69
Coordinates from ORCA-job /scratch/magstr/orcajob__5670644-ClTQ/orca
  N   -3.85766264697285     -4.75190548931061      1.71567730225593
  C   -4.10548521704868     -5.92467025478492      0.92483791454198
  C   -3.04824896185742     -7.00556644977160      1.24467968491767
  N   -2.87947373527539     -7.21522855793656      2.66595540659906
  C   -3.80891377639830     -8.07720649857680      3.35854347558203
  C   -4.43607757720421     -7.40509989853233      4.59956604783584
  N   -4.97597448160742     -6.11182440083972      4.27153687834189
  Mo  -4.11423713595920     -4.28120683583860      3.75355252865280
  N   -2.30177346195049     -4.93668055838848      4.50671118092300
  C   -1.34181733009436     -5.47253594654464      3.53882510892693
  C   -1.57781500318309     -6.96621352180706      3.24690837651023
  H   -0.30417185604810     -5.30945805461315      3.87462181026411
  H   -1.44400215781166     -4.90882946079584      2.60351572864930
  H   -1.49691946089887     -7.53732682353496      4.18499616926357
  H   -0.76428319684294     -7.32608327599598      2.58473985484781
  H   -5.20658752155956     -8.07101254014446      5.02360136812470
  H   -3.66770451401022     -7.27444425175582      5.37595930277950
  H   -4.61685207764810     -8.33308409984597      2.65601256587687
  H   -3.34079690899854     -9.03233952903112      3.67788168693970
  H   -4.10417098337717     -5.70468018936894     -0.15645334238232
  H   -5.10945801311952     -6.30827354471787      1.16992731743407
  H   -2.08157726733295     -6.67929547071056      0.83016361356443
  H   -3.32367427485840     -7.94254060764394      0.72038269275582
  C   -3.24765204397104     -3.63092365569735      1.31761458522200
  C   -2.80653303489955     -3.20181972335450      0.04626786371917
  C   -2.19790047213969     -1.95828535244596     -0.05315235432880
  C   -2.02285072510213     -1.16239420327640      1.08746564827672
  C   -2.47389264974256     -1.63580318651577      2.32496986364283
  C   -2.24044363702179     -0.85754211546067      3.54658851022556
  O   -2.42582333222555     -1.22278895635881      4.69946981992468
  C   -1.66072473885130      0.55653995006200      3.37799177904456
  O   -0.52265755579655      0.86377912546677      3.22330446416918
  Br  -3.09478024718793      1.92229446838304      3.67285078154496
  N   -3.09378175929405     -2.83504734240388      2.43551500610163
  C   -6.25346667381592     -5.87847967674919      3.93080384038223
  C   -7.42412658478563     -6.64592166774411      4.14167116729205
  C   -8.65349770972745     -6.03952150318521      3.92648017462379
  C   -8.72315640498426     -4.71168443895684      3.48508982529020
  C   -7.52773734668390     -4.04731010592023      3.19649392126425
  C   -7.57539434485048     -2.67502890896639      2.64646267733805
  O   -8.50981594978894     -1.90351131622580      2.78264297355568
  C   -6.42999882490988     -2.26954996191055      1.69813495034997
  O   -6.09320353037273     -2.88425165806973      0.73305806703900
  Br  -5.79475421091139     -0.40220039363721      2.03336772808216
  N   -6.32587025301960     -4.62823654769832      3.36666617970648
  C   -2.05792791656028     -5.18360971505979      5.83300327940020
  C   -0.84662228073877     -5.76876883389757      6.31975693450747
  C   -0.68327292703867     -6.01406005903910      7.67425792369631
  C   -1.70811351628342     -5.69615183480615      8.56921826480873
  C   -2.85105396628494     -5.12010640903590      8.01413161696780
  C   -3.99384012426791     -4.73051824705255      8.86610609846971
  O   -4.12062927070633     -4.90243121515589     10.06331466833093
  C   -5.11168782989470     -3.97320487651554      8.11692877960028
  O   -5.22451669592536     -2.79017021419276      8.04650060241163
  Br  -6.54528685065747     -5.22095628821074      7.51726994020378
  N   -3.03809632702743     -4.86646357787619      6.71127476807326
  H   -2.95472210971161     -3.83403208330776     -0.82811024486925
  H   -1.85123810041743     -1.59802181755927     -1.02259271022467
  H   -1.52675011338079     -0.19651478484569      1.01593410218909
  H   -7.35400875366779     -7.66622442233288      4.51614658659011
  H   -9.57248600495486     -6.59587038083984      4.11804581557359
  H   -9.67012007397978     -4.20019871066152      3.32438424391011
  H   -0.03806144109749     -6.02500843422290      5.63863460280981
  H   0.24726373556493     -6.45763838448668      8.03266538987185
  H   -1.64148729198417     -5.87644300104124      9.64108089853635
  N   -4.73601089698245     -3.04144722555345      4.87291273910679
  N   -5.41654004624289     -1.98314479930441      5.19444922350958
  H   -5.44482540203260     -1.74797514609469      6.18967456524885
  H   -5.47325720558661     -1.21295010775065      4.51905076560505
