88
Coordinates from ORCA-job /scratch/magstr/orcajob__5668032-u2OE/orca
  N   -2.94797455605899     -4.08183290532797      2.71511078308115
  C   -2.77899763678480     -4.91686989420908      1.53287839290907
  C   -2.21494228087992     -6.22269852760625      2.02609755962211
  N   -3.09530725442385     -6.70189363508383      3.12642425886532
  C   -4.34259569411686     -7.27713943342704      2.53882805493595
  C   -5.52225020619934     -6.99145626848268      3.43568617232457
  N   -5.48473082085155     -5.58549847134771      3.81594063735347
  Mo  -3.62486720695590     -4.89135344958313      4.38466565950945
  N   -1.88493902303375     -5.63190026638384      5.06206123053362
  C   -1.30056244069277     -6.93350243363325      4.75750218354680
  C   -2.35645804703128     -7.69633053565732      3.95068380232264
  H   -1.07999204423436     -7.49237848750954      5.67989403543668
  H   -0.35007730444847     -6.83160662791941      4.20903976058141
  H   -3.06873001811573     -8.18273191806207      4.62190291671083
  H   -1.91079633055978     -8.45950135815565      3.29476669141855
  H   -6.44598590995786     -7.22900135561641      2.88929521855752
  H   -5.53147000284009     -7.65981003980274      4.31756738523066
  H   -4.50901270126781     -6.79286918113861      1.57077212817743
  H   -4.20630453656277     -8.35409025265001      2.36195155362612
  H   -2.09542800427570     -4.45918723699229      0.80234596464552
  H   -3.74765834126597     -5.05215078064197      1.01649013010143
  H   -1.22049517813178     -6.03439953190845      2.44335226034722
  H   -2.13842780037461     -6.99549083227395      1.24721805855577
  C   -2.73031463285879     -2.64585924635098      2.41463411638203
  C   -3.97404460355842     -2.08399059808709      1.66687423716732
  C   -3.95927186298626     -0.59847880310194      1.49005488110346
  S   -4.02985231470883      0.17492093306436      0.04613727018507
  C   -3.94360107596041      0.25224627407156      2.71351025342952
  O   -3.96696222255851     -0.19878623326400      3.84821066881055
  C   -1.41613478835178     -2.41284706823626      1.66968514429097
  C   -1.38670695002356     -2.08567537458180      0.31112569237819
  C   -0.17369675795464     -1.94555125047071     -0.36488898114149
  C   1.03562381337916     -2.14076607416313      0.29178387370962
  C   0.99404664802752     -2.47557767382050      1.63813774796990
  F   2.16010972056480     -2.68146368544404      2.30175576753684
  C   -0.19669218356608     -2.61001962931833      2.33497428349090
  C   -6.78995471436037     -4.95970671358773      4.12454841264953
  C   -7.02793279221456     -3.75506690173936      3.19195991133460
  C   -6.79517293228910     -2.45620668726002      3.91621853457173
  S   -7.69099730567019     -1.08426463242638      3.69443354846749
  C   -5.67683239300742     -2.42030014080764      4.82630601245928
  O   -4.79185178868702     -3.32132742605738      4.83359645601523
  C   -7.94993397324280     -5.93569897167730      4.18154621426726
  C   -8.24077876411708     -6.55449098727834      5.40199645445666
  C   -9.27973291239016     -7.47838122865079      5.49833443407898
  C   -10.04659683872987     -7.80387019506988      4.38071885716834
  C   -9.74666602333827     -7.17538175269198      3.17932546544504
  F   -10.48176941749944     -7.47528629258075      2.07889519618102
  C   -8.72084021906818     -6.24821092332822      3.05538217395779
  C   -1.58750706582111     -4.88037405337674      6.19737454955031
  C   -2.51125441722450     -5.02799861911593      7.42809933180806
  C   -3.91827548029879     -5.24298064320689      6.98289132278543
  S   -4.45967706205673     -6.61997965918046      6.17224257897387
  C   -4.92106191319196     -4.33284032423984      7.58036778038700
  O   -6.12956742440738     -4.49218175538767      7.60632271152957
  C   -0.15444626121702     -4.57826548620603      6.47238806297565
  C   0.73681639611485     -4.49604946698168      5.39084912881531
  C   2.07077706577608     -4.16026803085083      5.59557209844564
  C   2.54120220320218     -3.89853172022599      6.88123324056391
  C   1.64686067350216     -3.98270435939459      7.94046094824455
  F   2.09199315265127     -3.74278610633847      9.19408790310627
  C   0.31013433827275     -4.31204157865165      7.76700595914324
  H   -2.68668277805107     -2.10406144858510      3.36650550320447
  H   -4.82961423119507     -2.33043653076978      2.30619556373222
  H   -4.11936883479661     -2.57790873008718      0.70010670387787
  H   -3.92657434846759      1.34366652806135      2.51258824525299
  H   -2.31359752169350     -1.93664386597752     -0.23620492175299
  H   -0.17191245750684     -1.68133192628461     -1.42028969754184
  H   1.99098708932942     -2.03678317664667     -0.21687966071625
  H   -0.15886657663263     -2.87744526539689      3.38182315952335
  H   -6.71590729586949     -4.57675133025193      5.15483836209213
  H   -6.33217164183498     -3.81707518346351      2.33637937331155
  H   -8.03699799357654     -3.75713856186832      2.76689662963965
  H   -5.58268806604701     -1.56123825502205      5.50105134062705
  H   -7.64673089387027     -6.30267668084487      6.27878264124601
  H   -9.50272483200526     -7.94516366493634      6.45563573517310
  H   -10.86538816732686     -8.51759874029009      4.43142483612572
  H   -8.54128566733833     -5.79129366684109      2.08404779872159
  H   -2.72713069976264     -3.08881199863132      6.32950739178383
  H   -2.16781673895753     -5.91276555894877      7.98846752430880
  H   -2.41873060269296     -4.17503627170582      8.11266352196130
  H   -4.43909507292850     -3.44754696089185      8.12632742313452
  H   0.36475474243114     -4.68212647982835      4.38602879453222
  H   2.75460441148510     -4.09570521394907      4.75266286818410
  H   3.57910251964716     -3.63441383653540      7.06929060718053
  H   -0.33560786622477     -4.37822352065513      8.63766475834799
  N   -2.37602876131068     -3.59340512122735      5.53688066781748
  H   -1.85558729587097     -3.07538302899321      4.83864474914430
