102
Coordinates from ORCA-job orca
  N   -3.57401958267484      0.26386054944193      4.81190872933233
  Mo  -3.89734545853630      2.21464002818284      5.03179077685101
  N   -4.99095880848838      2.66536505350701      6.57585264623709
  C   -4.31715815125173      2.85954499701555      7.86392752537521
  C   -3.14836333640114      1.88385555823174      7.94557542287183
  N   -2.39428736284338      1.90331830466117      6.65952399509876
  C   -1.73246077176427      0.59676007613993      6.37958618227299
  C   -2.73973785152138     -0.38979082239882      5.82341182456605
  C   -1.40935342652333      3.02047786972649      6.58550704628574
  C   -1.26127670525688      3.39703560133492      5.11373091998197
  N   -2.59168031326318      3.68831433847525      4.56039399430423
  H   -2.18551707156962     -1.24395453362897      5.39518945514500
  H   -3.37565768300858     -0.80838890351800      6.62973265617391
  H   -0.95515606913114      0.78156420853292      5.62613984521665
  H   -1.24135001976229      0.21487776401910      7.29017436929063
  H   -0.58724030212336      4.26417526634640      5.01243633768409
  H   -0.79175362607980      2.57146912430378      4.55331529147383
  H   -1.82467115902763      3.87407129739754      7.13929116250672
  H   -0.45885166986678      2.72645030094864      7.06306934826138
  H   -5.01082050783060      2.66062284805976      8.69791782377858
  H   -3.96890158545318      3.90224105936555      7.97970016947762
  H   -3.54356974498487      0.86744874292099      8.07843300482372
  H   -2.47395005082700      2.10823934673198      8.78874013343528
  C   -4.39380506069483     -0.70294020650641      4.07896803723656
  C   -3.65371170797517     -1.43030839385001      2.94522620516984
  C   -3.17186160221418     -0.51096676114147      1.84532485242594
  O   -4.35798440705754      0.10398406326641      1.24424330643728
  C   -4.19906304017615      0.87933862528834      0.13036169075944
  C   -5.03177741301947      0.64896451145869     -0.94783414143421
  C   -4.94501524193868      1.48057457803646     -2.08465273484957
  N   -4.09995531200250      2.49074377740983     -2.21411652956302
  C   -3.27816790602496      2.74032623710716     -1.15558544397196
  C   -2.36518926088709      3.82077741265676     -1.23530427717380
  C   -1.55475611554215      4.10323497962441     -0.15786626313743
  C   -1.67407644767570      3.31585592638886      1.01029153997835
  N   -2.50546005026127      2.29283436996178      1.13127127446627
  C   -3.28706357614114      1.97949084213514      0.06110910110163
  C   -2.85091466783098      5.13105134278012      4.58684958220534
  C   -4.16014610820172      5.57812414975126      3.94544880492648
  C   -4.10069681495610      5.66181433871605      2.41556945214640
  O   -5.16917535240500      4.94700216052982      1.75175907082455
  C   -6.42338735787723      5.44992371920639      1.80517194393779
  C   -6.80969112591787      6.59097685560719      2.48851825151463
  C   -8.17016398969806      6.97263638845485      2.46820779290320
  N   -9.13350217414669      6.33133137583487      1.82856484281301
  C   -8.76119063688627      5.22098060630956      1.12336509218457
  C   -9.73768175878423      4.51570181303606      0.37918107161767
  C   -9.36137041043071      3.40350587096384     -0.34062675862754
  C   -8.01080557072528      2.98829503142512     -0.30284127855717
  N   -7.06298247610557      3.60871854082313      0.38269579084065
  C   -7.42218296712217      4.71817588069139      1.08101481824562
  C   -6.45082530507036      2.73714088234035      6.55855548072666
  C   -7.01479420939474      4.14863074637452      6.31026157654180
  C   -8.38699042462386      4.11300742349313      5.65888745254454
  O   -8.24201419675193      3.32015500061335      4.45949594856044
  C   -9.35049810076358      2.92586523905003      3.80471813082013
  C   -10.60831221197046      3.48760028313017      3.93859821195493
  C   -11.66957985540483      2.97731495183087      3.15831864946888
  N   -11.57409136377243      1.97232789569984      2.30235614873347
  C   -10.34346444808343      1.39545264700022      2.17602227264211
  C   -10.17811213505433      0.30586530079808      1.28678508054797
  C   -8.93591372318999     -0.27529339085425      1.15215081921566
  C   -7.85828162118457      0.23011950975995      1.91138146828554
  N   -7.96802165635176      1.24248506195228      2.76120033456999
  C   -9.18729304119203      1.83023493742902      2.89606000469630
  H   -4.78257282176168     -1.45861964487771      4.78739798957820
  H   -5.27828025376807     -0.20018817861333      3.66652176346057
  H   -2.77245956973083     -1.95787689213041      3.34434094285858
  H   -4.32054319818027     -2.20124863349090      2.52635370727569
  H   -2.64502384462989     -1.07116343786186      1.05767742311707
  H   -2.51795042497060      0.28105518098741      2.23076087497041
  H   -5.74477916945842     -0.17555807910985     -0.91492246294936
  H   -5.60552744713926      1.28749817253711     -2.93588371037704
  H   -2.33587177771309      4.40378084109208     -2.15711462655518
  H   -0.83741768360883      4.92439364189539     -0.18831565623506
  H   -1.06423144431706      3.54572313605622      1.88998074982893
  H   -2.01482655153849      5.65380160640454      4.08033637025454
  H   -2.83984960906510      5.49936736279317      5.63341893441759
  H   -4.43067493642878      6.55401758228182      4.37295564088072
  H   -4.96615050338758      4.88950905289057      4.23841425946970
  H   -3.20051028183373      5.16170443582866      2.04010797244321
  H   -4.09653814534074      6.70316355732214      2.05860918905698
  H   -6.09809458195487      7.19681858913982      3.04603130164242
  H   -8.46898492559998      7.86847899250842      3.02260178381652
  H   -10.76646334888248      4.87793663534079      0.39741704431954
  H   -10.08728926845760      2.83762122238225     -0.92524457693953
  H   -7.69985978866881      2.09893994244755     -0.85910125349458
  H   -6.84946369290252      2.32348844480184      7.50225168563895
  H   -6.80955846006158      2.08159990629934      5.75288734921198
  H   -6.32732455827637      4.68389400076278      5.64016575209089
  H   -7.07690716845922      4.73278568721618      7.24082170114348
  H   -8.72989351404040      5.12716850980614      5.39927940600063
  H   -9.14281443387765      3.63742360039636      6.30640935994866
  H   -10.78972609689129      4.32688823019661      4.60816258602136
  H   -12.65717821008339      3.43942492112940      3.25366654186980
  H   -11.04842739763800     -0.04025370896402      0.72692981549979
  H   -8.77335636533870     -1.11450879783063      0.47479672532971
  H   -6.86243968626979     -0.21145967080230      1.80904688349331
  N   -5.22158004534858      2.30498563731549      3.24720261277125
  H   -4.84160422484543      1.63358521334071      2.56330709477362
  H   -5.22128523152056      3.20036716450114      2.73949234802890
  H   -6.22584823431194      2.03383817562537      3.33815614316316
