77
Coordinates from ORCA-job /scratch/magstr/orcajob__5661765-eWkV/orca
  N   -2.72280735386278     -3.57036412581894      2.74253201703484
  C   -2.04797474599118     -4.32408775871911      1.68444626912705
  C   -2.12547011127913     -5.80129289361262      2.01888362168016
  N   -3.48978920719091     -6.13147576862319      2.52284863806862
  C   -4.47262768801755     -6.24328753443819      1.40616625674202
  C   -5.87146973915576     -5.94629015833446      1.91677225568093
  N   -5.82277334131343     -4.77005414407293      2.78130453481217
  Mo  -4.09634965667204     -4.54881205003951      3.77049906527300
  N   -3.59947280324843     -5.80691565238133      5.24691548126902
  C   -2.91455026614120     -6.99709634421948      4.75626924492711
  C   -3.49353054136353     -7.33881316731242      3.39241737876719
  H   -3.05982313155374     -7.87435881741941      5.41609702372444
  H   -1.81675907489527     -6.85192000212436      4.68042410279759
  H   -4.54398189941375     -7.63861564211730      3.50889880372730
  H   -2.94626798866644     -8.16355387376491      2.90152411908312
  H   -6.52727086590985     -5.77626798665396      1.03889204040756
  H   -6.28725399898694     -6.83488035232720      2.43786219564531
  H   -4.18939274205995     -5.48978847610611      0.65890931830643
  H   -4.39993333318381     -7.24089426097507      0.93871616915864
  H   -0.98115144228427     -4.04295316723742      1.61549667698051
  H   -2.49270294521562     -4.11792309931799      0.68769811381388
  H   -1.42137990426575     -6.02911409642476      2.83027195781923
  H   -1.87032640573183     -6.43505331164741      1.15003645921528
  C   -5.41670023912538      0.22681077495992      1.51228929526694
  C   -4.02649902401264     -0.38335440906117      1.58559564296519
  N   -3.98106629106941     -1.54973627283680      2.46710386374232
  C   -2.63106017044060     -2.12556675559214      2.57800360623402
  C   -1.88302838470195     -1.46339547381883      3.74919640869680
  C   -0.37734164987151     -1.47870032088346      3.62686100272707
  F   0.13516102820708     -2.80135553487428      3.60238229475652
  C   -8.09575663008669     -0.73172472848779      4.15284122369559
  C   -8.29193580322117     -2.21658151145885      3.88577084734015
  N   -7.07235391700890     -2.82678916151793      3.35970430236964
  C   -7.14569513199974     -4.26987368841624      3.11411833187764
  C   -7.77830582167844     -5.09757640820314      4.26975116594142
  C   -6.98244028380502     -4.96410098436603      5.54458733862393
  F   -7.04582846631593     -6.15070648121952      6.31306887687086
  C   -0.23677725788034     -3.61940925611969      7.75246305699815
  C   -0.54462007236674     -4.45662612396421      6.51210181355009
  N   -1.91364852304279     -4.25004054674720      6.01202530677803
  C   -3.02755134347639     -5.15929352497104      6.41985781398272
  C   -2.67650702746488     -6.14147171921518      7.54737403449163
  C   -3.93239824713334     -6.80490683305921      8.07531913868656
  F   -3.58652954539369     -7.81976093539816      8.99503570424631
  H   -5.44813176633921      1.03839764573805      0.77177860615542
  H   -5.71482257241925      0.63201923311531      2.48852927794960
  H   -6.16086432469648     -0.52968470631297      1.22143643230479
  H   -3.31735852089827      0.36550838998014      1.97767692312173
  H   -3.66863935431342     -0.63843275739385      0.56374810775470
  H   -4.61160829728505     -2.28136517952613      2.11979944775775
  H   -2.05629222462134     -1.90660618415387      1.64645598182274
  H   -2.20747186136468     -1.93913038308062      4.68843314466272
  H   -2.17459143617823     -0.39998660358790      3.80884774959667
  H   -0.04591678004012     -1.00460393345863      2.68821548707260
  H   0.10254807356197     -0.97029269433618      4.47714835043037
  H   -7.81040073600506     -0.19931870161948      3.23726389727581
  H   -7.30212298184658     -0.56887738096138      4.89858158362051
  H   -9.01925513012728     -0.28371498430428      4.54500185020092
  H   -9.08776181490726     -2.35981073350973      3.13406950540462
  H   -8.65720998900035     -2.70007251846266      4.81584187337959
  H   -6.27999310844982     -2.62417528198147      3.97994703618783
  H   -7.81438547528235     -4.40466816735711      2.23751348912783
  H   -8.83111534487715     -4.81451886197897      4.41733018406958
  H   -7.77342461418433     -6.15698955599553      3.96987061388712
  H   -5.90878306860494     -4.80830883015559      5.28526751005602
  H   -7.31626448041512     -4.14658063820516      6.20234482175249
  H   -0.40990012419458     -2.55390063000078      7.54309962836986
  H   0.81045623034662     -3.74804261893034      8.06506700949311
  H   -0.87571138857996     -3.89914944095113      8.60272827193290
  H   0.13088332740249     -4.14984009073706      5.70021341911413
  H   -0.32059666925882     -5.52041733417611      6.71589513826931
  H   -1.90840915346507     -4.28761863657042      4.98280497450499
  H   -3.83857363832801     -4.51343948267390      6.81464143036623
  H   -1.98200607439772     -6.91918404898153      7.19750805745270
  H   -2.17778668443917     -5.60265436216810      8.36491432563335
  H   -4.57579832661482     -6.08897121881938      8.61031942142717
  H   -4.51793870188488     -7.27275272950408      7.27019463594175
