105
Coordinates from ORCA-job /scratch/magstr/orcajob__5658521-pCmn/orca
  N   -3.47692141840811     -3.87120224090558      2.58603402059349
  C   -2.89803964261210     -4.56945104697852      1.43638207778604
  C   -2.48407140928532     -5.97030694205732      1.86914146631816
  N   -3.53882179980073     -6.55664032514296      2.74233526275297
  C   -4.75936339141072     -6.94514958005779      1.97853666116525
  C   -5.97930225183923     -6.97806892208528      2.89514371962986
  N   -5.90815602449229     -5.85918388089569      3.83675683882102
  Mo  -4.16808463337505     -4.95914982154164      4.07795930509297
  N   -2.81039787143532     -5.84158187535535      5.21730118054481
  C   -2.19054935623650     -7.07788392561814      4.74744086065336
  C   -3.03169527381572     -7.65371085459204      3.61151898437586
  H   -2.13600515252103     -7.83962397428897      5.54528323687988
  H   -1.15007569034549     -6.90309762240773      4.41383600276399
  H   -3.91478109344924     -8.15742639855126      4.02775199387259
  H   -2.46534326316973     -8.38957441730184      3.01601387457222
  H   -6.87932814258486     -6.92126556265525      2.25737157653058
  H   -6.03862472231224     -7.94616619385665      3.42609486131918
  H   -4.90474478409770     -6.17811535278944      1.20664480064115
  H   -4.60764255459365     -7.91441983091813      1.47402932999134
  H   -2.00394578078678     -4.04912376962370      1.05473320486391
  H   -3.61423369156274     -4.61552779001374      0.59278107190064
  H   -1.56887069312407     -5.91119264132804      2.47297123460401
  H   -2.28823406986973     -6.62450784410120      1.00306369712907
  C   -3.04362382597291     -0.10300348750714      1.85059297415668
  C   -2.76269237939816     -1.60459778019348      1.81060421299934
  C   -3.90174623003780     -2.48111194298949      2.35609848126003
  C   -5.20413881911513     -2.43340062926834      1.50643067161579
  N   -6.06357595126371     -1.32542376637576      1.84395185993195
  C   -6.41823186157036     -0.26191525113399      1.03769309882052
  C   -6.27818247283437     -0.27011056998403     -0.36490580764276
  C   -6.70001745360860      0.83386515830324     -1.10679764555407
  C   -7.27249387271516      1.95295921878145     -0.50335333159381
  C   -7.41162312060840      1.96305589613495      0.89377333809274
  S   -8.13232373065519      3.32071283261629      1.77570512973456
  C   -6.97565126289069      0.87675338852856      1.65290808383578
  C   -9.09873952551332     -6.44087748528820      5.94762765604493
  C   -8.02127203577647     -6.75479482462704      4.90959088045787
  C   -7.10483520709020     -5.55100065450028      4.64583212456285
  C   -7.88262485948096     -4.32765606527432      4.08608795666123
  N   -7.76943145725154     -3.21152158161475      5.02689539752403
  C   -8.39670062521154     -1.97615651930507      4.76414146403828
  C   -8.98657494958671     -1.66930041286415      3.53005145302916
  C   -9.54241780054874     -0.40128033047417      3.33619738172042
  C   -9.52552376640545      0.56190135052200      4.34039298026599
  C   -8.93159037749158      0.25453045472230      5.57684570973594
  S   -8.85407747964211      1.41362575597083      6.91146013705362
  C   -8.36788909787805     -1.00803278729207      5.78268291439009
  C   -0.15777817846738     -6.50437860981756      7.28094758784301
  C   -0.80484771948260     -5.24964724100638      6.68862745378102
  C   -2.33548758370724     -5.24088061530598      6.47334608273016
  C   -3.11935665692583     -5.78135925206544      7.68570768513056
  N   -4.56115595554199     -5.80089845540271      7.39442078822192
  C   -5.48198107324965     -5.84240965939647      8.46510725778356
  C   -6.47276264155926     -6.83496713672030      8.50880099560212
  C   -7.43762897070683     -6.80941198741073      9.51637193574075
  C   -7.43080809929471     -5.81700909801012     10.49389727913242
  C   -6.43757589327831     -4.82479117335451     10.45666539712170
  S   -6.35389003906507     -3.51285222324933     11.63988892097973
  C   -5.47047830080707     -4.83815996422683      9.44425019049812
  H   -2.14841746311357      0.45814670498081      1.54777310947187
  H   -3.31486901797452      0.22687189947557      2.86539357102578
  H   -3.85995918730868      0.18653208470673      1.17643044680619
  H   -1.86114615477033     -1.82630476405358      2.40516146053980
  H   -2.53846438136083     -1.90385130518585      0.77388967105199
  H   -4.17226870485269     -2.07947555364075      3.34883880023104
  H   -4.96649218490134     -2.39227188614284      0.43560156260030
  H   -5.73634185462299     -3.38905277453865      1.68078596666955
  H   -6.23333240115275     -1.18343595843184      2.83535130304265
  H   -5.86422377076992     -1.13506728091107     -0.88223861328822
  H   -6.58796193393655      0.81498309876606     -2.19262491884680
  H   -7.60500368731805      2.79979937447383     -1.10385619355013
  H   -8.38469678538909      4.09056775588232      0.69258333063117
  H   -7.07994069745733      0.89227901253531      2.73988669780446
  H   -9.71161779245672     -7.32959973317331      6.15167842189266
  H   -9.77996978032396     -5.64722716423407      5.60737463764540
  H   -8.64944074390439     -6.11963677781641      6.89994637019151
  H   -8.49137996817439     -7.08817050364730      3.97062292677327
  H   -7.40424943684023     -7.59285962435516      5.27149878798649
  H   -6.72780531075762     -5.25261918422823      5.63990437806687
  H   -8.93607635609732     -4.58494220298290      3.86867130324507
  H   -7.42086760417544     -4.02430140263062      3.13559551425864
  H   -7.95295145593331     -3.51837566835199      5.98419722931971
  H   -9.01773487615154     -2.40410500793345      2.72752673759923
  H   -9.99468728015428     -0.15768700857284      2.37380096422779
  H   -9.96005367594604      1.54603745259626      4.16315479314511
  H   -9.45559636310387      2.43337028034644      6.25751195135688
  H   -7.88955520923621     -1.25549850743884      6.73595243807002
  H   -0.31749176687615     -7.40244354362396      6.67045978792377
  H   -0.52985727163322     -6.71696047473518      8.29274392656923
  H   0.92816180326712     -6.35466474274707      7.36182340822412
  H   -0.57770798693555     -4.40294640000850      7.35652579882231
  H   -0.33498681959653     -4.99923675134069      5.72387255582893
  H   -2.59806551860885     -4.17336306297340      6.40061606885600
  H   -2.76715341523452     -6.78743185427374      7.97315917385375
  H   -2.94606794831629     -5.11332621081690      8.54036353954203
  H   -4.75559912434825     -6.54716914504718      6.72497411029967
  H   -6.47681264527192     -7.62548380203244      7.75505535929609
  H   -8.20500729507226     -7.58500339686799      9.54670653092765
  H   -8.18569192523407     -5.81309320560437     11.28057517136626
  H   -7.45976470158791     -3.86597438911842     12.33378419088144
  H   -4.71590925013616     -4.04980602024094      9.40490370104549
  N   -4.83381934333166     -3.39985692545376      5.55551730134222
  H   -5.79779556539070     -3.05059074340665      5.36815210210301
  H   -4.21509447985524     -2.60193824585178      5.72207337666645
  H   -4.88407668189085     -3.96301117920430      6.42561228997329
