98
Coordinates from ORCA-job orca
  N   -3.18731409998095     -0.35290592252226      4.81744119817405
  Mo  -3.90400288001676      1.54044951680157      5.33841163685024
  N   -4.81919816794888      1.27438058430498      7.09679801140930
  C   -4.06832618777563      0.92818558858294      8.29930804816456
  C   -2.77138588389765      0.27913825378314      7.87126224597779
  N   -2.18699982487367      1.08848013666953      6.76262244071868
  C   -1.18222118855018      0.32314500576034      5.99206430384502
  C   -1.88939499195114     -0.80789656483936      5.29332110490059
  C   -1.57286869622410      2.33783807176831      7.29758795321841
  C   -1.65103407765917      3.36722769637591      6.18943907953131
  N   -3.00491652486437      3.30645924605321      5.68930313467787
  H   -1.23826459756338     -1.18297368303318      4.47751371793881
  H   -2.00827700498597     -1.67195845171375      5.97998086226418
  H   -0.73766118933601      1.01367852267855      5.26247361744508
  H   -0.38018137446729     -0.04410896521154      6.65656117998293
  H   -1.40400448942114      4.37042678359382      6.57180973085409
  H   -0.91547709025708      3.14077830122914      5.39306966396538
  H   -2.18128361367994      2.67876490544911      8.14391049039103
  H   -0.55003014645961      2.12534317646539      7.65246140540157
  H   -4.64466498318664      0.21944449384073      8.92355441658080
  H   -3.89196455695900      1.82016854718863      8.92440220614853
  H   -2.97102679833649     -0.72577479916194      7.48376509291213
  H   -2.04841175286273      0.20336379579276      8.70081651026261
  C   0.01420624843181      0.93300014424235     -1.67283197133314
  C   -1.48769936263655      0.80119784967954     -1.61907406558786
  O   -2.17278545933921      1.20419882871626     -2.55948573804491
  C   -2.16270290537259      0.18389612129127     -0.42816662929249
  C   -3.55823296731865      0.06330997944344     -0.50017677548420
  C   -4.32309165049733     -0.48889230747122      0.52770268657728
  O   -5.65272120722983     -0.61156316744256      0.36286641411434
  C   -3.67968930166092     -0.88291132770755      1.74091719914467
  C   -4.49324882587988     -1.36623398528131      2.85250533755800
  O   -5.68432664711817     -1.71250048710486      2.65581968033240
  C   -3.94981837613256     -1.48036833239064      4.27992884281086
  C   -2.27267192554382     -0.79067282805031      1.79869264727675
  C   -1.51597909039463     -0.29152513291937      0.74572587978923
  O   -0.14530353403261     -0.23899749543406      0.83800541893512
  C   -9.52070944869117      9.22480734384980      4.88695792168462
  C   -9.47771336950395      7.85358814669476      4.26755762204010
  O   -10.47069542432892      7.46055545743999      3.58798211169063
  C   -8.33126068327040      6.99005551811270      4.47179095083457
  C   -7.20363984447465      7.39208860728301      5.22810589770549
  C   -6.13198367398913      6.54955507834977      5.44837994148355
  O   -5.04874139532223      6.93862024964253      6.19837330945314
  C   -6.13804103560983      5.21941011785427      4.92320421386878
  C   -5.10698326083856      4.26677671833024      5.19532853623049
  O   -5.26835194795661      3.03601140924059      4.81834556387255
  C   -3.80276662132899      4.50192978298969      5.87695935643789
  C   -7.26092995225606      4.81784445613198      4.15727506855580
  C   -8.33098412734641      5.66811502530662      3.91813132082237
  O   -9.37655668010935      5.22969050825184      3.18909821004621
  C   -12.14260556547313      6.13426186254625      6.31065882494337
  C   -10.90154032148178      6.50715597343432      7.09517643367148
  O   -10.82471969552961      7.64039131322482      7.58161681904518
  C   -9.78778395271452      5.53356135691524      7.28281317712796
  C   -8.70644500188141      5.98831574184370      8.05950464153740
  C   -7.58193898782864      5.21428440439305      8.30667433240203
  O   -6.57525814384962      5.73506255804268      9.04280022203785
  C   -7.50134365874102      3.89343314915668      7.75619763267032
  C   -6.28997732646933      3.11402669835405      7.95483349083747
  O   -5.32407578847146      3.58053107748822      8.61877401681955
  C   -6.17799293241937      1.69685311755638      7.37470451871004
  C   -8.59151203822818      3.43227449156494      6.99090344480863
  C   -9.71207185835091      4.21623872888411      6.74426382066956
  O   -10.67325215948456      3.62009109056538      5.97236793107887
  H   0.38500061096593      1.53767348707926     -0.83273439562674
  H   0.28793620989208      1.40066409796464     -2.62504132997421
  H   0.49779085653782     -0.04976570262906     -1.57816942892500
  H   -4.05294426058064      0.40564447602449     -1.40975904451915
  H   -5.96685212724452     -1.10906602791348      1.18765591147071
  H   -4.82608911282433     -1.72685003608269      4.90341840562108
  H   -3.31387986592604     -2.38671437558373      4.29687452294127
  H   -1.75247338257206     -1.14166944863621      2.69058672558646
  H   0.11559352443024     -0.65713952131455      1.67859353258238
  H   -9.59783792989395      9.13601629451776      5.98270806137249
  H   -8.61617008982316      9.80613930463075      4.65762581022029
  H   -10.40287538482274      9.75675913613341      4.51424084343999
  H   -7.18478088517548      8.38868963036476      5.67417600776652
  H   -5.26223326625160      7.78928772055024      6.62253363444260
  H   -3.29548590077694      5.40091434348581      5.48376263450370
  H   -3.99080327648413      4.70335982089340      6.95327900678535
  H   -7.29534238717775      3.80578293341994      3.75629710958342
  H   -10.01631164181341      6.02843771669619      3.17490755127901
  H   -11.89826202924649      6.00109954451161      5.24101852588160
  H   -12.61568547462883      5.21897829608422      6.69974776406424
  H   -12.85937769693427      6.96034669126495      6.37741541222131
  H   -8.75996052614352      6.99840169463011      8.46570068839486
  H   -5.87004997271479      5.00644796852234      9.04631776428949
  H   -6.77724615307975      1.64056864607171      6.46125279128218
  H   -6.65919577213250      1.01951386209790      8.11153413272038
  H   -8.57919754349505      2.44286073173085      6.53598023667532
  H   -11.29587140978149      4.28933495202789      5.63822885441114
  N   -3.03196836567886      2.08911776328337      3.17642264778105
  H   -3.74057290965026      2.64087955515789      2.68473595673816
  H   -2.81111531387380      1.27881869941812      2.58841062882240
  H   -2.19818106197229      2.67725154553297      3.23523081875941
  N   -5.66572614769351      0.71151668348520      4.43891800077149
  N   -6.72112729149967      0.43414943370445      4.18899290913825
