94
Coordinates from ORCA-job /scratch/magstr/orcajob__5661749-McsN/orca
  N   -2.41221947464323     -3.67884285125069      3.11640458317487
  C   -1.81674596217431     -4.51981060277130      2.06980238590333
  C   -1.79851231102420     -5.97573101120877      2.51988583253435
  N   -3.09131704811080     -6.31542935329771      3.15792254049320
  C   -4.18719400209187     -6.51765721966604      2.18750014865790
  C   -5.53173310050490     -6.27911537489978      2.85930860322270
  N   -5.46631923312153     -5.05129104389777      3.65222188346755
  Mo  -3.67543053285946     -4.46129890574774      4.38129624816795
  N   -2.70162606895114     -5.56395588860708      5.72871335501453
  C   -2.27229781733389     -6.92236274611658      5.40106734785319
  C   -2.99874317804901     -7.40610049862791      4.15217275885358
  H   -2.48198149088574     -7.63512299005570      6.22021923242206
  H   -1.17977816448740     -6.96573230932106      5.23482681923881
  H   -4.02765206480663     -7.68973315966417      4.41227667046561
  H   -2.49905075796385     -8.29479816568012      3.72712007188669
  H   -6.28604444720050     -6.20411833770877      2.05974302551912
  H   -5.82179801488448     -7.15872887419810      3.47012045823314
  H   -4.05409851537338     -5.77548417353156      1.38837667772937
  H   -4.13840867867213     -7.52427765179774      1.73489151338562
  H   -0.78263898800725     -4.20938819224297      1.85953131783657
  H   -2.37711439555418     -4.41516926058668      1.12358012263068
  H   -1.01469883662100     -6.10886657593281      3.27775022324867
  H   -1.57913997913699     -6.65613533072454      1.67793284365648
  C   0.34551764424032     -1.81070384839553      2.41200073509039
  N   -0.68297584894363     -1.94385014143706      3.43955900017177
  C   -2.07077641607583     -2.23779626093032      3.09757932240338
  C   -2.48445750226291     -1.55897273275038      1.77725453613549
  C   -3.96163219021043     -1.68086750851532      1.51242549697429
  C   -4.88159271519589     -0.94073451126502      2.26925949326102
  C   -6.25165856905405     -1.04818848352270      2.03301660077058
  C   -6.73121569526027     -1.91058515687316      1.04308727763349
  C   -5.82607219829753     -2.65415654942221      0.28381919300584
  C   -4.45364994959046     -2.53207101760311      0.51476567818425
  C   -8.21699156391477     -4.95968140535609      6.21384486085472
  N   -6.90800103960109     -5.11507723072789      5.56008637960151
  C   -6.72754721753830     -4.53977718672073      4.18008948891703
  C   -7.91829913629936     -4.74007404164097      3.22032225185215
  C   -9.15056852271930     -3.90723195243882      3.49526056920512
  C   -10.42083128012078     -4.49583672248052      3.41808391748451
  C   -11.57845439403033     -3.74569651779056      3.63114275494600
  C   -11.48589566406884     -2.38398797730208      3.92801250899677
  C   -10.22740837113577     -1.78318967831010      4.00164968363367
  C   -9.07253648368690     -2.53763223722454      3.78519505976211
  C   -2.74960779788050     -4.64158312372343      9.36101521389687
  N   -3.13867995157632     -5.13930286416071      8.03339528225650
  C   -2.14177255591094     -4.95719699779740      6.93734607367460
  C   -0.69524429232335     -5.41160574887344      7.24907958511159
  C   0.11662134468420     -4.42749496991497      8.05941753793753
  C   0.77965841873477     -4.83008189449242      9.22588938199725
  C   1.55212413863999     -3.92888807629662      9.96123530160916
  C   1.67525831029165     -2.60370939312027      9.53823089097066
  C   1.02846864714118     -2.19147132766731      8.37052018299744
  C   0.25942342657688     -3.09689292894546      7.63773490177836
  H   0.50704813749873     -2.69352366514190      1.76288132512287
  H   1.29805192766345     -1.59329205860193      2.91431284490717
  H   0.12346209424572     -0.95496739943270      1.76016445086506
  H   -0.38034012847229     -2.56464822374677      4.18999426019629
  H   -2.69838493915112     -1.80936109120131      3.89573983157072
  H   -1.91680271601749     -1.98165101018534      0.93550899633063
  H   -2.20040056798369     -0.49787412986985      1.85517809689963
  H   -4.51743266542444     -0.26155998234251      3.04393105898081
  H   -6.94940314705779     -0.44280715570677      2.61434990549218
  H   -7.80402081430413     -1.99243318764118      0.86077296305769
  H   -6.18748710772094     -3.31900586743475     -0.50307829865336
  H   -3.75009584387697     -3.09668168560271     -0.10199134820686
  H   -8.15101694690792     -5.38164989156567      7.22641024861197
  H   -8.46113007165749     -3.89213663440970      6.29605859413085
  H   -9.04169348508306     -5.45277567363853      5.67927610464248
  H   -6.65991972173668     -6.10678683204850      5.51418985906952
  H   -6.60018346397910     -3.45677515700808      4.32731778014783
  H   -7.54169199583848     -4.47358398623662      2.21804759259176
  H   -8.20620631696739     -5.80199923119159      3.18248704568688
  H   -10.50204455538420     -5.56203915450052      3.19081303355138
  H   -12.55580915194897     -4.22704971772886      3.56607301765615
  H   -12.38834873395200     -1.79478813569585      4.09734865507787
  H   -10.14295446848997     -0.71815736574046      4.22598251906027
  H   -8.09955247391146     -2.04774153910461      3.83867177988129
  H   -2.48391375606558     -3.57790989735207      9.28359314425345
  H   -1.89182951484751     -5.17041108155610      9.80250730368753
  H   -3.60882547443825     -4.73821213028626     10.03861461087235
  H   -3.37985699327881     -6.13332162703610      8.08868898106345
  H   -2.09661113502123     -3.86935466399850      6.77942960693965
  H   -0.18817046108238     -5.54413827128490      6.27943908094973
  H   -0.69680240597062     -6.39688725552496      7.74065434858419
  H   0.68703085715593     -5.86555073144904      9.56360234509829
  H   2.05934828347345     -4.26350492710712     10.86778154149850
  H   2.27678355901975     -1.89703373215126     10.11176761580911
  H   1.12693994133849     -1.16092300712239      8.02488425167435
  H   -0.23149579111237     -2.75803936098253      6.72137648689487
  N   -4.31016290343846     -3.18188024503015      5.54129913618865
  N   -5.02752891323544     -3.56056964723520      6.75191357423411
  H   -5.35306724641444     -2.72535318882160      7.25249435821946
  H   -5.86635266621464     -4.21133168027455      6.42380733335195
  H   -4.37654773556231     -4.17628977377443      7.38350913929754
