78
Coordinates from ORCA-job /scratch/magstr/orcajob__5668083-erDH/orca
  N   -2.92571215825459     -3.28224028387580      2.39283019175813
  C   -2.40504800647335     -4.08777290269488      1.28228796649975
  C   -1.85885974536859     -5.39264207109239      1.81285444081378
  N   -2.84761347274523     -6.00664185586884      2.73141595112719
  C   -4.01471129494858     -6.52328877969776      1.94608624421827
  C   -5.28625388745115     -6.24173431017974      2.70947907910740
  N   -5.28385600051791     -4.86197274676992      3.19735479126344
  Mo  -3.48329015943829     -4.29452925943840      4.10831954208633
  N   -2.32730800246795     -5.62298839709168      5.36497480234414
  C   -1.43553213679138     -6.53474619722304      4.65585417332536
  C   -2.23359820927329     -7.11013640603174      3.51071743667618
  H   -1.10277558527257     -7.35667842114250      5.30790023150140
  H   -0.52350562622990     -6.02204800858773      4.29697548295007
  H   -3.05319594432161     -7.71637841401199      3.91999081758359
  H   -1.61983375063563     -7.74852649669849      2.85276309578264
  H   -6.15682668753701     -6.45902872870616      2.07816778674756
  H   -5.35591414637040     -6.90076094213735      3.59671774080397
  H   -4.06291589629141     -5.99512287347047      0.99157764729259
  H   -3.87693767079478     -7.59780175480539      1.74897018463680
  H   -1.58430779313631     -3.56061538924469      0.77164723958431
  H   -3.19646471738833     -4.25907652461005      0.53183971430733
  H   -0.93378667179653     -5.21103366996311      2.37682629297448
  H   -1.62521009151708     -6.08489433670641      0.98523437094036
  C   -3.14202904706128     -1.96088383745868      2.11670405311616
  C   -2.92936649084016     -1.43242433348354      0.81471576620975
  C   -3.04345993116690     -0.08926791802466      0.48946160591208
  C   -2.82228476958193      0.28602915564288     -0.92896612459980
  O   -2.39863340918950     -0.50178825012462     -1.77135418008269
  C   -3.41845682975067      0.85286840243525      1.50662596939960
  C   -3.50536340725228      2.31091992399453      1.35055815300102
  O   -3.18084448407262      2.97442582757845      0.37287612538559
  C   -3.70604863438360      0.35662146378858      2.76653916481667
  C   -3.60709044154293     -1.01238258933569      3.11828686562628
  C   -4.03355766938197     -1.35976096540426      4.41426619658101
  O   -4.08018842582902     -2.56063190720108      4.88518630308961
  C   -6.41142159391262     -4.10942023394924      3.04225560497128
  C   -6.82191694460484     -3.23387502103043      4.08295218964317
  C   -8.02847302530657     -2.54609327675263      4.08394684743127
  C   -8.25886956679969     -1.74127637499460      5.30533588334388
  O   -9.22694240559402     -1.04290632915747      5.56654690561834
  C   -8.93296630470035     -2.67828205067370      2.98215106483699
  C   -10.24694938696614     -2.01773171707502      2.88366100677843
  O   -11.02210070950428     -2.20048535717737      1.94505045263058
  C   -8.50303560540730     -3.46241027498090      1.91457070372457
  C   -7.27244795874116     -4.13585623663971      1.87498139879004
  C   -6.88466769193517     -4.57541121272787      0.53573500902434
  O   -5.77513966150741     -4.95347919772970      0.15738581726864
  C   -2.09999523926532     -5.40462157664295      6.67257446130223
  C   -0.87858380231830     -5.77056677412222      7.31825163418551
  C   -0.61040854254954     -5.44878413404663      8.63574362863254
  C   0.70548095109056     -5.90507994023923      9.18511704767957
  O   1.69006406390703     -6.06815087670068      8.48074711962028
  C   -1.59022208454320     -4.78605136172847      9.44092837515386
  C   -1.33979905012569     -4.32468052743756     10.80424921787051
  O   -0.24629714516279     -4.30321548001919     11.36288293184896
  C   -2.83131786309488     -4.52564276952185      8.86477614591658
  C   -3.10458452597268     -4.79783466496923      7.51721687168745
  C   -4.45261157824837     -4.70711651803781      7.04830591203730
  O   -4.81278361439476     -4.84790555263076      5.85959592963890
  H   -2.67853471542229     -2.08916987574559     -0.01599517537311
  H   -3.07154956092194      1.33152462377283     -1.19694042880056
  H   -3.90581489924292      2.81912885592807      2.26558325000473
  H   -4.03183672214903      1.05564237096490      3.54294948642508
  H   -4.41663530809642     -0.57128100596659      5.07535161899317
  H   -6.19678825143504     -3.16697158958748      4.96875280061087
  H   -7.40705162927588     -1.81443936206957      6.03079901208752
  H   -10.51055350588005     -1.33199166569783      3.71346688823118
  H   -9.14944420316594     -3.50370069319876      1.03281274081086
  H   -7.71237117679570     -4.46680721994022     -0.20675460712821
  H   -0.08930976524817     -6.27519259998234      6.76212069559842
  H   0.72462793815834     -6.13195701157761     10.27042529041802
  H   -2.25426715600212     -3.95545266020315     11.33225652173182
  H   -3.62158841420236     -4.08090643464778      9.47769471385125
  H   -5.24185737893444     -4.57704852972530      7.81429665237292
  N   -1.45307034470152     -3.16245606628761      4.72155197570019
  H   -0.59203062914380     -3.62448908712494      4.41932425989363
  H   -1.37395594606577     -3.01788011900098      5.73285702717302
  H   -1.45519885074233     -2.23629867328314      4.28480899498328
