73
Coordinates from ORCA-job orca
  N   -1.92936324258879      1.09297836080232      5.83886946518319
  Mo  -2.93434486326268      2.55879091043074      4.77097204158691
  N   -4.67152144089283      2.42952573059589      6.02202875840653
  C   -4.58612321106982      3.16094688582622      7.28880279687833
  C   -3.16459135902457      3.06673691543799      7.80286531252365
  N   -2.18636932906986      3.48380727533220      6.74565847184328
  C   -0.84518402100159      2.86912057876738      6.98449037133047
  C   -0.92554948330376      1.33569325994869      6.84422039027564
  C   -2.12805625009299      4.98218034244616      6.62995934968496
  C   -2.40767179574292      5.41256564082151      5.18989630500275
  N   -3.52591701966498      4.61836126800118      4.68502653523558
  H   0.06045305563454      0.94168896004085      6.54943789017313
  H   -1.20346595623673      0.85432304680279      7.79536020341898
  H   -0.16888952010574      3.27754706569860      6.22165136869470
  H   -0.46390274150115      3.15599276308246      7.97826823194171
  H   -2.64707160407526      6.48592606166118      5.15941515614068
  H   -1.52803915155606      5.22371089029353      4.55445308763104
  H   -2.90788867841167      5.39785285613000      7.28089552048148
  H   -1.15275508437302      5.34322739655971      6.98779796128816
  H   -5.27756201022750      2.73116708129670      8.02950488053035
  H   -4.89873806691747      4.21130981176497      7.14928598294314
  H   -2.95213564511240      2.02489074466566      8.06975891614674
  H   -3.01303903562427      3.68850723808485      8.69997985067192
  C   -2.46037345912451      0.03374408714917      5.27288655282705
  N   -3.39954655316128      0.44491375793807      4.40216321102855
  C   -4.12546366684703     -0.33323545209146      3.51105188257814
  O   -4.62182994357515      0.15966639864312      2.50450781998354
  C   -4.29907554981819     -1.78286906487374      3.85062588091995
  C   -4.23863341616499     -2.72929926774170      2.81900343976787
  C   -4.44235453968277     -4.07769801063138      3.10214649025498
  C   -4.73147594864416     -4.49585306033031      4.40461223713022
  C   -4.81182386807377     -3.53962474862174      5.41602320593073
  Br  -5.23541713917085     -4.08942076569002      7.19370228388833
  C   -4.59417149360923     -2.18752037206543      5.16064176672347
  C   -4.75628689121294      5.12698514521976      4.71945562847404
  N   -5.06701015407277      6.29541781315895      5.24488359869716
  C   -6.37298620143545      6.70864320946588      5.03155791572860
  O   -7.07932048032907      6.37952667788708      4.07082528303957
  C   -6.91388965042516      7.63006722182955      6.09038976269984
  C   -8.23847162430845      8.07707480954564      5.98855077753914
  C   -8.78029342177965      8.89748849015724      6.97565701581571
  C   -8.01173984850939      9.28720747749556      8.07725025685438
  C   -6.69443020591037      8.83767230940906      8.16230688327486
  Br  -5.62647951882157      9.36231452899102      9.66476414780076
  C   -6.13307925554679      8.01809100842332      7.18890185148116
  C   -5.90262134113219      2.09615416692669      5.60834140335592
  N   -6.99332189417089      2.44677456971703      6.24374427001938
  C   -8.18458205795381      1.88370656430202      5.81385400880628
  O   -8.29616507911818      0.74106798650920      5.35327199022783
  C   -9.38254580182086      2.77288390998544      5.99158291965774
  C   -9.26112014136287      4.10254014620723      6.41933994280555
  C   -10.39407012544673      4.90681228223767      6.53464778017557
  C   -11.65937562227808      4.39752658746727      6.23262596864958
  C   -11.76373385935837      3.07113849686678      5.80955135512151
  Br  -13.49396964240694      2.36562600399397      5.39151861929259
  C   -10.64804008824071      2.25361561892203      5.68112823254295
  H   -2.16313899175051     -1.01160584978031      5.44079313809161
  H   -4.03642370084834     -2.39319745671665      1.80178805488702
  H   -4.38497573313508     -4.81868121619507      2.30348451283356
  H   -4.90203783245406     -5.54875059963438      4.62755425567043
  H   -4.69889098242504     -1.45328208164568      5.95949649419032
  H   -5.54384067244419      4.48413489282397      4.30020743799884
  H   -8.82581944739285      7.76073047174999      5.12615969113528
  H   -9.81225453851828      9.24389262036727      6.89621882176520
  H   -8.42917207494439      9.92827990814862      8.85340698995425
  H   -5.10290983075753      7.67396290787160      7.26028370032941
  H   -5.95218931820770      1.53779759477403      4.66060000266832
  H   -8.27268771186871      4.49654482157151      6.65151903536194
  H   -10.29534947629998      5.94388983220986      6.85991458899450
  H   -12.54964762408378      5.01989033293081      6.32176138195344
  H   -10.72678180601381      1.22104025097329      5.34181397303039
  N   -2.00726861245791      2.74898017170823      3.29563889301873
  H   -1.79835770866175      2.93590078794749      2.31044279700895
