79
Coordinates from ORCA-job /scratch/magstr/orcajob__5670615-dZeu/orca
  N   -3.26444725436155     -3.25214255209904      2.53102441806908
  C   -2.76479353654910     -3.94578774644767      1.32623674588609
  C   -2.38570845557944     -5.35527723999234      1.69981186302174
  N   -3.44200608721711     -5.90549410152882      2.58695089214226
  C   -4.67797564031989     -6.26568387352265      1.85225969310486
  C   -5.83837278429245     -6.32011282311356      2.82667260660027
  N   -5.90719533823903     -5.06671649430824      3.60080450298793
  Mo  -4.10313619155898     -4.19643430257378      4.05147478084024
  N   -3.18028064033749     -5.52761509934307      5.21288464748151
  C   -2.21885842957884     -6.46046913918198      4.59955644876755
  C   -2.90287599463508     -7.04227297493415      3.37993507978164
  H   -1.95979678954271     -7.26342553996658      5.30145191503880
  H   -1.28386222947610     -5.93973322214475      4.34157665376143
  H   -3.74047688789597     -7.66670450418655      3.71297391777193
  H   -2.23202236300903     -7.66004199420967      2.76221266508873
  H   -6.76725593255513     -6.45719439783469      2.25410948477911
  H   -5.74777226563835     -7.18370244397683      3.50813949413721
  H   -4.87208460110709     -5.47904194131869      1.11210297834877
  H   -4.55146550173635     -7.22075061099061      1.31754671565939
  H   -1.89208643216225     -3.40908020449043      0.92024967717747
  H   -3.54558481967819     -3.91379865715513      0.54671517724129
  H   -1.44739717879645     -5.34714139912455      2.27117634271589
  H   -2.24114840370508     -5.99523859345657      0.81446542859274
  C   -3.64692277172620     -1.90960667478818      2.21136649307472
  C   -2.68175156067676     -0.90280268315326      2.03799148391994
  C   -3.07257315625156      0.41538068008477      1.81331823070869
  C   -4.43015050183672      0.72032605122241      1.77715527139567
  F   -4.80454381782242      2.00783584547588      1.62935668237342
  C   -5.41824081692031     -0.26417970920517      1.89628869024406
  C   -6.87030310802320      0.01713177581384      1.97799668989881
  O   -7.73459302716908     -0.83109948358441      1.82521058281233
  C   -7.35465054327543      1.41730037231969      2.43489541685329
  O   -7.95251714586701      2.21126664046072      1.75944826528362
  C   -7.13147012835610      1.56409988570007      3.97088549093104
  O   -6.56499474936065      0.69461733632963      4.58059689352438
  Cl  -7.79924453887528      3.00780418504787      4.66909169025442
  C   -4.99979684497413     -1.58937473346609      2.08567840746730
  C   -7.20017514813373     -4.71659482631257      4.04393570201957
  C   -8.34396653631618     -5.54967590129265      4.04443845697217
  C   -9.58809733812019     -5.04879221147688      4.44267904885896
  C   -9.73780520050139     -3.72917570830986      4.86510954825154
  F   -10.94138651117064     -3.27571488140360      5.21721433921012
  C   -8.59540683495488     -2.91269345967575      4.97568969511231
  C   -8.43192685164307     -1.57673706421223      5.60573533203874
  O   -9.17245356650644     -0.69540979340766      5.91761433165908
  C   -5.69751507849411     -1.59755676685928      6.66083619010304
  O   -3.42723949278662     -3.16758273871702      7.55103062591602
  C   -5.81278344660211     -0.44204315642916      7.49198483062499
  O   -6.72676667862529      0.10232074152820      8.02818190506711
  Cl  -4.01632448466115      0.05387134745145      7.92713498009626
  C   -7.39876711189437     -3.43153532590797      4.52224318310126
  C   -3.50310549362513     -5.73748287690882      6.56861762014520
  C   -2.56415517534294     -6.26241576752424      7.46381102144583
  C   -2.89575139481927     -6.42711273917832      8.80205297187213
  C   -4.12766048489741     -5.99574979327941      9.26147507366685
  F   -4.41776511267823     -6.11720348881367     10.57489565669309
  C   -5.07927581637940     -5.44091057789285      8.39800908503852
  C   -6.39611140619529     -4.92334088985671      8.81714898592776
  O   -7.20729274476487     -4.45069577822561      8.02701983753327
  C   -6.85301356379014     -4.97677434272260     10.29015334816773
  O   -7.62707098134409     -5.81022914636560     10.68848085518158
  C   -6.28485759244209     -3.81510475717429     11.14792168934610
  O   -5.34631670051321     -3.16692273452708     10.78551105891637
  Cl  -7.15517580130556     -3.55588349685968     12.66667228780293
  C   -4.76133131308286     -5.36462632540575      7.03455693761054
  H   -1.62077483325601     -1.14455302122596      2.12977392263063
  H   -2.33854512961817      1.21348437423852      1.70220526653769
  H   -5.76492247540586     -2.36091700278545      2.18934161390776
  H   -8.28974676840346     -6.59593636155868      3.74712130257815
  H   -10.46905673544578     -5.69196031828662      4.41579864827950
  H   -6.53162252888597     -2.81847825267705      4.60755576517605
  H   -1.54195714720356     -6.48238075430399      7.19471363043444
  H   -2.18435565864314     -6.83451265155238      9.51831252013432
  H   -5.52765412228585     -4.97391672352250      6.36446586139174
  N   -4.52138032331408     -2.73888904687300      4.99091000756694
  N   -5.04297834334879     -1.62268070384927      5.53420081762836
  H   -3.38955761421815     -2.18089780439148      7.66458269142857
  H   -7.24445833581767     -1.66700717507431      5.98823707611767
  H   -4.84310265345500     -0.73242073073473      5.04111386007035
