527960393129      4.69191873353541
  C   -1.91602907476101      4.44814019757809      7.56886174868964
  C   -2.14726732590766      5.68850207131737      6.72139978300470
  N   -3.38825916276167      5.52669286938325      5.96683391639290
  H   -0.69475469124427      2.08495544806224      3.91278980734824
  H   -1.59428230528541      1.02885926437012      5.00752986087390
  H   -0.62161475744099      3.88776962287088      5.48911091363575
  H   -0.20285230889349      2.42937090228190      6.42641530451684
  H   -2.21584083486885      6.56871500137164      7.38573917268561
  H   -1.28468035792342      5.87381427303722      6.05248448377154
  H   -2.64334937483486      4.43874967186628      8.39199852846687
  H   -0.90188631064682      4.42530729163145      8.00593876016184
  H   -4.46254625684117      1.28651365664054      8.28103733435567
  H   -4.20037498492383      2.98018153730076      8.72567073650332
  H   -2.48964427904734      1.18529994714877      6.92534480798628
  H   -1.98228351165413      1.96133597324711      8.44964154489599
  C   -3.09196397366947      1.99879848777535      2.87962258564164
  C   -3.59525321265564      0.54870555627658      2.99175032160038
  C   -5.07238553721219      0.42405320126082      3.43435394964027
  C   -6.01821967463077      0.59100352864518      2.28219155311641
  N   -6.64649157792580      1.75653511963770      2.13625593435403
  C   -7.45120865269319      1.94019573037886      1.05048873505313
  N   -7.69191936912852      1.07594419024030      0.09480932702894
  C   -7.08248541476818     -0.14432011870499      0.21588084139338
  C   -7.31413420590257     -1.12532350332458     -0.77675036696725
  C   -6.71415828865240     -2.36367429735923     -0.67542528382758
  C   -5.86766378305840     -2.66791585353594      0.41641243064396
  C   -5.62298502003527     -1.72876443702430      1.39725049827687
  C   -6.22102131443121     -0.44551719937526      1.31961967953186
  C   -4.04687290784813      6.79180281948830      5.63845880490408
  C   -3.25427342494647      7.67960199128682      4.66401818393338
  C   -2.91072007352651      6.99151964167141      3.34409735367099
  C   -4.08539931290814      6.66283440494965      2.46141874671846
  N   -5.24111010381882      7.27119576441171      2.69790675778974
  C   -6.31495012668774      6.88583908508351      1.96104158479128
  N   -6.36936361448098      5.92801712443570      1.05290303234007
  C   -5.17194898950649      5.33741361973839      0.73511691764988
  C   -5.13750945436937      4.34368568447765     -0.27188291032028
  C   -3.93555909583640      3.76411313225229     -0.62847357984002
  C   -2.73364424698782      4.15278900608892      0.00494341006939
  C   -2.74546300745727      5.10362516002715      1.00724196169845
  C   -3.96287693276303      5.70880712839074      1.39981205549832
  C   -6.27176018032840      2.55513340842796      6.85805220437063
  C   -6.92238530811372      3.84356232726516      7.38164504738899
  C   -8.40641019911631      3.69729134866528      7.70568796485047
  C   -9.34722490127278      3.53182869539995      6.54093910061095
  N   -8.89185973860816      3.71502234242772      5.30436933507207
  C   -9.77583965798394      3.58820270625193      4.27221966981524
  N   -11.05317335289640      3.30057851091938      4.34312110975335
  C   -11.55621827406630      3.10552028181247      5.60136993748879
  C   -12.92875151483477      2.79651119603606      5.75043002609749
  C   -13.45878921405054      2.60591657052485      7.00994898861466
  C   -12.64170652114685      2.71539950849566      8.15923844796952
  C   -11.29873713633056      3.01184701310467      8.04076210126527
  C   -10.72448645326326      3.21239158614878      6.76040481633304
  H   -2.20310659866449      2.00207844680338      2.22037390640356
  H   -3.85220238741827      2.62530181621665      2.39304686462818
  H   -2.96511539995392     -0.00461126950124      3.70386865296159
  H   -3.46190543339051      0.05293172489981      2.01779341759336
  H   -5.23499932537989     -0.56108326100786      3.89526536484081
  H   -5.28978818386423      1.17837095260717      4.20513080664497
  H   -7.93090012132218      2.92189401167885      0.98043364517862
  H   -7.97490107286741     -0.87079191104656     -1.60609289070199
  H   -6.89495981742213     -3.11999851090072     -1.44073350596624
  H   -5.40740856219285     -3.65468292557366      0.48141869990258
  H   -4.96946455624646     -1.97619613248248      2.23381509910263
  H   -5.02768233371089      6.56775847205629      5.20583834986668
  H   -4.21655250829372      7.36366018591028      6.57115652342596
  H   -2.31650038810428      8.00978104754456      5.13694030177553
  H   -3.85184819165853      8.58288309002046      4.47365691766006
  H   -2.21525181346371      7.62475266170085      2.76496554591107
  H   -2.36109908728293      6.05715739676106      3.54527849365328
  H   -7.24947436277364      7.41524517050371      2.17587779279549
  H   -6.07193950201491      4.07243740631892     -0.76495548197044
  H   -3.90957470995206      3.00740292509991     -1.41441001180403
  H   -1.79190820596619      3.69338534152812     -0.29911282280562
  H   -1.81439057644048      5.39177858129075      1.49558340466962
  H   -6.50662814226950      1.72648719893842      7.55285169657714
  H   -6.71879027612956      2.27712987508762      5.89107836758941
  H   -6.39970836371897      4.14882537145180      8.30112725044617
  H   -6.76329373913232      4.65371413324267      6.65259097729245
  H   -8.55129667328180      2.84610154317137      8.39205047786180
  H   -8.74772731536273      4.58087115845996      8.27317898315770
  H   -9.35991614974739      3.74648767651015      3.27096343945660
  H   -13.53914965352057      2.71986178429435      4.84994751127090
  H   -14.51774837367785      2.36969911017929      7.12497476791274
  H   -13.07974115921201      2.56390285014772      9.14669700215815
  H   -10.68204617036944      3.09516072525229      8.93559142361831
  N   -5.19202311521782      4.18360524093917      4.10437357421016
  N   -6.54012361584724      3.97219971677050      3.69817183382153
  H   -7.25111641151815      3.91338067160653      4.48870503940852
  H   -6.58687418848124      3.03729594793575      3.10988721359252
  H   -6.83111480093967      4.73463386381538      3.06502441356137
