75
Coordinates from ORCA-job /scratch/magstr/orcajob__5668060-5g5i/orca
  N   -2.65265856011623     -3.70411008210466      2.64057311274371
  C   -2.24953512057429     -4.66262023721560      1.59628036500259
  C   -2.13363243472002     -6.08205591885752      2.14396856422250
  N   -3.30445295487917     -6.42414800434185      2.96676959889046
  C   -4.51437977192282     -6.75900492236023      2.19970459071988
  C   -5.76178668837321     -6.42216001028489      3.00532674523889
  N   -5.65262308538053     -5.06782075762161      3.57363483139615
  Mo  -3.88852938497451     -4.31657766269352      4.09325942781571
  N   -2.92433092245016     -5.34313315016231      5.50016726004447
  C   -2.29240768620689     -6.63785885778533      5.20020036850333
  C   -3.01814074360416     -7.35435269789390      4.06956384921690
  H   -2.29192501735066     -7.28958025696425      6.08638740524718
  H   -1.23200107545051     -6.45945730702173      4.94060312919075
  H   -3.97778323107725     -7.72260091461628      4.45524643155575
  H   -2.43023008319294     -8.22683181041411      3.72805752702953
  H   -6.64055473377014     -6.48816758336600      2.34674250491835
  H   -5.91929011478957     -7.14836436358236      3.82425517850514
  H   -4.51231057270839     -6.14569614516042      1.28756387948710
  H   -4.52688053494580     -7.82241234019284      1.89533464782568
  H   -1.28266358146150     -4.37165976362341      1.15740364397147
  H   -2.98927116176462     -4.61616200958625      0.77700949805644
  H   -1.24731495799903     -6.13965281751393      2.79160714447089
  H   -1.99113390800459     -6.80057808775408      1.31497869189191
  C   -2.07386166703835     -2.42710380408117      2.58476560070794
  C   -0.67582885770482     -2.30376465666354      2.60497387933355
  C   -0.05559851463856     -1.05452405993615      2.68916667848902
  C   1.41612064264208     -0.95382013646218      2.73842450128587
  O   2.05814074811755      0.07326260725603      2.87122922260172
  C   2.22746406112849     -2.25831061974002      2.61569065526311
  O   2.66042663305368     -2.91807019727023      3.50713597868659
  Cl  2.57206059689326     -2.62211277607912      0.87632114555541
  C   -0.82514359528803      0.11823793127275      2.76186390741744
  C   -2.20603039952234      0.01763622033427      2.72151717898040
  C   -2.84114068028599     -1.23232918011463      2.60221610505107
  C   -4.30640335885586     -1.27271526188007      2.40522218745702
  O   -4.96661934113031     -2.08536501127799      1.82335543191437
  F   -4.91923358596954     -0.15849512320507      2.92635287543417
  C   -6.86409920821048     -4.49931109113705      4.02963173190050
  C   -7.15340123535277     -4.60099359869610      5.39810490729513
  C   -8.27229223386579     -3.98199176621020      5.95826550956850
  C   -8.53855673597946     -4.08461915821503      7.40746276564067
  O   -9.47968559260788     -3.57906751153158      7.99447872698742
  C   -7.51831028222371     -4.86138905193910      8.26129918950412
  O   -6.50204227508924     -4.42082207195212      8.70549702937459
  Cl  -8.10199224340071     -6.52045927311402      8.61986736362514
  C   -9.14926849893500     -3.24514081819578      5.14380631720729
  C   -8.88710833645495     -3.14896168031342      3.78909895763717
  C   -7.76479944011619     -3.77642123930920      3.20793374820476
  C   -7.62017852562278     -3.56264813706141      1.74717516769962
  O   -8.20749211165604     -2.76452778910948      1.07693294290017
  F   -6.74890570857079     -4.43374844486252      1.14234224914050
  C   -2.70497909282453     -4.82908085454858      6.78922955758932
  C   -1.95802012301123     -3.64862776423344      6.91191880580078
  C   -1.70329410010814     -3.06997951193793      8.15498469575346
  C   -0.92490913790988     -1.81589794131130      8.24590523142643
  O   -0.60773029150131     -1.25234920749544      9.27834626535917
  C   -0.51675992595039     -1.13268827187379      6.92584855417282
  O   -1.12628492150570     -0.27903844468480      6.36238413734507
  Cl  1.10339587862455     -1.70490274602439      6.37332846341016
  C   -2.18616186367823     -3.67354190655650      9.32886901809092
  C   -2.93293270850060     -4.83464229127557      9.23056282189227
  C   -3.21340334884639     -5.42174566799463      7.97823717121821
  C   -4.13757733019595     -6.56901758982631      7.91346935402968
  O   -4.68761273011356     -7.05246074971519      6.96245838568419
  F   -4.38353089742021     -7.10216421464669      9.15841821151530
  H   -0.07636052970834     -3.21612838140340      2.61494138038274
  H   -0.32799291935309      1.08351280852129      2.85011395207104
  H   -2.81958394965897      0.91637294074803      2.76096556646196
  H   -6.45089567907993     -5.16283793669353      6.01612523935318
  H   -10.01543380064587     -2.75624606754274      5.58932395233178
  H   -9.54450500754743     -2.57452876746983      3.13649416753985
  H   -1.57893174697031     -3.19705937148925      5.99452293715938
  H   -1.98035684621221     -3.21281673069744     10.29470006800525
  H   -3.34499449913293     -5.29262360913443     10.12772730251216
  N   -4.26942835634697     -2.92375332210202      4.93591741008573
