97
Coordinates from ORCA-job orca
  N   -3.59335824782659      3.30009649224019      4.41028889771735
  Mo  -4.19216498609059      1.56822627234608      5.18469224639430
  N   -5.39094947306188      1.47403779777808      6.77054581024117
  C   -4.85589609258835      1.86521090898045      8.06939317992561
  C   -3.65558244454150      2.77790373077249      7.87152173729306
  N   -2.80152683483943      2.25520929794297      6.77444415907003
  C   -1.94471361092251      3.31798057038543      6.18948958790481
  C   -2.77289801893955      4.17489448438862      5.24332303449506
  C   -2.01489782503240      1.05525678865368      7.16569434419098
  C   -1.67139807663261      0.23972102336802      5.92536299851905
  N   -2.86013888415648      0.11112654587900      5.08208691580371
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  H   -3.38307471501801      4.90466605358198      5.81194029121437
  H   -1.15291205865309      2.81774670774800      5.61582285874534
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  H   -5.61940539879286      2.39931736565051      8.66869235790036
  H   -4.56482562999617      0.97837895528215      8.66819176467241
  H   -4.00000238993097      3.77304985140279      7.55768648309192
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  C   -2.19646842565577     -0.30557567717503      2.72058618504805
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  N   -4.19283115056419     -0.55029266355772      0.26078675485529
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  N   -5.31466920148986      0.50513858861709     -1.58303599624192
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  C   -4.00860342992057      1.36093932906467     -3.42470287845112
  C   -2.76573527522336      1.56109912027032     -3.98654140355735
  C   -1.61586086746922      1.11411030391106     -3.29523208456610
  N   -1.64919002372170      0.50212980490189     -2.11936575931390
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  C   -6.54895809597076      0.59330273847856      6.86697400281441
  C   -6.25404248193945     -0.76290654472958      7.53784294555423
  C   -7.22366370213263     -1.84830898645321      7.11139385294177
  O   -6.88406206547512     -2.23621291060391      5.74905918803783
  C   -7.82924390324332     -2.24131564027047      4.80719259606005
  N   -9.08394735316995     -1.93904880771027      5.08298179479340
  C   -9.97047357604644     -1.96428284466750      4.05407341226792
  N   -9.73722107614550     -2.26076336110299      2.79186240066239
  C   -8.43595809762426     -2.56349546185838      2.48949328005450
  C   -8.06404601408853     -2.86272699341149      1.15761162663895
  C   -6.74762013967989     -3.16896765285867      0.88965069539017
  C   -5.81345887181549     -3.18457624391771      1.95094362748031
  N   -6.11645596495718     -2.90399016762095      3.20949499444367
  C   -7.40762788386447     -2.58695250758533      3.47306470232808
  H   -3.06968470526199      4.27650738495389      2.61835606218420
  H   -4.39646248232722      3.10416852768849      2.49074688250196
  H   -4.60949620578102      5.80250606570803      3.95625925986379
  H   -5.12465439397025      5.52158193940686      2.28770132643709
  H   -7.00910565501676      5.39327831341256      4.02922576510061
  H   -6.23124452513228      3.91470772785581      4.66369526779342
  H   -9.83534206538912      1.99349584320405      5.44744236654405
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  H   -8.07478036646935      1.60909188474684     -1.27471458129609
  H   -2.08522166721944     -1.71947592452280      4.37708446518831
  H   -3.73012175140584     -1.33231306805444      3.83664450198243
  H   -1.23249638917445      0.19850713928304      2.89109404340212
  H   -2.91331149595787      0.45595269348710      2.37939115962369
  H   -2.92392451535625     -2.02824432541560      1.62229330393212
  H   -1.13655788465213     -1.96039486159515      1.76439180249490
  H   -6.23825662504060     -0.27011663126026      0.09087868783613
  H   -4.93017408235466      1.68608885193387     -3.91003595530188
  H   -2.65626574109691      2.05800415100392     -4.95170419319408
  H   -0.62477357696786      1.26906412333085     -3.73282641854613
  H   -6.92678591074460      0.42048367860940      5.85044815293841
  H   -7.36333055494494      1.10367700667877      7.42054064356157
  H   -5.23124478790808     -1.07880185156238      7.27159763565933
  H   -6.29401240371205     -0.68095500566615      8.63535335459660
  H   -8.27039402895621     -1.51967639573479      7.14570295453393
  H   -7.10997701859915     -2.75634706593876      7.72095813560897
  H   -10.99768964689621     -1.70010544422464      4.31956434056033
  H   -8.82964220976185     -2.83773001317294      0.38064929468238
  H   -6.41497124868733     -3.39601454900726     -0.12424072606303
  H   -4.76902183998464     -3.43650402076713      1.74645618886415
  N   -5.39575370514146      0.90054234265018      3.79447264155539
  N   -6.10077621192062      0.46323163650485      3.00044385612011
