78
Coordinates from ORCA-job /scratch/magstr/orcajob__5668084-Vrft/orca
  N   -2.87485118596802     -3.32805526489399      2.42115838141705
  C   -2.17144117196047     -4.14020195516453      1.41531569780689
  C   -1.78015481373327     -5.46939086928907      2.01245642219459
  N   -2.91868029919154     -6.02854629231843      2.78927313726420
  C   -4.03522795500416     -6.42277346868415      1.87409797967598
  C   -5.35278830466695     -6.15581900595644      2.56220347468692
  N   -5.29614688469994     -4.84920248057945      3.22869453819646
  Mo  -3.55152914945357     -4.32862584313145      4.14491880880118
  N   -2.36236032779599     -5.64096213946252      5.36903296473163
  C   -1.62489986617442     -6.72919831400343      4.72415548619291
  C   -2.48170027188458     -7.20679404093717      3.58236773711010
  H   -1.46362703503494     -7.55620334029575      5.43177171018582
  H   -0.62763682575563     -6.40637230659903      4.37699346317062
  H   -3.38558356778136     -7.69131055416723      3.97581916651777
  H   -1.95096702739952     -7.92209116807065      2.93325440887931
  H   -6.17076486522545     -6.19749635399103      1.82988891445860
  H   -5.57018856836595     -6.92321037654203      3.32805749712193
  H   -3.98510277152138     -5.80701409569792      0.97417571621699
  H   -3.91757670944421     -7.47970723076695      1.59109572455010
  H   -1.25344862647913     -3.63329814652461      1.07990915808780
  H   -2.81577310969831     -4.26884958251525      0.53145540154634
  H   -0.93229796952837     -5.33964114669058      2.69715428062656
  H   -1.47453041612551     -6.17812004232545      1.22499759482427
  C   -3.13954159254175     -2.05197544986602      2.05731804298279
  C   -2.74852110570397     -1.55037731937073      0.77573006097864
  C   -2.93753420954088     -0.24324644641547      0.38100307047489
  C   -2.54560041711221      0.09718914861590     -1.02682866363327
  O   -1.69349318410013     -0.53258063379207     -1.63113528860094
  C   -3.56656190141767      0.69739666457561      1.25954732430256
  C   -3.68105109634020      2.13376715033962      0.96622386580194
  O   -3.11881365264118      2.70541815986942      0.04324570671540
  C   -4.02213053593121      0.23446536038132      2.47622577926634
  C   -3.84487260842062     -1.10602398785561      2.90872423462945
  C   -4.42919604728059     -1.42164413118577      4.14867939111029
  O   -4.43442481151363     -2.55938471727019      4.72786353025770
  C   -6.44402790103809     -4.05719326536113      3.14380408011728
  C   -7.06911851657935     -3.61768943470648      4.32524521193042
  C   -8.24144920203111     -2.85977207229233      4.32800987370331
  C   -8.70778132840307     -2.42242525384601      5.66938024030569
  O   -9.52312135013085     -1.54492338532728      5.89231044553912
  C   -8.87446323190969     -2.52715679213295      3.10279662447733
  C   -10.17311018469650     -1.80525235438896      2.99140962185771
  O   -10.59895528037229     -1.39540235352192      1.92110033547261
  C   -8.25291548045641     -2.94284004122075      1.92686300606351
  C   -7.05187677069180     -3.66630396110622      1.90538583739269
  C   -6.44604829926680     -3.79915974422964      0.56863183302908
  O   -5.32392632582103     -4.21512007557558      0.30693992832984
  C   -2.04492652426112     -5.37714940765846      6.65894518368022
  C   -0.80368942474822     -5.77746559159574      7.23237738498257
  C   -0.44420393995048     -5.43301638162951      8.52227169724878
  C   0.89711601567915     -5.91521431892263      8.99753186278268
  O   1.83205099311367     -6.07126315190306      8.23130836021151
  C   -1.34881860832448     -4.71607134057033      9.36422612136517
  C   -0.97300240268678     -4.22760112819816     10.69857571635354
  O   0.16980896453929     -4.21585084873587     11.13449152943543
  C   -2.61229038273036     -4.42461642874966      8.87056514467727
  C   -2.97681833503627     -4.72038782105723      7.54362601108226
  C   -4.34527254480392     -4.61527633426949      7.15694797317391
  O   -4.77285319520370     -4.76759600588343      5.98852043782528
  H   -2.29246529475595     -2.20639895065076      0.03813226917963
  H   -3.10424724717531      0.92787495692259     -1.50229730946607
  H   -4.32306818766526      2.69840765461555      1.68634911888781
  H   -4.53243747340193      0.92675440862336      3.15229479227056
  H   -4.97065517148082     -0.62114583307700      4.67550214184212
  H   -6.62580704097460     -3.90971736666595      5.27581530633740
  H   -8.20147847702957     -2.96035153395480      6.51031190041084
  H   -10.74615171884142     -1.67103118076822      3.93010696931248
  H   -8.72118192583865     -2.66098838927111      0.97938476708300
  H   -7.10416604715741     -3.41528055716418     -0.24683873325660
  H   -0.07066629065520     -6.32580037768324      6.64127503737623
  H   0.97193658490407     -6.17060534935476     10.07381591651963
  H   -1.82452809980391     -3.83330555050639     11.30492626662478
  H   -3.34571268741037     -3.93917708468851      9.52154321259134
  H   -5.09057842049147     -4.46101882996832      7.95916959159104
  N   -1.76187668954223     -3.00658299152791      4.96368041591527
  H   -1.87200232489486     -2.75397325599921      5.95083285105398
  H   -1.69952311486325     -2.13104898773293      4.43630430452816
  H   -0.85068023167451     -3.46554206768389      4.87959000161095
