71
Coordinates from ORCA-job /scratch/magstr/orcajob__5670654-hqPU/orca
  N   -2.92726366315174     -3.47383501362560      1.89415591238233
  C   -2.85078102536009     -4.06081274890865      0.61410435319683
  C   -2.43101482399696     -5.66463161041697      0.87741286658384
  N   -3.27624585758816     -6.24824327040328      1.98811316707210
  C   -4.31488416749801     -7.23449158465090      1.53022646507086
  C   -5.47736149653205     -7.19093583401508      2.52442309239647
  N   -5.89438775079633     -5.79548098938661      2.77070575399171
  Mo  -4.42510501784492     -4.32618349366143      3.12479894693984
  N   -2.85439631673062     -4.94760778272559      4.29845618252224
  C   -1.77786469212878     -5.81903494273582      3.83680838212736
  C   -2.39934280239791     -6.90116853878241      2.97962082905217
  H   -1.27886852985853     -6.28820488460200      4.69654767749627
  H   -1.01941039509308     -5.24500675254753      3.27444940456557
  H   -3.01269694453585     -7.55754641125041      3.61026369172096
  H   -1.62737234644525     -7.51612340232607      2.48843832587665
  H   -6.32611986583438     -7.75714067307966      2.11529182557371
  H   -5.17109151365024     -7.66159375895651      3.47675765312038
  H   -4.71939677250824     -6.93702334261059      0.56081120462725
  H   -3.86506504501916     -8.23405105102365      1.43318941719018
  H   -2.15464679408281     -3.48412605559850     -0.02802069712566
  H   -3.99933900761687     -3.96548362976847      0.04649089958159
  H   -1.38789615720650     -5.61740240339197      1.20902364119024
  H   -2.48173832634216     -6.30455711423419     -0.02150792070019
  C   -1.92903295724090     -2.58548969067173      2.25853926382724
  C   -0.64173633911766     -2.63290570144443      1.67482741852991
  C   0.34713866532818     -1.72925051908243      2.03491915470131
  C   0.08414237554825     -0.74337218868401      2.99649225162756
  C   -1.17390289651109     -0.66004259923652      3.57054387748260
  C   -2.20683520448002     -1.55661101273327      3.21887242699477
  C   -3.52622351543615     -1.45515779864362      3.79360187726280
  O   -4.26279611338223     -2.52321648406834      3.93471224140714
  C   -4.15528847848905     -0.22569424916990      4.23398797349177
  F   -5.36107280756669     -0.48098679476699      4.82162636622103
  S   -3.68063701493019      1.32513854407061      4.03844292754856
  C   -7.18974492486145     -5.53226219768597      3.14669070121582
  C   -7.95004213477079     -6.54625033717654      3.77809598077569
  C   -9.23393123624298     -6.31344307311449      4.23760447998688
  C   -9.83007405583353     -5.05340911346953      4.07408884577277
  C   -9.13574110916217     -4.04786985239787      3.42888490684596
  C   -7.82304583680312     -4.23940053158159      2.92833575134922
  C   -7.14317395183713     -3.19662227836258      2.18164288975851
  O   -5.86735043100917     -3.20718420933788      2.04702364457277
  C   -7.80541043579784     -2.11499904742814      1.42964017808657
  F   -9.16152380897770     -2.17295594333573      1.43608394815932
  S   -7.04823651517727     -0.94312012639256      0.59101497408214
  C   -2.59206425298568     -4.24779826612277      5.48191821766499
  C   -1.26227800862624     -4.01235175080106      5.88805668305203
  C   -0.96478125482762     -3.24387844934299      7.00781348429871
  C   -1.99182371870153     -2.68725189091456      7.77675515033388
  C   -3.31150467923772     -2.93601307266434      7.42987645356788
  C   -3.65251475579912     -3.73237890749507      6.31650194234276
  C   -5.03260109508954     -4.09567036283745      6.04656493797567
  O   -5.40707881379673     -4.51200027207349      4.87848917940908
  C   -6.09873776416023     -4.14876797501620      7.05363714163577
  F   -7.29178307229408     -4.42100454142585      6.45361768921781
  S   -6.05195330781817     -4.00287744496612      8.67456013311061
  H   -0.39951335201500     -3.41114713311478      0.95115412175819
  H   1.33616735653435     -1.80591579386873      1.58095011891333
  H   0.86876691430782     -0.05201028579565      3.30507721388786
  H   -1.36823291997457      0.08380002226370      4.33858274975969
  H   -7.48738841222820     -7.51278159037244      3.97244458921842
  H   -9.77033442459423     -7.10912408683430      4.75731443560900
  H   -10.82974830566133     -4.86169676974987      4.46396623121819
  H   -9.60016404357770     -3.07125817462526      3.32791880475017
  H   -0.44010768890593     -4.38616087859635      5.28074470266907
  H   0.07886011227282     -3.05444003612710      7.26383545070112
  H   -1.76453456386187     -2.05798557646298      8.63840995979959
  H   -4.11231829232733     -2.49333635719650      8.01570047881424
  N   -4.65288231375992     -4.76582350650139      0.91586204187963
  H   -5.46780468578221     -4.54203556104018      0.31345696951245
  H   -3.86984261812060     -5.26024984490278      0.37630396474676
