75
Coordinates from ORCA-job orca E -7353.258782278488
  N      -3.299990     -4.104629      1.780195
  C      -3.805971     -4.923889      0.696654
  C      -4.047198     -6.320856      1.264270
  N      -3.179782     -6.455892      2.441457
  C      -3.472423     -7.712695      3.169925
  C      -4.047856     -7.352752      4.542140
  N      -4.658109     -6.052812      4.369625
  Mo     -3.595202     -4.570232      3.642811
  N      -1.859007     -5.276228      4.195996
  C      -0.974374     -6.036384      3.330942
  C      -1.752913     -6.408094      2.069950
  H      -0.641960     -6.934242      3.864955
  H      -0.094407     -5.434414      3.076987
  H      -1.427249     -7.377057      1.678720
  H      -1.577574     -5.661649      1.293727
  H      -4.771792     -8.105491      4.856570
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  H      -3.094947     -4.962130     -0.134012
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  H      -3.813416     -7.090374      0.519731
  H      -5.088489     -6.437036      1.586035
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  C      -2.383500     -2.492724      0.129391
  C      -1.766638     -1.277312     -0.038991
  C      -1.465885     -0.462349      1.058583
  C      -1.749645     -0.882868      2.334449
  C      -2.315720     -2.152338      2.541662
  N      -2.714241     -2.643529      3.748529
  C      -2.208023     -2.084639      4.856416
  C      -0.859435     -1.720137      5.069671
  O      -0.379068     -1.064248      5.960904
  Cl      0.283872     -2.552045      3.950826
  C      -5.918643     -5.829973      4.810057
  C      -6.736010     -6.674983      5.579240
  C      -8.020413     -6.287734      5.882295
  C      -8.534345     -5.074283      5.419524
  C      -7.746495     -4.216940      4.685565
  C      -6.420284     -4.567983      4.397857
  N      -5.522678     -3.818240      3.666224
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  C      -5.398691     -1.741090      2.431255
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  Cl     -5.633406      0.024200      2.736555
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  C      -0.170902     -5.439020      5.985639
  C       0.128735     -5.152284      7.292352
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  C      -2.051452     -4.198174      7.652830
  C      -2.415018     -4.538626      6.334732
  N      -3.605301     -4.253288      5.746051
  C      -4.668710     -3.915364      6.484581
  C      -4.999503     -4.499897      7.734761
  O      -4.572023     -5.461593      8.310211
  Cl     -6.441770     -3.651290      8.442770
  H      -2.655799     -3.064241     -0.741288
  H      -1.539946     -0.926673     -1.033690
  H      -1.029768      0.511791      0.900591
  H      -1.571633     -0.234903      3.180755
  H      -2.861130     -1.933994      5.717978
  H      -6.367494     -7.617258      5.949393
  H      -8.644805     -6.936482      6.476619
  H      -9.556260     -4.807456      5.637750
  H      -8.161533     -3.296931      4.305485
  H      -6.442411     -2.024602      4.268364
  H       0.584869     -5.871797      5.352651
  H       1.106249     -5.389709      7.682103
  H      -0.523285     -4.234590      9.125438
  H      -2.748483     -3.655222      8.269629
  H      -5.370178     -3.204046      6.080453
  N      -5.018756     -5.389362      2.286559
  N      -5.853863     -5.869892      1.490934
  H      -6.009521     -5.452235      0.573381
  H      -6.403506     -6.693387      1.736531
75
Coordinates from ORCA-job orca E -7353.354311571699
  N      -3.278384     -4.098048      1.755542
  C      -3.779298     -4.921624      0.666586
  C      -4.037993     -6.328120      1.240188
  N      -3.163733     -6.466278      2.434276
  C      -3.458426     -7.723200      3.173169
  C      -4.039215     -7.359177      4.550878
  N      -4.662924     -6.060890      4.381676
  Mo     -3.591904     -4.571761      3.634679
  N      -1.845701     -5.284837      4.197759
  C      -0.957328     -6.048207      3.333474
  C      -1.730189     -6.420267      2.069117
  H      -0.627413     -6.947324      3.870646
  H      -0.073892     -5.447357      3.081848
  H      -1.402048     -7.391874      1.680970
  H      -1.552838     -5.675029      1.291275
  H      -4.760149     -8.115031      4.870797
  H      -3.252021     -7.292532      5.316321
  H      -4.192677     -8.308111      2.610315
  H      -2.554759     -8.325729      3.288765
  H      -3.056728     -4.960434     -0.159579
  H      -4.701017     -4.464729      0.282630
  H      -3.800914     -7.102137      0.493197
  H      -5.115418     -6.452805      1.561105
  C      -2.654097     -2.943860      1.403957
  C      -2.343363     -2.490703      0.104237
  C      -1.722477     -1.273990     -0.064686
  C      -1.428198     -0.454381      1.035746
  C      -1.722352     -0.872732      2.313142
  C      -2.292711     -2.143298      2.520003
  N      -2.698868     -2.636694      3.731533
  C      -2.189530     -2.076695      4.848330
  C      -0.838300     -1.710293      5.082226
  O      -0.380243     -1.052860      5.989774
  Cl      0.343673     -2.531171      3.979862
  C      -5.922800     -5.835491      4.827754
  C      -6.734178     -6.682323      5.605396
  C      -8.021950     -6.297421      5.917123
  C      -8.541858     -5.084170      5.453544
  C      -7.757038     -4.224277      4.709859
  C      -6.430722     -4.572117      4.414415
  N      -5.539331     -3.808600      3.669007
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  C      -5.496878     -1.701873      2.437057
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  Cl     -5.777234      0.057782      2.773071
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  C      -0.161626     -5.449695      5.998994
  C       0.137346     -5.163673      7.310952
  C      -0.796855     -4.517964      8.137740
  C      -2.048256     -4.205559      7.665095
  C      -2.409612     -4.544778      6.344470
  N      -3.606984     -4.253964      5.749511
  C      -4.679940     -3.910763      6.483587
  C      -5.025990     -4.496319      7.733628
  O      -4.602306     -5.464744      8.313714
  Cl     -6.474455     -3.637938      8.432724
  H      -2.612526     -3.067647     -0.768068
  H      -1.488128     -0.926051     -1.062398
  H      -0.988459      0.521915      0.878284
  H      -1.548438     -0.221720      3.160960
  H      -2.849117     -1.927478      5.704555
  H      -6.358227     -7.625344      5.976321
  H      -8.642450     -6.948507      6.519173
  H      -9.566107     -4.817549      5.678106
  H      -8.176764     -3.302925      4.328900
  H      -6.491049     -2.030694      4.291434
  H       0.596586     -5.884318      5.364214
  H       1.117060     -5.403379      7.703432
  H      -0.519404     -4.244146      9.147044
  H      -2.747901     -3.660655      8.282379
  H      -5.376549     -3.195566      6.072736
  N      -5.039216     -5.387030      2.269667
  N      -5.930608     -5.857682      1.455406
  H      -6.093424     -5.433668      0.534278
  H      -6.498575     -6.679393      1.699335
75
Coordinates from ORCA-job orca E -7353.425446624190
  N      -3.262459     -4.087625      1.729958
  C      -3.758234     -4.918679      0.638947
  C      -4.032322     -6.331767      1.218139
  N      -3.150972     -6.474464      2.427891
  C      -3.446417     -7.731948      3.176557
  C      -4.031318     -7.368465      4.560703
  N      -4.670295     -6.074136      4.397307
  Mo     -3.592543     -4.574084      3.628666
  N      -1.833086     -5.293049      4.202580
  C      -0.942379     -6.057455      3.336135
  C      -1.712198     -6.428383      2.068845
  H      -0.613364     -6.958238      3.874297
  H      -0.056228     -5.457105      3.085988
  H      -1.381751     -7.401773      1.682126
  H      -1.535491     -5.683084      1.290087
  H      -4.747692     -8.129377      4.884783
  H      -3.238589     -7.298838      5.321132
  H      -4.178387     -8.322608      2.613594
  H      -2.537570     -8.329763      3.293755
  H      -3.024773     -4.956619     -0.182324
  H      -4.676712     -4.462839      0.242729
  H      -3.791880     -7.108966      0.469146
  H      -5.145043     -6.465545      1.535980
  C      -2.633985     -2.930569      1.382265
  C      -2.317389     -2.478767      0.081951
  C      -1.696330     -1.258260     -0.084910
  C      -1.408866     -0.436117      1.019864
  C      -1.710019     -0.856219      2.297968
  C      -2.280607     -2.129374      2.501420
  N      -2.691135     -2.627772      3.716145
  C      -2.179852     -2.068220      4.840259
  C      -0.828004     -1.697305      5.088871
  O      -0.390614     -1.039884      6.010514
  Cl      0.385142     -2.501000      3.991591
  C      -5.929463     -5.843695      4.846532
  C      -6.736173     -6.690885      5.631836
  C      -8.027158     -6.307416      5.950215
  C      -8.551456     -5.094486      5.484411
  C      -7.768869     -4.232723      4.731391
  C      -6.443154     -4.578207      4.429835
  N      -5.555357     -3.803093      3.672540
  C      -5.873758     -2.485734      3.548854
  C      -5.525754     -1.701663      2.428674
  O      -5.154794     -2.039206      1.318736
  Cl     -5.805701      0.068535      2.752034
  C      -1.424873     -5.127275      5.492200
  C      -0.154798     -5.458590      6.013550
  C       0.142971     -5.173093      7.330262
  C      -0.794704     -4.527094      8.156224
  C      -2.048556     -4.213599      7.678798
  C      -2.406545     -4.551543      6.356326
  N      -3.610384     -4.255885      5.757723
  C      -4.687959     -3.908756      6.490302
  C      -5.041762     -4.496710      7.741273
  O      -4.617040     -5.470100      8.321690
  Cl     -6.493822     -3.631357      8.439121
  H      -2.583058     -3.059712     -0.792549
  H      -1.457139     -0.909863     -1.084757
  H      -0.968779      0.543702      0.864758
  H      -1.540875     -0.204048      3.148731
  H      -2.843850     -1.924803      5.693442
  H      -6.353540     -7.634161      6.004451
  H      -8.644493     -6.959833      6.559557
  H      -9.577724     -4.827236      5.713953
  H      -8.192174     -3.310385      4.348880
  H      -6.511884     -2.017960      4.295782
  H       0.605848     -5.893958      5.376873
  H       1.124952     -5.413968      7.724925
  H      -0.519667     -4.252798      9.169331
  H      -2.751427     -3.667975      8.296658
  H      -5.381276     -3.190017      6.076039
  N      -5.066812     -5.387859      2.249195
  N      -6.013284     -5.842252      1.420108
  H      -6.182128     -5.411718      0.501381
  H      -6.596899     -6.656752      1.659861
75
Coordinates from ORCA-job orca E -7353.478316546848
  N      -3.242744     -4.078580      1.703992
  C      -3.731340     -4.918198      0.612695
  C      -4.023402     -6.332993      1.197223
  N      -3.138850     -6.480865      2.420426
  C      -3.436523     -7.737512      3.178895
  C      -4.023674     -7.376001      4.568540
  N      -4.675958     -6.087143      4.412246
  Mo     -3.592776     -4.576549      3.621420
  N      -1.821146     -5.300798      4.208161
  C      -0.929225     -6.065584      3.339311
  C      -1.696270     -6.434820      2.068717
  H      -0.601233     -6.968024      3.877791
  H      -0.040373     -5.466355      3.090533
  H      -1.364079     -7.409626      1.683153
  H      -1.520452     -5.689161      1.289514
  H      -4.735252     -8.142120      4.896133
  H      -3.225177     -7.304659      5.323410
  H      -4.166113     -8.332643      2.615311
  H      -2.523388     -8.331042      3.297648
  H      -2.985890     -4.957377     -0.201301
  H      -4.645520     -4.464758      0.201861
  H      -3.779778     -7.113392      0.447911
  H      -5.171254     -6.474438      1.509152
  C      -2.609476     -2.920978      1.362334
  C      -2.283492     -2.471394      0.062516
  C      -1.662163     -1.248197     -0.100896
  C      -1.384223     -0.423114      1.007551
  C      -1.695075     -0.843298      2.285164
  C      -2.266432     -2.117891      2.484645
  N      -2.682446     -2.619679      3.700097
  C      -2.171300     -2.063316      4.830411
  C      -0.820142     -1.690822      5.093324
  O      -0.401440     -1.036885      6.027561
  Cl      0.419144     -2.479718      3.998929
  C      -5.931929     -5.850639      4.864358
  C      -6.733360     -6.697652      5.657165
  C      -8.025871     -6.315622      5.983505
  C      -8.554173     -5.103225      5.517266
  C      -7.774877     -4.240538      4.755423
  C      -6.451076     -4.584036      4.446451
  N      -5.571824     -3.797923      3.677933
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  C      -5.579590     -1.701226      2.424309
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  Cl     -5.869853      0.076255      2.742265
  C      -1.420696     -5.133666      5.503027
  C      -0.151791     -5.467133      6.027117
  C       0.144025     -5.181456      7.347054
  C      -0.796505     -4.534197      8.171151
  C      -2.051270     -4.219444      7.689091
  C      -2.405655     -4.556716      6.365576
  N      -3.613361     -4.256053      5.764634
  C      -4.692748     -3.903797      6.494675
  C      -5.053992     -4.492634      7.746364
  O      -4.629653     -5.468533      8.326671
  Cl     -6.508280     -3.618756      8.442217
  H      -2.543463     -3.056425     -0.813831
  H      -1.415807     -0.900229     -1.101759
  H      -0.943598      0.559329      0.855005
  H      -1.532402     -0.189717      3.138257
  H      -2.839833     -1.926410      5.680575
  H      -6.343994     -7.640803      6.030130
  H      -8.639076     -6.969035      6.599997
  H      -9.581272     -4.834907      5.752862
  H      -8.201208     -3.317135      4.372579
  H      -6.536785     -2.015366      4.311002
  H       0.610737     -5.903738      5.389540
  H       1.127419     -5.423462      7.743922
  H      -0.524182     -4.258859      9.187153
  H      -2.756484     -3.672578      8.306782
  H      -5.382002     -3.181582      6.076456
  N      -5.096342     -5.389942      2.222783
  N      -6.092793     -5.822676      1.382434
  H      -6.265387     -5.385127      0.468319
  H      -6.691228     -6.626745      1.616966
75
Coordinates from ORCA-job orca E -7353.517645909115
  N      -3.225115     -4.070661      1.681092
  C      -3.703982     -4.919566      0.590511
  C      -4.013239     -6.332034      1.179612
  N      -3.129015     -6.485259      2.412929
  C      -3.429260     -7.740331      3.180120
  C      -4.016630     -7.382893      4.574176
  N      -4.680111     -6.100307      4.426466
  Mo     -3.594620     -4.579543      3.615118
  N      -1.812166     -5.307203      4.214608
  C      -0.919668     -6.070927      3.343010
  C      -1.683824     -6.438014      2.069151
  H      -0.591926     -6.974932      3.880776
  H      -0.028700     -5.472665      3.095462
  H      -1.349805     -7.413413      1.683852
  H      -1.509421     -5.691224      1.290450
  H      -4.722843     -8.154944      4.903645
  H      -3.212682     -7.311115      5.323621
  H      -4.156331     -8.338522      2.615093
  H      -2.512636     -8.330071      3.299755
  H      -2.946584     -4.960597     -0.214822
  H      -4.614216     -4.471096      0.163971
  H      -3.766854     -7.115230      0.431108
  H      -5.195238     -6.481098      1.483840
  C      -2.589670     -2.912959      1.346564
  C      -2.255129     -2.464485      0.047810
  C      -1.636218     -1.238053     -0.111730
  C      -1.369206     -0.410130      0.999435
  C      -1.688524     -0.830566      2.275930
  C      -2.258251     -2.106992      2.471577
  N      -2.677611     -2.612056      3.686270
  C      -2.168164     -2.060385      4.821552
  C      -0.818817     -1.685571      5.096854
  O      -0.416011     -1.037191      6.041818
  Cl      0.442205     -2.457479      4.000502
  C      -5.932429     -5.857275      4.880422
  C      -6.729462     -6.703981      5.679619
  C      -8.022289     -6.323610      6.013181
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  C      -7.778810     -4.248513      4.778521
  C      -6.456665     -4.589907      4.462172
  N      -5.586513     -3.795291      3.685178
  C      -5.923904     -2.475424      3.560528
  C      -5.607757     -1.714185      2.417389
  O      -5.256622     -2.069810      1.301876
  Cl     -5.893285      0.075258      2.718187
  C      -1.419841     -5.139161      5.512264
  C      -0.151862     -5.474756      6.038620
  C       0.142622     -5.188644      7.360159
  C      -0.799626     -4.539832      8.182713
  C      -2.054504     -4.223968      7.697502
  C      -2.406570     -4.560802      6.373483
  N      -3.616349     -4.255613      5.772209
  C      -4.695175     -3.897984      6.499778
  C      -5.062558     -4.486677      7.752535
  O      -4.639017     -5.462874      8.332978
  Cl     -6.518038     -3.603745      8.446108
  H      -2.508190     -3.053499     -0.829902
  H      -1.383662     -0.890052     -1.112854
  H      -0.930201      0.575087      0.849259
  H      -1.533322     -0.175580      3.130860
  H      -2.840405     -1.932407      5.669797
  H      -6.333969     -7.646630      6.052298
  H      -8.631200     -6.977894      6.635765
  H      -9.581422     -4.842461      5.788873
  H      -8.207864     -3.324420      4.396311
  H      -6.549120     -2.009077      4.321919
  H       0.611597     -5.912500      5.400211
  H       1.127123     -5.431465      7.758215
  H      -0.529271     -4.263213      9.200572
  H      -2.760797     -3.675873      8.315294
  H      -5.380485     -3.172873      6.077805
  N      -5.129963     -5.394529      2.194125
  N      -6.171037     -5.800804      1.346551
  H      -6.346120     -5.354972      0.438382
  H      -6.783263     -6.593290      1.575604
75
Coordinates from ORCA-job orca E -7353.547477792421
  N      -3.207767     -4.065199      1.661575
  C      -3.674113     -4.923474      0.572366
  C      -4.000410     -6.329457      1.165316
  N      -3.121378     -6.487778      2.405016
  C      -3.425096     -7.740730      3.179305
  C      -4.010513     -7.388791      4.576450
  N      -4.682043     -6.112338      4.438374
  Mo     -3.597091     -4.582775      3.609083
  N      -1.806028     -5.312160      4.221171
  C      -0.913407     -6.073791      3.347003
  C      -1.674321     -6.438354      2.069940
  H      -0.585444     -6.979290      3.883196
  H      -0.020720     -5.476533      3.100668
  H      -1.338516     -7.413618      1.684111
  H      -1.501172     -5.689735      1.292767
  H      -4.711333     -8.167024      4.906147
  H      -3.201601     -7.318181      5.320919
  H      -4.149779     -8.340239      2.611889
  H      -2.506140     -8.327875      3.299215
  H      -2.904602     -4.968141     -0.222550
  H      -4.579584     -4.481269      0.128614
  H      -3.752230     -7.115395      0.419013
  H      -5.214086     -6.485891      1.459865
  C      -2.570955     -2.908298      1.334551
  C      -2.226790     -2.461014      0.037266
  C      -1.611478     -1.231606     -0.118432
  C      -1.356908     -0.400288      0.994306
  C      -1.685050     -0.820071      2.269154
  C      -2.252410     -2.098181      2.461542
  N      -2.674409     -2.605367      3.674254
  C      -2.167718     -2.059131      4.813349
  C      -0.820678     -1.682396      5.098952
  O      -0.429228     -1.041321      6.052785
  Cl      0.456506     -2.438590      3.997168
  C      -5.930425     -5.863217      4.894131
  C      -6.723659     -6.710007      5.698510
  C      -8.015625     -6.331425      6.039440
  C      -8.550669     -5.119402      5.576243
  C      -7.779541     -4.255873      4.802060
  C      -6.458967     -4.595426      4.477726
  N      -5.599332     -3.794474      3.694551
  C      -5.939856     -2.475495      3.568822
  C      -5.634818     -1.730726      2.411912
  O      -5.293971     -2.098557      1.298225
  Cl     -5.914939      0.070207      2.696491
  C      -1.421590     -5.143818      5.519718
  C      -0.154360     -5.481814      6.048396
  C       0.139241     -5.194860      7.370184
  C      -0.803738     -4.543707      8.191277
  C      -2.057901     -4.226555      7.703894
  C      -2.408807     -4.563345      6.379617
  N      -3.618755     -4.253914      5.779181
  C      -4.695735     -3.890144      6.503791
  C      -5.069102     -4.477042      7.757935
  O      -4.647481     -5.451857      8.340140
  Cl     -6.525394     -3.584357      8.447013
  H      -2.471557     -3.054157     -0.841217
  H      -1.352406     -0.884063     -1.119132
  H      -0.920495      0.587323      0.846005
  H      -1.538322     -0.163371      3.125170
  H      -2.842575     -1.941075      5.660671
  H      -6.322637     -7.652158      6.069500
  H      -8.620070     -6.986722      6.666897
  H      -9.577208     -4.849228      5.823789
  H      -8.210667     -3.330841      4.422006
  H      -6.555283     -2.004950      4.336210
  H       0.609206     -5.920938      5.409523
  H       1.124387     -5.438360      7.768816
  H      -0.534695     -4.265467      9.210004
  H      -2.764090     -3.676862      8.321723
  H      -5.377130     -3.162978      6.077564
  N      -5.165888     -5.402051      2.162320
  N      -6.244212     -5.777139      1.312124
  H      -6.419969     -5.321678      0.410649
  H      -6.869147     -6.557642      1.535881
75
Coordinates from ORCA-job orca E -7353.570946321658
  N      -3.192534     -4.062211      1.646316
  C      -3.643949     -4.929494      0.558496
  C      -3.985599     -6.326299      1.154829
  N      -3.116180     -6.489092      2.397235
  C      -3.423967     -7.740019      3.176445
  C      -4.005779     -7.394363      4.575498
  N      -4.682192     -6.122890      4.447563
  Mo     -3.600309     -4.586221      3.603944
  N      -1.802865     -5.315737      4.227594
  C      -0.910203     -6.074630      3.351330
  C      -1.667385     -6.436521      2.071308
  H      -0.581547     -6.981550      3.885326
  H      -0.016156     -5.478280      3.106206
  H      -1.329727     -7.411028      1.684182
  H      -1.494899     -5.685458      1.296701
  H      -4.701576     -8.178729      4.903762
  H      -3.192722     -7.326414      5.315915
  H      -4.146607     -8.339162      2.605763
  H      -2.503790     -8.326058      3.295809
  H      -2.862719     -4.979153     -0.225116
  H      -4.544158     -4.494429      0.096778
  H      -3.737204     -7.115207      0.411579
  H      -5.226965     -6.490331      1.438900
  C      -2.555654     -2.906010      1.326182
  C      -2.202415     -2.459762      0.030343
  C      -1.592264     -1.227192     -0.122350
  C      -1.350668     -0.391920      0.990859
  C      -1.686636     -0.810691      2.264015
  C      -2.250296     -2.090831      2.454239
  N      -2.673457     -2.599488      3.664751
  C      -2.169998     -2.058313      4.806710
  C      -0.825418     -1.679155      5.100565
  O      -0.441184     -1.045933      6.061578
  Cl      0.463714     -2.420947      3.991392
  C      -5.927354     -5.868712      4.905091
  C      -6.717737     -6.716314      5.712958
  C      -8.008278     -6.339641      6.060596
  C      -8.545885     -5.126668      5.601411
  C      -7.778684     -4.262551      4.824238
  C      -6.459091     -4.600418      4.492165
  N      -5.609330     -3.795429      3.705414
  C      -5.948906     -2.477446      3.577637
  C      -5.650609     -1.750050      2.407260
  O      -5.317071     -2.130048      1.297259
  Cl     -5.921087      0.062469      2.675349
  C      -1.424943     -5.147787      5.525797
  C      -0.158084     -5.488460      6.056493
  C       0.135500     -5.200339      7.377548
  C      -0.807232     -4.546119      8.197631
  C      -2.060314     -4.227480      7.709152
  C      -2.411486     -4.564576      6.384717
  N      -3.620411     -4.251319      5.785951
  C      -4.694998     -3.881015      6.507690
  C      -5.073754     -4.464747      7.763639
  O      -4.654523     -5.437124      8.349353
  Cl     -6.530776     -3.562619      8.446514
  H      -2.438310     -3.057240     -0.848304
  H      -1.327518     -0.880317     -1.122382
  H      -0.918226      0.598076      0.843636
  H      -1.548802     -0.151976      3.120451
  H      -2.846244     -1.950828      5.654123
  H      -6.312019     -7.658213      6.081146
  H      -8.608695     -6.996289      6.691326
  H      -9.571341     -4.855799      5.854801
  H      -8.211133     -3.336278      4.447495
  H      -6.553595     -1.999610      4.349415
  H       0.604809     -5.929227      5.417189
  H       1.121092     -5.444422      7.776077
  H      -0.538525     -4.265994      9.216418
  H      -2.765380     -3.675819      8.327126
  H      -5.373036     -3.152835      6.077093
  N      -5.203760     -5.413517      2.128770
  N      -6.311376     -5.753157      1.281492
  H      -6.486470     -5.286611      0.386962
  H      -6.947788     -6.522503      1.500765
75
Coordinates from ORCA-job orca E -7353.590420638056
  N      -3.179499     -4.061587      1.635142
  C      -3.614296     -4.937015      0.548043
  C      -3.968777     -6.323605      1.147455
  N      -3.112831     -6.490029      2.389742
  C      -3.425217     -7.739349      3.171641
  C      -4.002555     -7.399706      4.571616
  N      -4.680899     -6.131395      4.453637
  Mo     -3.603809     -4.589606      3.599630
  N      -1.802195     -5.318253      4.233584
  C      -0.909217     -6.074406      3.356122
  C      -1.661985     -6.433756      2.073321
  H      -0.579766     -6.982638      3.887779
  H      -0.013960     -5.478933      3.112381
  H      -1.322465     -7.407129      1.684471
  H      -1.489140     -5.679926      1.302049
  H      -4.694226     -8.189543      4.897315
  H      -3.186318     -7.335571      5.309082
  H      -4.146327     -8.336727      2.597112
  H      -2.504860     -8.325856      3.289796
  H      -2.822015     -4.992527     -0.223962
  H      -4.508914     -4.509183      0.068184
  H      -3.722039     -7.115981      0.407699
  H      -5.232487     -6.495523      1.421214
  C      -2.543217     -2.905696      1.320746
  C      -2.181556     -2.460773      0.026190
  C      -1.577339     -1.225070     -0.124655
  C      -1.348570     -0.385316      0.988102
  C      -1.691405     -0.802667      2.259739
  C      -2.250654     -2.084976      2.448947
  N      -2.673935     -2.594362      3.657545
  C      -2.173643     -2.056939      4.801373
  C      -0.831424     -1.674786      5.101080
  O      -0.450719     -1.048842      6.067396
  Cl      0.465969     -2.404399      3.983707
  C      -5.923747     -5.873611      4.913291
  C      -6.712022     -6.722778      5.722932
  C      -8.000881     -6.347810      6.076691
  C      -8.540241     -5.132941      5.622900
  C      -7.776232     -4.267862      4.844769
  C      -6.457262     -4.604503      4.505378
  N      -5.616081     -3.797464      3.717118
  C      -5.952945     -2.480155      3.587057
  C      -5.661394     -1.767905      2.404690
  O      -5.335652     -2.157155      1.297446
  Cl     -5.923039      0.054632      2.659997
  C      -1.429106     -5.151312      5.530952
  C      -0.162465     -5.495011      6.063390
  C       0.131763     -5.205539      7.383199
  C      -0.809993     -4.547604      8.202610
  C      -2.061792     -4.227149      7.713705
  C      -2.414194     -4.564770      6.389133
  N      -3.621304     -4.248032      5.792243
  C      -4.693546     -3.871124      6.511358
  C      -5.077016     -4.450715      7.769267
  O      -4.660295     -5.420155      8.359808
  Cl     -6.534946     -3.540300      8.444834
  H      -2.408532     -3.062771     -0.852082
  H      -1.307705     -0.879221     -1.124017
  H      -0.920872      0.606969      0.841122
  H      -1.562403     -0.141695      3.116062
  H      -2.850008     -1.959645      5.649745
  H      -6.302574     -7.664908      6.087271
  H      -8.598028     -7.006128      6.709155
  H      -9.564391     -4.861481      5.881828
  H      -8.209022     -3.339770      4.472310
  H      -6.546291     -1.994092      4.362734
  H       0.599224     -5.937768      5.423721
  H       1.117614     -5.450284      7.781294
  H      -0.540826     -4.265506      9.220936
  H      -2.765127     -3.673156      8.331780
  H      -5.368996     -3.142909      6.076462
  N      -5.242332     -5.429092      2.093640
  N      -6.370722     -5.729644      1.255298
  H      -6.543829     -5.250866      0.367868
  H      -7.017179     -6.489167      1.470988
75
Coordinates from ORCA-job orca E -7353.607537326396
  N      -3.169165     -4.062833      1.627672
  C      -3.586578     -4.945343      0.540149
  C      -3.950628     -6.322243      1.142334
  N      -3.110769     -6.491321      2.382812
  C      -3.428057     -7.739512      3.165492
  C      -4.000855     -7.404798      4.565627
  N      -4.678695     -6.137664      4.456782
  Mo     -3.607372     -4.592714      3.596239
  N      -1.803482     -5.320013      4.238995
  C      -0.909701     -6.073911      3.361443
  C      -1.657404     -6.431136      2.076026
  H      -0.579600     -6.983239      3.891070
  H      -0.013288     -5.479283      3.119317
  H      -1.316063     -7.403231      1.685386
  H      -1.483146     -5.674536      1.308454
  H      -4.689645     -8.198954      4.888215
  H      -3.182451     -7.345155      5.301258
  H      -4.148191     -8.334152      2.586932
  H      -2.508400     -8.327833      3.282054
  H      -2.784231     -5.006653     -0.220620
  H      -4.475508     -4.524549      0.042875
  H      -3.707313     -7.118576      0.406116
  H      -5.230518     -6.502280      1.407045
  C      -2.534061     -2.906566      1.317593
  C      -2.165267     -2.463253      0.024030
  C      -1.567471     -1.224441     -0.126235
  C      -1.350711     -0.379915      0.985375
  C      -1.699016     -0.795669      2.255849
  C      -2.253229     -2.080273      2.445157
  N      -2.675587     -2.589877      3.652515
  C      -2.178115     -2.054595      4.797355
  C      -0.838053     -1.668953      5.100886
  O      -0.458422     -1.049036      6.070833
  Cl      0.465143     -2.388942      3.975913
  C      -5.920218     -5.877885      4.918882
  C      -6.707026     -6.729237      5.728624
  C      -7.994301     -6.355633      6.087581
  C      -8.534535     -5.138162      5.639980
  C      -7.772747     -4.271675      4.862639
  C      -6.454094     -4.607550      4.516891
  N      -5.619354     -3.800073      3.728795
  C      -5.952386     -2.482878      3.596146
  C      -5.666606     -1.782877      2.404171
  O      -5.347048     -2.178184      1.298776
  Cl     -5.920580      0.047959      2.650763
  C      -1.433451     -5.154492      5.535503
  C      -0.166999     -5.501448      6.069231
  C       0.128450     -5.210534      7.387603
  C      -0.811745     -4.548482      8.206648
  C      -2.062269     -4.225931      7.717826
  C      -2.416557     -4.564228      6.393192
  N      -3.621534     -4.244356      5.798112
  C      -4.691593     -3.861130      6.515198
  C      -5.078768     -4.436125      7.775085
  O      -4.664280     -5.402556      8.370978
  Cl     -6.537542     -3.518936      8.443506
  H      -2.383824     -3.069793     -0.853447
  H      -1.294057     -0.879828     -1.125115
  H      -0.928319      0.614614      0.837859
  H      -1.578331     -0.132305      3.111656
  H      -2.853646     -1.966572      5.647250
  H      -6.294906     -7.672098      6.088478
  H      -8.589177     -7.015841      6.720352
  H      -9.557394     -4.866263      5.903823
  H      -8.204932     -3.341282      4.494972
  H      -6.534910     -1.988309      4.374846
  H       0.593143     -5.946488      5.429221
  H       1.114451     -5.456068      7.785068
  H      -0.541426     -4.264458      9.224195
  H      -2.763554     -3.669359      8.335926
  H      -5.365278     -3.133572      6.076484
  N      -5.280964     -5.448168      2.057678
  N      -6.421755     -5.707118      1.234392
  H      -6.592015     -5.215251      0.354066
  H      -7.076749     -6.458448      1.447332
75
Coordinates from ORCA-job orca E -7353.623216919146
  N      -3.161526     -4.065456      1.623430
  C      -3.561449     -4.953865      0.534147
  C      -3.931680     -6.322590      1.138409
  N      -3.109500     -6.493342      2.376560
  C      -3.431887     -7.740754      3.158484
  C      -4.000571     -7.409541      4.558211
  N      -4.675946     -6.141776      4.457410
  Mo     -3.610851     -4.595362      3.593792
  N      -1.806202     -5.321270      4.243819
  C      -0.911093     -6.073596      3.367295
  C      -1.653234     -6.429212      2.079415
  H      -0.580636     -6.983754      3.895428
  H      -0.013543     -5.479775      3.127053
  H      -1.310149     -7.400014      1.687141
  H      -1.476739     -5.670023      1.315586
  H      -4.687879     -8.206592      4.877597
  H      -3.180907     -7.354755      5.292963
  H      -4.151573     -8.331999      2.575972
  H      -2.513667     -8.331957      3.273361
  H      -2.749998     -5.020147     -0.215993
  H      -4.444632     -4.539493      0.020769
  H      -3.692955     -7.123141      0.405568
  H      -5.221378     -6.510953      1.395766
  C      -2.527974     -2.908185      1.316330
  C      -2.153434     -2.466753      0.023484
  C      -1.562157     -1.224958     -0.127291
  C      -1.356225     -0.375622      0.982706
  C      -1.708619     -0.789700      2.252399
  C      -2.257498     -2.076578      2.442678
  N      -2.678104     -2.585993      3.649498
  C      -2.182897     -2.051267      4.794527
  C      -0.844726     -1.661697      5.099794
  O      -0.464422     -1.046255      6.071815
  Cl      0.462147     -2.374123      3.967720
  C      -5.916946     -5.881524      4.922273
  C      -6.702802     -6.735422      5.730711
  C      -7.988706     -6.362654      6.093945
  C      -8.528909     -5.142126      5.652942
  C      -7.768357     -4.273886      4.877698
  C      -6.449914     -4.609556      4.526715
  N      -5.619253     -3.802882      3.739910
  C      -5.948257     -2.485337      3.604525
  C      -5.667925     -1.794549      2.405356
  O      -5.353444     -2.192984      1.300677
  Cl     -5.916640      0.042766      2.646841
  C      -1.437671     -5.157454      5.539656
  C      -0.171483     -5.507814      6.074148
  C       0.125628     -5.215453      7.391086
  C      -0.812533     -4.549084      8.209991
  C      -2.061886     -4.224198      7.721628
  C      -2.418439     -4.563258      6.397063
  N      -3.621238     -4.240540      5.803578
  C      -4.689276     -3.851455      6.519282
  C      -5.079242     -4.421770      7.781001
  O      -4.666659     -5.385381      8.382204
  Cl     -6.538704     -3.499314      8.442965
  H      -2.364328     -3.077659     -0.852918
  H      -1.286028     -0.881714     -1.125913
  H      -0.939360      0.621041      0.834046
  H      -1.595457     -0.123932      3.107417
  H      -2.856784     -1.971405      5.646404
  H      -6.289112     -7.679466      6.085780
  H      -8.582327     -7.024793      6.725879
  H      -9.550555     -4.869857      5.921046
  H      -8.199085     -3.340809      4.515059
  H      -6.520916     -1.982751      4.385573
  H       0.586916     -5.955342      5.433857
  H       1.111695     -5.461923      7.787809
  H      -0.540519     -4.263269      9.226568
  H      -2.760978     -3.664895      8.339658
  H      -5.361884     -3.124972      6.077328
  N      -5.319359     -5.469439      2.021536
  N      -6.464333     -5.685884      1.218561
  H      -6.631195     -5.180315      0.345272
  H      -7.126513     -6.430713      1.429106
75
Coordinates from ORCA-job orca E -7353.637780393626
  N      -3.156572     -4.069020      1.621967
  C      -3.539263     -4.962190      0.529646
  C      -3.912354     -6.324743      1.134738
  N      -3.108726     -6.496242      2.371102
  C      -3.436396     -7.743092      3.150962
  C      -4.001637     -7.413975      4.549885
  N      -4.672943     -6.144037      4.456082
  Mo     -3.614164     -4.597426      3.592372
  N      -1.809818     -5.322199      4.248209
  C      -0.912970     -6.073691      3.373701
  C      -1.649318     -6.428187      2.083578
  H      -0.582500     -6.984410      3.900918
  H      -0.014296     -5.480646      3.135561
  H      -1.304572     -7.397739      1.689907
  H      -1.470057     -5.666666      1.323329
  H      -4.688892     -8.212426      4.866201
  H      -3.181473     -7.364325      5.284544
  H      -4.156165     -8.330410      2.564701
  H      -2.520259     -8.338066      3.264206
  H      -2.719465     -5.032072     -0.210450
  H      -4.416679     -4.553351      0.001710
  H      -3.678612     -7.129472      0.404996
  H      -5.205672     -6.521840      1.386331
  C      -2.524922     -2.910221      1.316673
  C      -2.146128     -2.470803      0.024257
  C      -1.561380     -1.226150     -0.127926
  C      -1.364946     -0.372122      0.980152
  C      -1.719975     -0.784561      2.249458
  C      -2.263266     -2.073681      2.441409
  N      -2.681283     -2.582665      3.648372
  C      -2.187692     -2.047212      4.792902
  C      -0.851083     -1.653574      5.098197
  O      -0.469057     -1.041292      6.071164
  Cl      0.457857     -2.360583      3.960023
  C      -5.914033     -5.884598      4.923910
  C      -6.699473     -6.741155      5.729862
  C      -7.984294     -6.368569      6.096385
  C      -8.523548     -5.144747      5.662061
  C      -7.763232     -4.274536      4.889887
  C      -6.445023     -4.610629      4.534956
  N      -5.616014     -3.805656      3.750156
  C      -5.941329     -2.487450      3.611759
  C      -5.665992     -1.803344      2.407510
  O      -5.355050     -2.202767      1.302797
  Cl     -5.911989      0.038830      2.646294
  C      -1.441466     -5.160266      5.543582
  C      -0.175636     -5.514129      6.078283
  C       0.123517     -5.220311      7.393861
  C      -0.812181     -4.549506      8.212801
  C      -2.060523     -4.222084      7.725215
  C      -2.419579     -4.562014      6.400902
  N      -3.620309     -4.236676      5.808779
  C      -4.686385     -3.842183      6.523728
  C      -5.078323     -4.407812      7.787168
  O      -4.667294     -5.368832      8.393403
  Cl     -6.538238     -3.481332      8.443505
  H      -2.350232     -3.085761     -0.850909
  H      -1.283645     -0.884297     -1.126533
  H      -0.953756      0.626581      0.829868
  H      -1.613420     -0.116437      3.103481
  H      -2.859330     -1.974484      5.647087
  H      -6.285374     -7.686774      6.080146
  H      -8.577667     -7.032531      6.726557
  H      -9.544095     -4.872077      5.933699
  H      -8.191759     -3.338507      4.532305
  H      -6.505374     -1.977626      4.394496
  H       0.580907     -5.964322      5.437806
  H       1.109597     -5.467863      7.789735
  H      -0.538012     -4.262031      9.228267
  H      -2.757328     -3.659923      8.343086
  H      -5.358465     -3.117038      6.079050
  N      -5.357601     -5.491403      1.986105
  N      -6.498842     -5.666304      1.206912
  H      -6.661936     -5.146510      0.340609
  H      -7.167275     -6.406305      1.414658
75
Coordinates from ORCA-job orca E -7353.651187168754
  N      -3.154115     -4.073101      1.622793
  C      -3.520168     -4.970072      0.526471
  C      -3.892892     -6.328636      1.130574
  N      -3.108168     -6.500071      2.366653
  C      -3.441384     -7.746491      3.143223
  C      -4.003970     -7.418296      4.541115
  N      -4.669905     -6.144938      4.453481
  Mo     -3.617073     -4.598845      3.592140
  N      -1.813576     -5.323051      4.252570
  C      -0.914850     -6.074508      3.380844
  C      -1.645509     -6.428205      2.088787
  H      -0.584774     -6.985596      3.907665
  H      -0.015006     -5.482301      3.144932
  H      -1.299231     -7.396603      1.693940
  H      -1.463186     -5.664638      1.331823
  H      -4.692592     -8.216677      4.854567
  H      -3.183916     -7.374122      5.276300
  H      -4.161858     -8.329313      2.553477
  H      -2.527923     -8.346052      3.254865
  H      -2.692512     -5.041802     -0.204032
  H      -4.391911     -4.565823     -0.014478
  H      -3.663751     -7.137202      0.403573
  H      -5.183975     -6.535220      1.377533
  C      -2.524743     -2.912361      1.318351
  C      -2.143237     -2.474840      0.026085
  C      -1.564949     -1.227444     -0.128124
  C      -1.376520     -0.369037      0.977914
  C      -1.732653     -0.780062      2.247199
  C      -2.270183     -2.071381      2.441267
  N      -2.684690     -2.579829      3.648978
  C      -2.191902     -2.042606      4.792330
  C      -0.856466     -1.644770      5.095926
  O      -0.472033     -1.034415      6.068884
  Cl      0.453007     -2.347876      3.952214
  C      -5.911478     -5.887174      4.924293
  C      -6.697161     -6.746258      5.726793
  C      -7.981201     -6.373097      6.095551
  C      -8.518566     -5.145896      5.667708
  C      -7.757442     -4.273656      4.899324
  C      -6.439597     -4.610886      4.541845
  N      -5.609941     -3.808168      3.759406
  C      -5.932541     -2.489196      3.617543
  C      -5.662121     -1.809883      2.409791
  O      -5.353417     -2.208953      1.304592
  Cl     -5.908714      0.035686      2.646966
  C      -1.444408     -5.163089      5.547617
  C      -0.179053     -5.520586      6.082093
  C       0.122390     -5.225311      7.396415
  C      -0.810482     -4.549938      8.215486
  C      -2.057945     -4.219757      7.728888
  C      -2.419603     -4.560684      6.405009
  N      -3.618422     -4.232878      5.813990
  C      -4.682623     -3.833420      6.528569
  C      -5.076080     -4.394387      7.793634
  O      -4.666360     -5.353026      8.404561
  Cl     -6.536487     -3.465004      8.444705
  H      -2.341522     -3.093361     -0.847829
  H      -1.286766     -0.886839     -1.126955
  H      -0.971083      0.631636      0.825695
  H      -1.631647     -0.109748      3.100157
  H      -2.860661     -1.976193      5.649200
  H      -6.283868     -7.693816      6.072531
  H      -8.575324     -7.038660      6.723204
  H      -9.538152     -4.872654      5.942070
  H      -8.183101     -3.334484      4.546672
  H      -6.489314     -1.973153      4.401456
  H       0.575594     -5.973650      5.441601
  H       1.108429     -5.474142      7.791386
  H      -0.533819     -4.260916      9.229755
  H      -2.752396     -3.654599      8.346506
  H      -5.354602     -3.109875      6.081399
  N      -5.395826     -5.512496      1.952445
  N      -6.526416     -5.648568      1.197967
  H      -6.685539     -5.113968      0.338663
  H      -7.200802     -6.385234      1.401563
75
Coordinates from ORCA-job orca E -7353.663322851995
  N      -3.153780     -4.077237      1.625244
  C      -3.504157     -4.977337      0.524583
  C      -3.873497     -6.334050      1.125531
  N      -3.107527     -6.504686      2.363504
  C      -3.446623     -7.750771      3.135640
  C      -4.007392     -7.422732      4.532408
  N      -4.667035     -6.145109      4.450312
  Mo     -3.619218     -4.599610      3.593211
  N      -1.816516     -5.324058      4.257392
  C      -0.916151     -6.076332      3.388890
  C      -1.641649     -6.429305      2.095322
  H      -0.586937     -6.987710      3.915712
  H      -0.015027     -5.485166      3.155151
  H      -1.294045     -7.396686      1.699454
  H      -1.456210     -5.663985      1.341238
  H      -4.698704     -8.219714      4.843184
  H      -3.187918     -7.384434      5.268601
  H      -4.168541     -8.328438      2.542728
  H      -2.536358     -8.355646      3.245578
  H      -2.668859     -5.048950     -0.196600
  H      -4.370403     -4.576897     -0.027960
  H      -3.647697     -7.145880      0.400967
  H      -5.156884     -6.551074      1.368297
  C      -2.527148     -2.914267      1.320947
  C      -2.144526     -2.478220      0.028545
  C      -1.572646     -1.228160     -0.128023
  C      -1.390624     -0.365847      0.976025
  C      -1.746206     -0.775894      2.245612
  C      -2.277783     -2.069422      2.442026
  N      -2.687708     -2.577388      3.651003
  C      -2.194817     -2.037762      4.792610
  C      -0.860117     -1.635880      5.093169
  O      -0.473012     -1.026587      6.065538
  Cl      0.448729     -2.336600      3.944700
  C      -5.909289     -5.889304      4.923829
  C      -6.696023     -6.750581      5.722140
  C      -7.979584     -6.376103      6.091996
  C      -8.514172     -5.145574      5.670156
  C      -7.751187     -4.271411      4.906073
  C      -6.433855     -4.610481      4.547518
  N      -5.601569     -3.810231      3.767564
  C      -5.922947     -2.490616      3.621570
  C      -5.657668     -1.814911      2.411262
  O      -5.350046     -2.213012      1.305485
  Cl     -5.908649      0.032817      2.646784
  C      -1.445948     -5.165973      5.552132
  C      -0.181172     -5.527209      6.086176
  C       0.122615     -5.230455      7.399344
  C      -0.807203     -4.550370      8.218540
  C      -2.053855     -4.217239      7.732990
  C      -2.418060     -4.559334      6.409695
  N      -3.615131     -4.229219      5.819544
  C      -4.677623     -3.825267      6.533839
  C      -5.072419     -4.381603      7.800505
  O      -4.663733     -5.337939      8.415825
  Cl     -6.533611     -3.450278      8.446250
  H      -2.338055     -3.099684     -0.844236
  H      -1.295254     -0.888476     -1.127312
  H      -0.991044      0.636785      0.821722
  H      -1.649616     -0.103672      3.097554
  H      -2.860129     -1.977087      5.652503
  H      -6.284701     -7.700379      6.063768
  H      -8.575396     -7.042999      6.716522
  H      -9.532971     -4.871483      5.946324
  H      -8.173437     -3.329009      4.558075
  H      -6.473812     -1.969500      4.406286
  H       0.571626     -5.983396      5.445927
  H       1.108547     -5.480785      7.793447
  H      -0.527877     -4.259879      9.231587
  H      -2.745937     -3.648951      8.350245
  H      -5.349866     -3.103671      6.084115
  N      -5.434159     -5.531372      1.921440
  N      -6.549454     -5.632758      1.189804
  H      -6.704849     -5.082770      0.337513
  H      -7.230180     -6.367256      1.387071
75
Coordinates from ORCA-job orca E -7353.674227394250
  N      -3.155051     -4.081085      1.628750
  C      -3.491058     -4.983829      0.524021
  C      -3.854398     -6.340602      1.119626
  N      -3.106544     -6.509817      2.361891
  C      -3.451906     -7.755652      3.128564
  C      -4.011592     -7.427467      4.524226
  N      -4.664390     -6.145165      4.447168
  Mo     -3.620211     -4.599849      3.595635
  N      -1.817804     -5.325490      4.263129
  C      -0.916404     -6.079453      3.397949
  C      -1.637605     -6.431487      2.103329
  H      -0.588599     -6.991170      3.925025
  H      -0.013811     -5.489697      3.166181
  H      -1.288975     -7.398006      1.706479
  H      -1.449162     -5.664693      1.351672
  H      -4.706710     -8.221955      4.832451
  H      -3.193039     -7.395440      5.261765
  H      -4.176114     -8.327412      2.532867
  H      -2.545295     -8.366473      3.236521
  H      -2.648142     -5.053379     -0.187955
  H      -4.352068     -4.586665     -0.038900
  H      -3.629756     -7.154932      0.397356
  H      -5.124981     -6.568545      1.357790
  C      -2.531659     -2.915722      1.324121
  C      -2.149501     -2.480499      0.031306
  C      -1.583910     -1.227876     -0.127711
  C      -1.406583     -0.362271      0.974531
  C      -1.759951     -0.771930      2.244693
  C      -2.285485     -2.067663      2.443476
  N      -2.689699     -2.575329      3.654118
  C      -2.195725     -2.032986      4.793466
  C      -0.861331     -1.627133      5.089635
  O      -0.471347     -1.018153      6.060898
  Cl      0.445642     -2.326007      3.936317
  C      -5.907346     -5.891044      4.922890
  C      -6.695959     -6.754039      5.716578
  C      -7.979296     -6.377636      6.086445
  C      -8.510403     -5.143953      5.669897
  C      -7.744641     -4.268131      4.910388
  C      -6.427924     -4.609620      4.552115
  N      -5.591529     -3.811804      3.774654
  C      -5.913510     -2.491860      3.623770
  C      -5.653960     -1.819076      2.411336
  O      -5.346586     -2.215990      1.305066
  Cl     -5.913361      0.029771      2.644595
  C      -1.445695     -5.169012      5.557492
  C      -0.181606     -5.534014      6.091218
  C       0.124327     -5.235703      7.403322
  C      -0.802396     -4.550763      8.222494
  C      -2.048216     -4.214587      7.737851
  C      -2.414733     -4.558090      6.415227
  N      -3.610171     -4.225890      5.825683
  C      -4.671323     -3.817961      6.539410
  C      -5.067624     -4.369694      7.807658
  O      -4.659721     -5.323670      8.427220
  Cl     -6.530273     -3.437342      8.447431
  H      -2.339424     -3.104202     -0.840547
  H      -1.308554     -0.888677     -1.127670
  H      -1.012901      0.642315      0.818134
  H      -1.666562     -0.098195      3.095788
  H      -2.856929     -1.977775      5.656813
  H      -6.287579     -7.706279      6.054658
  H      -8.577555     -7.045585      6.707429
  H      -9.528597     -4.868693      5.946944
  H      -8.163148     -3.322535      4.566657
  H      -6.459734     -1.966888      4.409085
  H       0.569486     -5.993582      5.451564
  H       1.110052     -5.487724      7.796738
  H      -0.520455     -4.258826      9.234350
  H      -2.738010     -3.643061      8.354569
  H      -5.344147     -3.098811      6.086737
  N      -5.472612     -5.547134      1.893479
  N      -6.570838     -5.618578      1.180429
  H      -6.723147     -5.052708      0.335203
  H      -7.258907     -6.351589      1.368622
75
Coordinates from ORCA-job orca E -7353.684171876926
  N      -3.157514     -4.084514      1.632965
  C      -3.480677     -4.989415      0.524747
  C      -3.836000     -6.347862      1.113091
  N      -3.105068     -6.515158      2.361852
  C      -3.457031     -7.760810      3.122256
  C      -4.016170     -7.432511      4.516909
  N      -4.661907     -6.145478      4.444384
  Mo     -3.619835     -4.599717      3.599354
  N      -1.817019     -5.327454      4.269962
  C      -0.915392     -6.083906      3.407899
  C      -1.633334     -6.434637      2.112635
  H      -0.589526     -6.996088      3.935365
  H      -0.011121     -5.495988      3.177799
  H      -1.283986     -7.400432      1.714736
  H      -1.442137     -5.666602      1.362951
  H      -4.715898     -8.223707      4.822668
  H      -3.198782     -7.407006      5.256024
  H      -4.184379     -8.325956      2.524232
  H      -2.554447     -8.378071      3.227869
  H      -2.630140     -5.055197     -0.178100
  H      -4.336790     -4.595179     -0.047476
  H      -3.609577     -7.163766      0.393113
  H      -5.088903     -6.586062      1.345476
  C      -2.537797     -2.916720      1.327668
  C      -2.157614     -2.481662      0.034156
  C      -1.598149     -1.226623     -0.127334
  C      -1.423838     -0.358329      0.973305
  C      -1.773419     -0.768170      2.244287
  C      -2.292867     -2.066100      2.445441
  N      -2.690291     -2.573736      3.658072
  C      -2.194325     -2.028692      4.794807
  C      -0.859837     -1.619112      5.085634
  O      -0.466928     -1.010024      6.055536
  Cl      0.444286     -2.316725      3.927606
  C      -5.905497     -5.892447      4.921719
  C      -6.696665     -6.756651      5.710681
  C      -7.979990     -6.377969      6.079585
  C      -8.507234     -5.141443      5.667417
  C      -7.738064     -4.264314      4.912491
  C      -6.421972     -4.608556      4.555656
  N      -5.580488     -3.813006      3.780652
  C      -5.904885     -2.493148      3.624115
  C      -5.651768     -1.822898      2.409694
  O      -5.344064     -2.218619      1.303087
  Cl     -5.923185      0.026180      2.639970
  C      -1.443511     -5.172165      5.563831
  C      -0.180196     -5.540780      6.097581
  C       0.127508     -5.240732      7.408699
  C      -0.796265     -4.550866      8.227582
  C      -2.041198     -4.211742      7.743539
  C      -2.409637     -4.556977      6.421632
  N      -3.603510     -4.223048      5.832410
  C      -4.663801     -3.811624      6.545097
  C      -5.061853     -4.358688      7.814949
  O      -4.654404     -5.310077      8.438799
  Cl     -6.526588     -3.425957      8.448008
  H      -2.345124     -3.106955     -0.836965
  H      -1.326008     -0.887499     -1.128164
  H      -1.036051      0.648191      0.814836
  H      -1.682043     -0.093309      3.094709
  H      -2.850864     -1.978809      5.661954
  H      -6.291874     -7.711357      6.045883
  H      -8.581181     -7.046708      6.696849
  H      -9.525012     -4.864771      5.944466
  H      -8.152794     -3.315743      4.572517
  H      -6.447617     -1.965474      4.409921
  H       0.569403     -6.003939      5.458908
  H       1.112916     -5.494503      7.801718
  H      -0.511931     -4.257414      9.238301
  H      -2.728912     -3.636934      8.359469
  H      -5.337465     -3.095461      6.088964
  N      -5.511287     -5.559134      1.868644
  N      -6.592835     -5.605372      1.168317
  H      -6.742690     -5.023315      0.330244
  H      -7.289627     -6.337023      1.344454
75
Coordinates from ORCA-job orca E -7353.693553352216
  N      -3.160879     -4.087613      1.637724
  C      -3.472803     -4.994123      0.526569
  C      -3.818867     -6.355559      1.106268
  N      -3.103005     -6.520442      2.363259
  C      -3.461688     -7.765905      3.117020
  C      -4.020662     -7.437650      4.510777
  N      -4.659476     -6.146112      4.442164
  Mo     -3.618167     -4.599313      3.604207
  N      -1.814254     -5.329877      4.277783
  C      -0.913197     -6.089387      3.418407
  C      -1.628874     -6.438504      2.122802
  H      -0.589666     -7.002162      3.946315
  H      -0.007108     -5.503645      3.189649
  H      -1.278994     -7.403675      1.723795
  H      -1.435313     -5.669430      1.374638
  H      -4.725405     -8.225098      4.814190
  H      -3.204614     -7.418594      5.251608
  H      -4.192834     -8.324029      2.517198
  H      -2.563347     -8.389833      3.220041
  H      -2.614771     -5.054853     -0.167322
  H      -4.324411     -4.602568     -0.053925
  H      -3.587258     -7.172067      0.388729
  H      -5.049366     -6.602084      1.331249
  C      -2.545014     -2.917460      1.331524
  C      -2.168013     -2.482022      0.037092
  C      -1.614293     -1.224807     -0.126828
  C      -1.441432     -0.354400      0.972414
  C      -1.786036     -0.764873      2.244385
  C      -2.299636     -2.064884      2.447842
  N      -2.689491     -2.572741      3.662666
  C      -2.190716     -2.025115      4.796498
  C      -0.855819     -1.611846      5.080986
  O      -0.459874     -1.002159      6.049199
  Cl      0.444361     -2.307734      3.917616
  C      -5.903585     -5.893513      4.920594
  C      -6.697630     -6.758435      5.705132
  C      -7.981091     -6.377417      6.072365
  C      -8.504506     -5.138511      5.663507
  C      -7.731737     -4.260470      4.912810
  C      -6.416214     -4.607500      4.558212
  N      -5.569201     -3.813977      3.785502
  C      -5.897573     -2.494629      3.622752
  C      -5.651597     -1.826586      2.406414
  O      -5.343318     -2.221160      1.299563
  Cl     -5.937630      0.021936      2.633290
  C      -1.439634     -5.175408      5.571036
  C      -0.177178     -5.547392      6.105217
  C       0.131824     -5.245514      7.415451
  C      -0.789282     -4.550841      8.233782
  C      -2.033272     -4.208972      7.749966
  C      -2.403143     -4.556144      6.428751
  N      -3.595486     -4.220861      5.839482
  C      -4.655475     -3.806372      6.550578
  C      -5.055657     -4.348773      7.821947
  O      -4.648464     -5.297404      8.450149
  Cl     -6.523005     -3.416112      8.447597
  H      -2.354252     -3.108316     -0.833478
  H      -1.346252     -0.885458     -1.128677
  H      -1.059300      0.653950      0.811953
  H      -1.695548     -0.089252      3.094315
  H      -2.842046     -1.980438      5.667773
  H      -6.296657     -7.715428      6.038221
  H      -8.585332     -7.046693      6.686065
  H      -9.522043     -4.860330      5.939879
  H      -8.143027     -3.309340      4.575959
  H      -6.437823     -1.965339      4.409031
  H       0.571176     -6.014195      5.467823
  H       1.116807     -5.501018      7.808408
  H      -0.502894     -4.255880      9.243471
  H      -2.719220     -3.630975      8.364866
  H      -5.330079     -3.093588      6.090519
  N      -5.550570     -5.566516      1.847062
  N      -6.616445     -5.592423      1.152647
  H      -6.764014     -4.994295      0.321681
  H      -7.323383     -6.322313      1.313953
75
Coordinates from ORCA-job orca E -7353.702513411019
  N      -3.164947     -4.090486      1.642834
  C      -3.467391     -4.998008      0.529238
  C      -3.803569     -6.363393      1.099700
  N      -3.100207     -6.525420      2.365980
  C      -3.465590     -7.770589      3.113195
  C      -4.024640     -7.442534      4.506152
  N      -4.656957     -6.146920      4.440605
  Mo     -3.615347     -4.598704      3.609869
  N      -1.809772     -5.332578      4.286262
  C      -0.909956     -6.095532      3.429070
  C      -1.624226     -6.442893      2.133354
  H      -0.589054     -7.008984      3.957492
  H      -0.001958     -5.512226      3.201323
  H      -1.273894     -7.407541      1.733256
  H      -1.428777     -5.673009      1.386224
  H      -4.734481     -8.226049      4.807391
  H      -3.210055     -7.429543      5.248777
  H      -4.201033     -8.321537      2.512163
  H      -2.571598     -8.401227      3.213517
  H      -2.602297     -5.052863     -0.156133
  H      -4.315009     -4.608988     -0.058387
  H      -3.563262     -7.179612      0.384912
  H      -5.006641     -6.615161      1.315715
  C      -2.552934     -2.918073      1.335495
  C      -2.180160     -2.481807      0.039954
  C      -1.631805     -1.222648     -0.126356
  C      -1.459060     -0.350630      0.971664
  C      -1.797726     -0.762106      2.244747
  C      -2.305697     -2.064083      2.450438
  N      -2.687419     -2.572479      3.667585
  C      -2.185219     -2.022584      4.798452
  C      -0.849649     -1.605956      5.076289
  O      -0.450884     -0.995550      6.042866
  Cl      0.446120     -2.300336      3.908005
  C      -5.901478     -5.894154      4.919646
  C      -6.698376     -6.759353      5.700421
  C      -7.982116     -6.376241      6.065443
  C      -8.502135     -5.135574      5.658617
  C      -7.725984     -4.257026      4.911457
  C      -6.410882     -4.606574      4.559636
  N      -5.558358     -3.814812      3.788939
  C      -5.891887     -2.496382      3.619456
  C      -5.653574     -1.830432      2.401180
  O      -5.344676     -2.224131      1.294186
  Cl     -5.955795      0.016893      2.624229
  C      -1.434363     -5.178647      5.578798
  C      -0.172839     -5.553726      6.113774
  C       0.136953     -5.250087      7.423278
  C      -0.781872     -4.550940      8.240840
  C      -2.024890     -4.206555      7.756865
  C      -2.395651     -4.555672      6.436251
  N      -3.586488     -4.219391      5.846473
  C      -4.646705     -3.802199      6.555512
  C      -5.049284     -4.340063      7.828252
  O      -4.642140     -5.285833      8.460803
  Cl     -6.519506     -3.407726      8.446249
  H      -2.366195     -3.108607     -0.830210
  H      -1.368592     -0.882833     -1.129339
  H      -1.082317      0.659451      0.809309
  H      -1.707172     -0.086019      3.094330
  H      -2.831107     -1.982895      5.673937
  H      -6.301031     -7.718239      6.032309
  H      -8.589204     -7.045811      6.676052
  H      -9.519614     -4.855959      5.933780
  H      -8.134505     -3.303931      4.576931
  H      -6.430543     -1.966319      4.406156
  H       0.574508     -6.024070      5.477820
  H       1.121415     -5.507281      7.816505
  H      -0.493848     -4.254607      9.249671
  H      -2.709456     -3.625621      8.370564
  H      -5.322236     -3.092984      6.091248
  N      -5.590268     -5.568169      1.829241
  N      -6.641331     -5.578734      1.133857
  H      -6.786416     -4.965163      0.309737
  H      -7.359623     -6.305999      1.278257
75
Coordinates from ORCA-job orca E -7353.711032111264
  N      -3.169444     -4.093082      1.648299
  C      -3.464311     -5.000845      0.532876
  C      -3.790374     -6.370841      1.094154
  N      -3.096490     -6.529871      2.369897
  C      -3.468686     -7.774652      3.110970
  C      -4.027763     -7.446957      4.503282
  N      -4.654253     -6.147848      4.439650
  Mo     -3.611390     -4.598232      3.616010
  N      -1.803910     -5.335712      4.295086
  C      -0.905883     -6.102558      3.439709
  C      -1.619345     -6.447952      2.143938
  H      -0.588134     -7.016784      3.968821
  H       0.004237     -5.522107      3.212767
  H      -1.268720     -7.412181      1.742726
  H      -1.422322     -5.677469      1.397447
  H      -4.742559     -8.226558      4.802562
  H      -3.214687     -7.439432      5.247699
  H      -4.209012     -8.318213      2.509370
  H      -2.579197     -8.412132      3.208406
  H      -2.592981     -5.049336     -0.144815
  H      -4.308686     -4.614318     -0.060499
  H      -3.537659     -7.185746      0.382393
  H      -4.961072     -6.623322      1.299925
  C      -2.561319     -2.918428      1.339546
  C      -2.193791     -2.480855      0.042772
  C      -1.650412     -1.219933     -0.125782
  C      -1.476514     -0.346904      0.971272
  C      -1.808389     -0.759868      2.245536
  C      -2.311002     -2.063681      2.453180
  N      -2.684103     -2.573214      3.672580
  C      -2.177826     -2.021461      4.800451
  C      -0.841444     -1.601391      5.070951
  O      -0.439797     -0.989907      6.035691
  Cl      0.449091     -2.292773      3.896660
  C      -5.899080     -5.894349      4.918891
  C      -6.698505     -6.759358      5.696954
  C      -7.982630     -6.374587      6.059399
  C      -8.499975     -5.132874      5.653103
  C      -7.720988     -4.254313      4.908455
  C      -6.406077     -4.605944      4.559665
  N      -5.548500     -3.815814      3.790671
  C      -5.887786     -2.498695      3.613643
  C      -5.657439     -1.835424      2.393060
  O      -5.348208     -2.229137      1.286128
  Cl     -5.976396      0.010376      2.611148
  C      -1.428137     -5.182018      5.586898
  C      -0.167652     -5.559914      6.123066
  C       0.142363     -5.254651      7.432019
  C      -0.774650     -4.551428      8.248547
  C      -2.016660     -4.204763      7.763983
  C      -2.387751     -4.555754      6.443843
  N      -3.577146     -4.218895      5.853008
  C      -4.638182     -3.799468      6.559560
  C      -5.043317     -4.333107      7.833442
  O      -4.636004     -5.275958      8.470291
  Cl     -6.516845     -3.401594      8.443665
  H      -2.380657     -3.107679     -0.827135
  H      -1.392671     -0.879344     -1.129958
  H      -1.104862      0.664816      0.807247
  H      -1.716860     -0.083706      3.095008
  H      -2.817822     -1.986823      5.680391
  H      -6.304230     -7.719562      6.028682
  H      -8.592117     -7.044159      6.667688
  H      -9.517561     -4.851990      5.926682
  H      -8.127583     -3.299953      4.575302
  H      -6.425401     -1.968052      4.400536
  H       0.578895     -6.033659      5.488651
  H       1.126178     -5.513506      7.825904
  H      -0.485490     -4.253914      9.256731
  H      -2.700251     -3.621212      8.376337
  H      -5.314696     -3.094052      6.090869
  N      -5.629632     -5.563431      1.815805
  N      -6.666460     -5.562979      1.113851
  H      -6.808748     -4.934741      0.296443
  H      -7.396996     -6.286286      1.240103
75
Coordinates from ORCA-job orca E -7353.719054076911
  N      -3.174021     -4.095385      1.653955
  C      -3.462626     -5.002765      0.537319
  C      -3.778733     -6.377826      1.089865
  N      -3.091810     -6.533550      2.374266
  C      -3.470646     -7.777903      3.110097
  C      -4.029703     -7.450597      4.501886
  N      -4.651523     -6.148751      4.438924
  Mo     -3.606822     -4.598152      3.622031
  N      -1.797563     -5.339079      4.303464
  C      -0.901480     -6.109907      3.449706
  C      -1.614291     -6.453142      2.153736
  H      -0.587270     -7.024933      3.979666
  H       0.010886     -5.532566      3.223550
  H      -1.263371     -7.416945      1.751374
  H      -1.415937     -5.682140      1.407671
  H      -4.748810     -8.226748      4.799482
  H      -3.218131     -7.447455      5.248024
  H      -4.216008     -8.314323      2.508464
  H      -2.585585     -8.421980      3.204720
  H      -2.586093     -5.044603     -0.133749
  H      -4.304708     -4.619022     -0.060452
  H      -3.509755     -7.190110      0.381322
  H      -4.915048     -6.626673      1.284602
  C      -2.569842     -2.918497      1.343532
  C      -2.208245     -2.479374      0.045491
  C      -1.669525     -1.216818     -0.125154
  C      -1.493723     -0.343225      0.971129
  C      -1.818357     -0.757984      2.246579
  C      -2.315781     -2.063535      2.455875
  N      -2.680073     -2.574927      3.677244
  C      -2.169389     -2.022077      4.802393
  C      -0.832115     -1.599188      5.065836
  O      -0.427653     -0.986997      6.029012
  Cl      0.453066     -2.288345      3.886312
  C      -5.896516     -5.894153      4.918227
  C      -6.697823     -6.758555      5.694901
  C      -7.982295     -6.372596      6.054876
  C      -8.497825     -5.130470      5.647822
  C      -7.716851     -4.252381      4.904493
  C      -6.401932     -4.605610      4.558401
  N      -5.540285     -3.817168      3.790820
  C      -5.884707     -2.501541      3.605683
  C      -5.661738     -1.842147      2.382266
  O      -5.352651     -2.237241      1.275733
  Cl     -5.995472      0.002409      2.593948
  C      -1.421845     -5.185221      5.594616
  C      -0.162402     -5.565407      6.132246
  C       0.147341     -5.258652      7.440794
  C      -0.768414     -4.551955      8.256074
  C      -2.009451     -4.203454      7.770607
  C      -2.380422     -4.556222      6.450845
  N      -3.568530     -4.219278      5.858627
  C      -4.630657     -3.798111      6.562649
  C      -5.037854     -4.327830      7.837611
  O      -4.629993     -5.267665      8.478606
  Cl     -6.514645     -3.397436      8.440769
  H      -2.396667     -3.105948     -0.824194
  H      -1.417564     -0.875269     -1.130487
  H      -1.126882      0.670022      0.805656
  H      -1.725301     -0.082038      3.096094
  H      -2.803491     -1.992297      5.686693
  H      -6.305785     -7.719423      6.027321
  H      -8.593514     -7.041843      6.661824
  H      -9.515558     -4.848532      5.919825
  H      -8.122338     -3.297418      4.571853
  H      -6.421262     -1.969682      4.392377
  H       0.583508     -6.042234      5.499347
  H       1.130417     -5.518969      7.835644
  H      -0.478639     -4.253436      9.263791
  H      -2.692470     -3.617749      8.381573
  H      -5.308296     -3.096602      6.089708
  N      -5.670146     -5.552835      1.806277
  N      -6.691161     -5.545386      1.094339
  H      -6.829633     -4.903324      0.283561
  H      -7.434245     -6.263300      1.202119
75
Coordinates from ORCA-job orca E -7353.726374143234
  N      -3.178264     -4.097259      1.659749
  C      -3.461517     -5.003774      0.542358
  C      -3.767546     -6.384296      1.086582
  N      -3.086058     -6.536432      2.378711
  C      -3.471432     -7.780518      3.110048
  C      -4.030543     -7.453676      4.501432
  N      -4.649021     -6.149844      4.438149
  Mo     -3.601720     -4.598850      3.627843
  N      -1.791148     -5.342891      4.311383
  C      -0.896873     -6.117699      3.459404
  C      -1.608764     -6.458266      2.162848
  H      -0.586762     -7.033613      3.990335
  H       0.017963     -5.543767      3.234372
  H      -1.257540     -7.421576      1.759201
  H      -1.408886     -5.686656      1.417359
  H      -4.753153     -8.227079      4.797477
  H      -3.220480     -7.453756      5.249229
  H      -4.221717     -8.310015      2.508569
  H      -2.590690     -8.430899      3.201979
  H      -2.580907     -5.038534     -0.123273
  H      -4.302514     -4.623432     -0.058505
  H      -3.478705     -7.192281      0.381357
  H      -4.871955     -6.626889      1.270262
  C      -2.578321     -2.918020      1.347519
  C      -2.223234     -2.477027      0.048265
  C      -1.688787     -1.212932     -0.124103
  C      -1.510313     -0.339378      0.971744
  C      -1.827357     -0.756327      2.248336
  C      -2.319970     -2.063471      2.458719
  N      -2.675284     -2.577576      3.681586
  C      -2.159702     -2.024364      4.804122
  C      -0.821564     -1.598621      5.059729
  O      -0.413507     -0.985520      6.020858
  Cl      0.457006     -2.283925      3.872780
  C      -5.893970     -5.893872      4.917530
  C      -6.696586     -6.757310      5.693972
  C      -7.981243     -6.370410      6.051860
  C      -8.495538     -5.128202      5.643244
  C      -7.713292     -4.251001      4.900307
  C      -6.398248     -4.605559      4.556248
  N      -5.533676     -3.818995      3.789924
  C      -5.881869     -2.504876      3.596118
  C      -5.665427     -1.851328      2.368993
  O      -5.357411     -2.249783      1.263320
  Cl     -6.011068     -0.007269      2.571932
  C      -1.416029     -5.188343      5.602039
  C      -0.157608     -5.570236      6.141387
  C       0.151472     -5.261975      7.449604
  C      -0.763538     -4.552263      8.263349
  C      -2.003642     -4.202436      7.776699
  C      -2.374224     -4.557055      6.457288
  N      -3.561321     -4.220530      5.863580
  C      -4.624680     -3.798218      6.565212
  C      -5.033334     -4.324347      7.841242
  O      -4.624757     -5.261189      8.486141
  Cl     -6.513536     -3.395546      8.437901
  H      -2.413848     -3.103034     -0.821265
  H      -1.442794     -0.870122     -1.130475
  H      -1.147882      0.675261      0.805172
  H      -1.732158     -0.081036      3.098163
  H      -2.787416     -1.999518      5.693052
  H      -6.306041     -7.718367      6.027528
  H      -8.593668     -7.039015      6.658284
  H      -9.513357     -4.845305      5.913916
  H      -8.118076     -3.295802      4.567619
  H      -6.416790     -1.970384      4.382064
  H       0.587770     -6.049874      5.509977
  H       1.133740     -5.523489      7.845689
  H      -0.473622     -4.252725      9.270707
  H      -2.686366     -3.614918      8.386233
  H      -5.303697     -3.100762      6.088295
  N      -5.713341     -5.537993      1.799869
  N      -6.716399     -5.526542      1.075939
  H      -6.849628     -4.871028      0.271617
  H      -7.472315     -6.237907      1.165411
75
Coordinates from ORCA-job orca E -7353.732741603616
  N      -3.181664     -4.098600      1.665379
  C      -3.460319     -5.003937      0.547650
  C      -3.755647     -6.390229      1.083781
  N      -3.079034     -6.538497      2.383049
  C      -3.471099     -7.782672      3.110227
  C      -4.030328     -7.456500      4.501341
  N      -4.646779     -6.151426      4.436840
  Mo     -3.595586     -4.600659      3.633381
  N      -1.784412     -5.347346      4.319075
  C      -0.891757     -6.126351      3.469321
  C      -1.602273     -6.463278      2.171573
  H      -0.586637     -7.043388      4.001284
  H       0.025977     -5.556347      3.246005
  H      -1.250858     -7.425970      1.766264
  H      -1.400339     -5.690708      1.427147
  H      -4.755645     -8.227916      4.795864
  H      -3.221789     -7.458664      5.250754
  H      -4.226243     -8.305059      2.508807
  H      -2.594724     -8.439322      3.199372
  H      -2.576821     -5.030988     -0.113944
  H      -4.301666     -4.627781     -0.054909
  H      -3.443850     -7.191819      0.381877
  H      -4.835785     -6.625951      1.257231
  C      -2.586797     -2.916663      1.351303
  C      -2.239281     -2.473212      0.050840
  C      -1.709357     -1.207411     -0.122861
  C      -1.527658     -0.334471      0.972922
  C      -1.836191     -0.754218      2.250646
  C      -2.323573     -2.063157      2.461659
  N      -2.669136     -2.581106      3.685648
  C      -2.148307     -2.028732      4.806029
  C      -0.809184     -1.601215      5.054511
  O      -0.397286     -0.988285      6.014120
  Cl      0.463113     -2.285609      3.861965
  C      -5.891398     -5.893781      4.916363
  C      -6.694996     -6.755855      5.693487
  C      -7.979599     -6.367910      6.049689
  C      -8.492831     -5.125683      5.639023
  C      -7.709706     -4.249795      4.895859
  C      -6.394510     -4.605759      4.553138
  N      -5.527972     -3.821446      3.788008
  C      -5.878527     -2.508859      3.584601
  C      -5.668495     -1.863825      2.352402
  O      -5.363177     -2.268098      1.248094
  Cl     -6.023182     -0.019280      2.543478
  C      -1.410500     -5.191130      5.609440
  C      -0.153077     -5.573992      6.150882
  C       0.155052     -5.263738      7.458726
  C      -0.759674     -4.551099      8.270398
  C      -1.998886     -4.200600      7.782169
  C      -2.368915     -4.557626      6.463219
  N      -3.555401     -4.222201      5.868086
  C      -4.619953     -3.799331      6.567666
  C      -5.028959     -4.321836      7.845105
  O      -4.619038     -5.255333      8.493915
  Cl     -6.512421     -3.394819      8.436217
  H      -2.432708     -3.098322     -0.818619
  H      -1.469960     -0.862799     -1.130181
  H      -1.169853      0.681651      0.805560
  H      -1.738402     -0.079985      3.101024
  H      -2.769670     -2.008889      5.699471
  H      -6.305468     -7.716840      6.028355
  H      -8.592998     -7.035515      6.656177
  H      -9.510620     -4.841729      5.908654
  H      -8.113713     -3.294443      4.562759
  H      -6.410708     -1.969753      4.369203
  H       0.591840     -6.056481      5.521114
  H       1.136449     -5.526094      7.856377
  H      -0.470066     -4.250133      9.277392
  H      -2.681547     -3.611348      8.390062
  H      -5.300889     -3.106342      6.087083
  N      -5.760112     -5.521150      1.795534
  N      -6.744519     -5.506762      1.058163
  H      -6.870903     -4.837701      0.260374
  H      -7.513732     -6.210351      1.129490
75
Coordinates from ORCA-job orca E -7353.738187319017
  N      -3.183680     -4.099550      1.671054
  C      -3.458464     -5.003381      0.553202
  C      -3.742516     -6.395614      1.081343
  N      -3.070876     -6.539971      2.387366
  C      -3.470045     -7.784769      3.110194
  C      -4.029238     -7.459700      4.501212
  N      -4.644817     -6.154058      4.434648
  Mo     -3.587980     -4.604152      3.638884
  N      -1.777355     -5.353081      4.327215
  C      -0.886140     -6.136718      3.480306
  C      -1.594585     -6.468416      2.180438
  H      -0.587380     -7.055378      4.013171
  H       0.035186     -5.571443      3.259736
  H      -1.243236     -7.430256      1.772719
  H      -1.389796     -5.694139      1.438014
  H      -4.756477     -8.229915      4.794192
  H      -3.222179     -7.462860      5.252148
  H      -4.230145     -8.299282      2.508459
  H      -2.598308     -8.448015      3.196102
  H      -2.573348     -5.022185     -0.106062
  H      -4.301563     -4.631800     -0.049461
  H      -3.405736     -7.188489      0.382555
  H      -4.809773     -6.625083      1.245843
  C      -2.594868     -2.914422      1.355395
  C      -2.255817     -2.467550      0.053897
  C      -1.730322     -1.199955     -0.120306
  C      -1.544463     -0.328629      0.976075
  C      -1.843779     -0.752049      2.254764
  C      -2.326256     -2.062793      2.465438
  N      -2.661202     -2.585772      3.690034
  C      -2.134186     -2.035036      4.808080
  C      -0.794256     -1.604302      5.046996
  O      -0.376796     -0.990405      6.003544
  Cl      0.468998     -2.281749      3.842099
  C      -5.888724     -5.894442      4.914590
  C      -6.693129     -6.754692      5.693173
  C      -7.977298     -6.365196      6.048263
  C      -8.489272     -5.122758      5.635421
  C      -7.705448     -4.248663      4.891531
  C      -6.390247     -4.606517      4.549286
  N      -5.522358     -3.825035      3.785221
  C      -5.874245     -2.514020      3.571157
  C      -5.672050     -1.879999      2.332422
  O      -5.371992     -2.292163      1.229627
  Cl     -6.033464     -0.034110      2.509168
  C      -1.405411     -5.194115      5.617598
  C      -0.149116     -5.577360      6.161679
  C       0.157799     -5.264336      7.469049
  C      -0.757000     -4.548420      8.277844
  C      -1.995272     -4.197815      7.787456
  C      -2.364598     -4.558106      6.469143
  N      -3.550881     -4.224477      5.872530
  C      -4.616852     -3.801695      6.570111
  C      -5.025814     -4.320659      7.849033
  O      -4.614361     -5.250660      8.501812
  Cl     -6.512880     -3.395805      8.434691
  H      -2.452713     -3.091130     -0.815792
  H      -1.497969     -0.852747     -1.128361
  H      -1.191060      0.688988      0.808556
  H      -1.742581     -0.079641      3.106218
  H      -2.747756     -2.021267      5.706945
  H      -6.304441     -7.715561      6.029311
  H      -8.591644     -7.031358      6.655322
  H      -9.506820     -4.837421      5.904498
  H      -8.108231     -3.292989      4.557883
  H      -6.402094     -1.968343      4.354109
  H       0.595394     -6.063046      5.533892
  H       1.138214     -5.527252      7.868710
  H      -0.468141     -4.245344      9.284400
  H      -2.678017     -3.606580      8.393289
  H      -5.300167     -3.113680      6.085882
  N      -5.810285     -5.504530      1.792244
  N      -6.777243     -5.485802      1.040736
  H      -6.894921     -4.802797      0.250225
  H      -7.560193     -6.180004      1.093943
75
Coordinates from ORCA-job orca E -7353.742895290171
  N      -3.184072     -4.100319      1.676110
  C      -3.455764     -5.002720      0.558135
  C      -3.728829     -6.400660      1.079135
  N      -3.062062     -6.540802      2.391426
  C      -3.468138     -7.786665      3.109942
  C      -4.026942     -7.462951      4.500900
  N      -4.642797     -6.157354      4.431340
  Mo     -3.578951     -4.608922      3.643743
  N      -1.770037     -5.359066      4.335228
  C      -0.880034     -6.147535      3.491569
  C      -1.585941     -6.472885      2.188911
  H      -0.588490     -7.068217      4.025081
  H       0.045324     -5.587501      3.274496
  H      -1.234734     -7.433561      1.778052
  H      -1.378158     -5.696033      1.449380
  H      -4.755118     -8.232847      4.792584
  H      -3.221205     -7.465727      5.253159
  H      -4.233070     -8.292831      2.507515
  H      -2.601103     -8.456572      3.192182
  H      -2.570299     -5.013456     -0.100647
  H      -4.301681     -4.635581     -0.043153
  H      -3.366869     -7.183275      0.383402
  H      -4.794074     -6.624956      1.235772
  C      -2.602261     -2.911560      1.359106
  C      -2.272769     -2.460598      0.056596
  C      -1.752890     -1.190727     -0.117830
  C      -1.563373     -0.321152      0.979377
  C      -1.852579     -0.748762      2.258946
  C      -2.328590     -2.061973      2.469178
  N      -2.651758     -2.590979      3.694304
  C      -2.118839     -2.043117      4.810876
  C      -0.777754     -1.611626      5.043449
  O      -0.355844     -0.999902      5.999370
  Cl      0.480087     -2.293606      3.835930
  C      -5.885718     -5.895759      4.912004
  C      -6.690749     -6.753829      5.692646
  C      -7.974187     -6.362273      6.047036
  C      -8.484756     -5.119488      5.631892
  C      -7.700427     -4.247559      4.886799
  C      -6.385361     -4.607748      4.544399
  N      -5.516365     -3.829715      3.781054
  C      -5.868757     -2.520236      3.555438
  C      -5.675803     -1.898942      2.309237
  O      -5.382626     -2.320232      1.208039
  Cl     -6.041443     -0.050985      2.470420
  C      -1.400329     -5.196281      5.625847
  C      -0.145154     -5.579172      6.172777
  C       0.160544     -5.262560      7.479574
  C      -0.754649     -4.543216      8.284872
  C      -1.992097     -4.193216      7.791900
  C      -2.360599     -4.557586      6.474423
  N      -3.547042     -4.226392      5.876312
  C      -4.614179     -3.803721      6.572337
  C      -5.022182     -4.318796      7.853133
  O      -4.608513     -5.244894      8.510077
  Cl     -6.511491     -3.394760      8.435083
  H      -2.473292     -3.082521     -0.813401
  H      -1.528296     -0.840353     -1.126550
  H      -1.215382      0.698340      0.811872
  H      -1.748294     -0.078218      3.111510
  H      -2.725934     -2.034937      5.714099
  H      -6.302775     -7.714535      6.030127
  H      -8.589483     -7.026550      6.655183
  H      -9.501905     -4.832548      5.900871
  H      -8.101606     -3.291450      4.552373
  H      -6.390881     -1.966415      4.336522
  H       0.598983     -6.068318      5.547170
  H       1.140011     -5.525596      7.881486
  H      -0.466869     -4.237353      9.290906
  H      -2.675195     -3.599893      8.395346
  H      -5.300019     -3.120581      6.084924
  N      -5.863357     -5.489792      1.788348
  N      -6.815095     -5.464470      1.023049
  H      -6.922240     -4.767592      0.240725
  H      -7.611547     -6.147884      1.058682
75
Coordinates from ORCA-job orca E -7353.746899984823
  N      -3.183001     -4.101433      1.681727
  C      -3.452405     -5.002268      0.562975
  C      -3.716124     -6.405435      1.077858
  N      -3.053856     -6.541631      2.395720
  C      -3.466276     -7.789062      3.109652
  C      -4.024169     -7.467081      4.500575
  N      -4.641030     -6.161838      4.427496
  Mo     -3.569220     -4.615332      3.648805
  N      -1.763567     -5.365977      4.344065
  C      -0.874539     -6.159167      3.503746
  C      -1.577348     -6.476912      2.197604
  H      -0.591056     -7.082463      4.037271
  H       0.055256     -5.604760      3.291263
  H      -1.226364     -7.436017      1.782694
  H      -1.366603     -5.696399      1.462186
  H      -4.752319     -8.237454      4.791327
  H      -3.219479     -7.468265      5.253847
  H      -4.235746     -8.286474      2.505988
  H      -2.603896     -8.465567      3.187644
  H      -2.567727     -5.005836     -0.096924
  H      -4.301532     -4.638283     -0.035598
  H      -3.330841     -7.177364      0.384838
  H      -4.785184     -6.624923      1.226503
  C      -2.607839     -2.908996      1.364123
  C      -2.286877     -2.453437      0.061142
  C      -1.770754     -1.181864     -0.112362
  C      -1.576371     -0.315188      0.986404
  C      -1.856988     -0.747242      2.266390
  C      -2.329667     -2.061980      2.474795
  N      -2.641730     -2.597007      3.699900
  C      -2.101385     -2.051406      4.813541
  C      -0.760385     -1.611885      5.031709
  O      -0.330793     -0.995184      5.980914
  Cl      0.483153     -2.268894      3.795949
  C      -5.882678     -5.898482      4.909559
  C      -6.688170     -6.754210      5.692550
  C      -7.970426     -6.359825      6.047078
  C      -8.479216     -5.116285      5.630232
  C      -7.694522     -4.246734      4.883575
  C      -6.380016     -4.609990      4.540065
  N      -5.509749     -3.836050      3.776898
  C      -5.862170     -2.527842      3.539967
  C      -5.680111     -1.919053      2.286481
  O      -5.395159     -2.348980      1.186351
  Cl     -6.049201     -0.068987      2.433371
  C      -1.396370     -5.199510      5.635332
  C      -0.142586     -5.582097      6.185262
  C       0.161734     -5.261822      7.491584
  C      -0.754089     -4.539036      8.293014
  C      -1.990676     -4.189759      7.797098
  C      -2.358017     -4.558198      6.480368
  N      -3.544624     -4.229485      5.880228
  C      -4.613509     -3.807163      6.574244
  C      -5.022287     -4.319498      7.855806
  O      -4.607997     -5.243048      8.516155
  Cl     -6.514728     -3.396758      8.432850
  H      -2.491241     -3.073012     -0.809626
  H      -1.552691     -0.828013     -1.121328
  H      -1.231629      0.705601      0.819811
  H      -1.748426     -0.079470      3.120710
  H      -2.698210     -2.051194      5.723536
  H      -6.301090     -7.714959      6.031080
  H      -8.586704     -7.021841      6.656736
  H      -9.495672     -4.827399      5.899980
  H      -8.093628     -3.289876      4.548614
  H      -6.377548     -1.965570      4.319537
  H       0.601313     -6.074634      5.561923
  H       1.140205     -5.524887      7.895955
  H      -0.467722     -4.230255      9.298601
  H      -2.674270     -3.594310      8.397957
  H      -5.301155     -3.128179      6.083570
  N      -5.918796     -5.477826      1.782352
  N      -6.857365     -5.443140      1.005079
  H      -6.952324     -4.732602      0.231867
  H      -7.666495     -6.115063      1.023918
75
Coordinates from ORCA-job orca E -7353.750222274364
  N      -3.180620     -4.102439      1.685326
  C      -3.448803     -5.002523      0.566090
  C      -3.704595     -6.409852      1.077240
  N      -3.045598     -6.541546      2.399652
  C      -3.463049     -7.790569      3.109878
  C      -4.019438     -7.469781      4.500696
  N      -4.638199     -6.165365      4.422806
  Mo     -3.558142     -4.621220      3.652053
  N      -1.756328     -5.370623      4.351287
  C      -0.868452     -6.168857      3.514232
  C      -1.568463     -6.479328      2.204900
  H      -0.593048     -7.094727      4.047748
  H       0.065825     -5.620391      3.305991
  H      -1.217835     -7.436774      1.785786
  H      -1.355654     -5.694825      1.473867
  H      -4.746540     -8.241188      4.791621
  H      -3.215407     -7.467635      5.254563
  H      -4.236784     -8.279718      2.505181
  H      -2.604962     -8.473156      3.183308
  H      -2.566205     -5.000027     -0.096543
  H      -4.301810     -4.641251     -0.028460
  H      -3.298950     -7.172097      0.386895
  H      -4.778294     -6.624835      1.217422
  C      -2.613750     -2.905892      1.366782
  C      -2.303853     -2.445800      0.062749
  C      -1.796700     -1.170774     -0.111273
  C      -1.601478     -0.304862      0.988100
  C      -1.870870     -0.741282      2.268863
  C      -2.332684     -2.060033      2.477618
  N      -2.631065     -2.601536      3.703704
  C      -2.086357     -2.059762      4.817222
  C      -0.743199     -1.625575      5.037466
  O      -0.312996     -1.019378      5.993022
  Cl      0.506043     -2.322171      3.829031
  C      -5.878689     -5.900510      4.905948
  C      -6.684818     -6.753711      5.691230
  C      -7.965998     -6.356233      6.045252
  C      -8.472919     -5.112118      5.626124
  C      -7.687706     -4.245133      4.877814
  C      -6.373742     -4.611682      4.533858
  N      -5.501564     -3.842451      3.770589
  C      -5.853224     -2.535365      3.522115
  C      -5.680013     -1.938706      2.262120
  O      -5.400476     -2.376672      1.163630
  Cl     -6.051987     -0.086575      2.395038
  C      -1.390740     -5.199516      5.643009
  C      -0.138013     -5.580902      6.195482
  C       0.165144     -5.256459      7.501306
  C      -0.751626     -4.530761      8.298864
  C      -1.987703     -4.182896      7.800096
  C      -2.353740     -4.555694      6.484235
  N      -3.540671     -4.230085      5.882106
  C      -4.610384     -3.807282      6.575039
  C      -5.017684     -4.315753      7.858406
  O      -4.600697     -5.235549      8.522594
  Cl     -6.509284     -3.390677      8.435193
  H      -2.511089     -3.064340     -0.808103
  H      -1.587468     -0.813373     -1.120900
  H      -1.265005      0.718696      0.821279
  H      -1.761287     -0.074503      3.123789
  H      -2.681042     -2.062286      5.728463
  H      -6.298775     -7.714369      6.031356
  H      -8.583479     -7.015650      6.656569
  H      -9.488759     -4.821304      5.896349
  H      -8.084595     -3.287675      4.541726
  H      -6.362168     -1.964450      4.299699
  H       0.605663     -6.076848      5.574404
  H       1.142817     -5.519024      7.908007
  H      -0.466828     -4.218923      9.304014
  H      -2.672277     -3.585861      8.398462
  H      -5.299578     -3.131503      6.082145
  N      -5.974634     -5.469638      1.772947
  N      -6.902896     -5.424372      0.985769
  H      -6.985299     -4.701366      0.221642
  H      -7.723187     -6.085152      0.989622
75
Coordinates from ORCA-job orca E -7353.753117211161
  N      -3.177646     -4.104197      1.691256
  C      -3.445123     -5.002831      0.570820
  C      -3.694902     -6.413738      1.078693
  N      -3.039094     -6.542261      2.404662
  C      -3.461242     -7.793454      3.110268
  C      -4.015934     -7.474352      4.501078
  N      -4.636590     -6.170681      4.418441
  Mo     -3.547548     -4.628932      3.656912
  N      -1.751110     -5.377470      4.360563
  C      -0.864518     -6.180761      3.526635
  C      -1.561030     -6.482472      2.213494
  H      -0.598403     -7.109864      4.059457
  H       0.074718     -5.638845      3.323895
  H      -1.211092     -7.437898      1.789269
  H      -1.345896     -5.693079      1.488105
  H      -4.741618     -8.247011      4.792406
  H      -3.212400     -7.468515      5.255346
  H      -4.239124     -8.273882      2.504140
  H      -2.607499     -8.482116      3.178391
  H      -2.565166     -4.995042     -0.095083
  H      -4.301921     -4.642741     -0.018807
  H      -3.272148     -7.167130      0.390132
  H      -4.771326     -6.624028      1.209059
  C      -2.616999     -2.904271      1.372996
  C      -2.314052     -2.439839      0.068950
  C      -1.809106     -1.163738     -0.103646
  C      -1.608754     -0.301039      0.997487
  C      -1.871609     -0.741411      2.278237
  C      -2.332905     -2.060769      2.484746
  N      -2.621182     -2.607301      3.710663
  C      -2.067907     -2.067893      4.820202
  C      -0.726385     -1.619320      5.021348
  O      -0.288090     -1.000491      5.964908
  Cl      0.502821     -2.259564      3.762110
  C      -5.875735     -5.904492      4.903038
  C      -6.682839     -6.755292      5.690045
  C      -7.962471     -6.353872      6.044274
  C      -8.466714     -5.108490      5.624152
  C      -7.680620     -4.244087      4.874527
  C      -6.367732     -4.614831      4.529489
  N      -5.493073     -3.850756      3.766067
  C      -5.844201     -2.544304      3.508626
  C      -5.682615     -1.956250      2.243738
  O      -5.411584     -2.398899      1.144897
  Cl     -6.060046     -0.103216      2.368517
  C      -1.387470     -5.203169      5.653117
  C      -0.136381     -5.584417      6.208314
  C       0.165196     -5.256508      7.513860
  C      -0.752494     -4.527817      8.307464
  C      -1.987740     -4.180586      7.805684
  C      -2.352014     -4.556859      6.490337
  N      -3.538777     -4.233805      5.885422
  C      -4.610491     -3.811275      6.576232
  C      -5.019567     -4.318633      7.859111
  O      -4.603224     -5.237766      8.524982
  Cl     -6.513943     -3.394840      8.431974
  H      -2.524718     -3.056037     -0.802735
  H      -1.604778     -0.803168     -1.113164
  H      -1.273627      0.723212      0.832004
  H      -1.757309     -0.077578      3.134962
  H      -2.649898     -2.080532      5.739482
  H      -6.298576     -7.716384      6.031027
  H      -8.581461     -7.010605      6.656986
  H      -9.481581     -4.815251      5.895541
  H      -8.074699     -3.285530      4.538137
  H      -6.346056     -1.966810      4.285996
  H       0.607221     -6.083504      5.589571
  H       1.141818     -5.519043      7.923098
  H      -0.469490     -4.213482      9.312379
  H      -2.673132     -3.581907      8.401527
  H      -5.300106     -3.137762      6.080734
  N      -6.031455     -5.465099      1.760926
  N      -6.950672     -5.407046      0.966507
  H      -7.019977     -4.671733      0.212100
  H      -7.780864     -6.057115      0.956032
75
Coordinates from ORCA-job orca E -7353.755644663832
  N      -3.173615     -4.105667      1.695577
  C      -3.441586     -5.003456      0.574853
  C      -3.685295     -6.417031      1.081412
  N      -3.031770     -6.542291      2.409789
  C      -3.457495     -7.795568      3.111816
  C      -4.010405     -7.477202      4.502611
  N      -4.633852     -6.174868      4.413764
  Mo     -3.535535     -4.635685      3.660515
  N      -1.744536     -5.382356      4.368683
  C      -0.859825     -6.191700      3.538019
  C      -1.552942     -6.484620      2.221243
  H      -0.603862     -7.123985      4.070461
  H       0.084798     -5.657345      3.340603
  H      -1.203865     -7.437933      1.791708
  H      -1.336068     -5.690143      1.501707
  H      -4.733876     -8.251300      4.795754
  H      -3.206997     -7.465996      5.256845
  H      -4.239542     -8.268021      2.504972
  H      -2.607750     -8.489720      3.174494
  H      -2.565607     -4.990654     -0.095862
  H      -4.303543     -4.645112     -0.008141
  H      -3.248658     -7.163029      0.394200
  H      -4.762018     -6.623670      1.201575
  C      -2.621363     -2.901808      1.377038
  C      -2.327951     -2.432917      0.072416
  C      -1.830335     -1.154005     -0.100029
  C      -1.628517     -0.292579      1.002024
  C      -1.881995     -0.737075      2.283114
  C      -2.335504     -2.059301      2.489051
  N      -2.611040     -2.610924      3.715418
  C      -2.051289     -2.073669      4.821969
  C      -0.709306     -1.621930      5.014454
  O      -0.265629     -1.007876      5.958422
  Cl      0.514743     -2.276856      3.757903
  C      -5.871894     -5.907209      4.898856
  C      -6.680639     -6.755451      5.687095
  C      -7.958901     -6.349876      6.040551
  C      -8.460136     -5.103363      5.618834
  C      -7.672598     -4.241794      4.868134
  C      -6.360641     -4.616938      4.523128
  N      -5.482789     -3.858440      3.759768
  C      -5.832574     -2.552222      3.494816
  C      -5.679292     -1.969882      2.226870
  O      -5.412262     -2.414148      1.127728
  Cl     -6.061783     -0.116263      2.347238
  C      -1.382196     -5.203905      5.661711
  C      -0.132457     -5.584286      6.219413
  C       0.167406     -5.252661      7.524650
  C      -0.751520     -4.521523      8.314321
  C      -1.986128     -4.175365      7.809687
  C      -2.348539     -4.555249      6.494894
  N      -3.535240     -4.235504      5.887108
  C      -4.609037     -3.813200      6.575711
  C      -5.019551     -4.319521      7.858094
  O      -4.603114     -5.237503      8.525791
  Cl     -6.514829     -3.395248      8.429010
  H      -2.540962     -3.048038     -0.799443
  H      -1.633256     -0.790141     -1.109804
  H      -1.299610      0.733753      0.836906
  H      -1.765912     -0.074773      3.140849
  H      -2.626138     -2.091096      5.745577
  H      -6.298586     -7.716946      6.029442
  H      -8.579817     -7.003744      6.654401
  H      -9.474154     -4.807553      5.890672
  H      -8.063776     -3.282323      4.530924
  H      -6.328158     -1.969448      4.272302
  H       0.611155     -6.086532      5.603155
  H       1.143047     -5.514803      7.936424
  H      -0.470495     -4.204842      9.319075
  H      -2.672648     -3.575630      8.403203
  H      -5.298545     -3.141242      6.077875
  N      -6.087918     -5.465870      1.746337
  N      -7.000852     -5.394492      0.946819
  H      -7.058022     -4.647970      0.201863
  H      -7.839285     -6.034930      0.923739
75
Coordinates from ORCA-job orca E -7353.757855166609
  N      -3.168665     -4.106699      1.700205
  C      -3.438528     -5.003577      0.579411
  C      -3.676983     -6.419094      1.085911
  N      -3.025144     -6.542067      2.415398
  C      -3.453871     -7.797553      3.113900
  C      -4.005153     -7.479578      4.504626
  N      -4.631561     -6.178756      4.409260
  Mo     -3.523456     -4.641975      3.664395
  N      -1.738172     -5.386683      4.376546
  C      -0.855983     -6.202702      3.549114
  C      -1.545667     -6.486482      2.228817
  H      -0.611081     -7.138196      4.081329
  H       0.094375     -5.676777      3.357111
  H      -1.197598     -7.437536      1.793714
  H      -1.327264     -5.686738      1.515412
  H      -4.726206     -8.255077      4.800048
  H      -3.201776     -7.462615      5.258677
  H      -4.240098     -8.262321      2.506668
  H      -2.607933     -8.496775      3.170909
  H      -2.567276     -4.986383     -0.096927
  H      -4.306445     -4.646929      0.004322
  H      -3.230915     -7.159369      0.398919
  H      -4.753028     -6.623786      1.195972
  C      -2.624128     -2.899502      1.381770
  C      -2.338555     -2.426948      0.076677
  C      -1.847501     -1.145691     -0.095680
  C      -1.645258     -0.284904      1.007001
  C      -1.891022     -0.732596      2.288269
  C      -2.337301     -2.057500      2.494060
  N      -2.601456     -2.613482      3.720858
  C      -2.035480     -2.079882      4.825105
  C      -0.693215     -1.624418      5.009920
  O      -0.246149     -1.007471      5.950132
  Cl      0.524412     -2.275705      3.745597
  C      -5.868998     -5.909846      4.893359
  C      -6.680530     -6.756089      5.681062
  C      -7.957948     -6.346711      6.032021
  C      -8.455809     -5.099097      5.608477
  C      -7.665836     -4.239980      4.858165
  C      -6.354175     -4.619017      4.515326
  N      -5.472229     -3.866000      3.752954
  C      -5.820314     -2.559793      3.482117
  C      -5.675437     -1.981571      2.211875
  O      -5.414386     -2.426410      1.111679
  Cl     -6.065683     -0.128298      2.329862
  C      -1.376421     -5.204544      5.669846
  C      -0.128041     -5.584393      6.229698
  C       0.170012     -5.249941      7.534891
  C      -0.750274     -4.517255      8.321190
  C      -1.984186     -4.171671      7.813916
  C      -2.344316     -4.553785      6.499248
  N      -3.530587     -4.236936      5.888851
  C      -4.605295     -3.814154      6.576630
  C      -5.014236     -4.318979      7.859472
  O      -4.595485     -5.235031      8.528623
  Cl     -6.506507     -3.391362      8.433980
  H      -2.553060     -3.041494     -0.795187
  H      -1.656387     -0.779212     -1.105622
  H      -1.322189      0.743278      0.842036
  H      -1.774273     -0.071191      3.146568
  H      -2.603613     -2.103134      5.752727
  H      -6.301234     -7.718146      6.024804
  H      -8.581570     -6.998144      6.645695
  H      -9.469416     -4.801015      5.879260
  H      -8.054127     -3.279784      4.519785
  H      -6.310151     -1.972963      4.260210
  H       0.615555     -6.089462      5.615685
  H       1.144607     -5.511985      7.949082
  H      -0.471443     -4.199404      9.326186
  H      -2.672240     -3.571849      8.405723
  H      -5.294352     -3.142197      6.078255
  N      -6.144988     -5.472737      1.730123
  N      -7.054523     -5.386991      0.928379
  H      -7.101219     -4.630244      0.192935
  H      -7.899293     -6.019159      0.894773
75
Coordinates from ORCA-job orca E -7353.759815697738
  N      -3.163005     -4.106764      1.704963
  C      -3.436315     -5.002629      0.584324
  C      -3.670174     -6.419519      1.091489
  N      -3.018982     -6.541613      2.420861
  C      -3.450284     -7.799249      3.116029
  C      -3.999638     -7.481421      4.506857
  N      -4.628834     -6.182079      4.405671
  Mo     -3.511408     -4.647455      3.668480
  N      -1.731574     -5.389856      4.383715
  C      -0.852322     -6.212980      3.559390
  C      -1.538854     -6.487958      2.235778
  H      -0.618779     -7.151423      4.091703
  H       0.103843     -5.695995      3.372524
  H      -1.191694     -7.436684      1.795117
  H      -1.319177     -5.683088      1.528388
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  H      -3.195786     -7.458935      5.260164
  H      -4.240721     -8.256788      2.508878
  H      -2.607866     -8.503053      3.167280
  H      -2.570419     -4.981791     -0.098302
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  H      -4.745422     -6.624183      1.192500
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  C      -2.346592     -2.420663      0.081381
  C      -1.860628     -1.137652     -0.090527
  C      -1.657221     -0.277803      1.012963
  C      -1.896374     -0.728439      2.294215
  C      -2.337755     -2.055216      2.499394
  N      -2.592225     -2.614525      3.726216
  C      -2.019367     -2.084256      4.827399
  C      -0.677510     -1.622249      5.001939
  O      -0.225285     -1.007625      5.940912
  Cl      0.531996     -2.271479      3.729692
  C      -5.865214     -5.911234      4.889658
  C      -6.679200     -6.755070      5.677639
  C      -7.954981     -6.341008      6.028050
  C      -8.449148     -5.091884      5.603677
  C      -7.657169     -4.235807      4.852480
  C      -6.346614     -4.619571      4.509953
  N      -5.461351     -3.872673      3.746827
  C      -5.807044     -2.566288      3.471025
  C      -5.669337     -1.991957      2.198645
  O      -5.410995     -2.437230      1.098122
  Cl     -6.060628     -0.137906      2.314999
  C      -1.370178     -5.203939      5.677312
  C      -0.122699     -5.582461      6.238846
  C       0.174043     -5.244352      7.543609
  C      -0.747368     -4.509831      8.326457
  C      -1.981091     -4.165720      7.817200
  C      -2.339982     -4.551518      6.503269
  N      -3.526401     -4.238913      5.890011
  C      -4.605160     -3.818318      6.574429
  C      -5.020116     -4.327699      7.852808
  O      -4.606385     -5.248103      8.519439
  Cl     -6.522675     -3.409978      8.417720
  H      -2.562501     -3.034533     -0.790569
  H      -1.674393     -0.768796     -1.100493
  H      -1.338501      0.751773      0.848381
  H      -1.778269     -0.068277      3.153348
  H      -2.579262     -2.114332      5.759789
  H      -6.302913     -7.717981      6.022229
  H      -8.580855     -6.989730      6.642304
  H      -9.461759     -4.790770      5.874767
  H      -8.042686     -3.274736      4.513448
  H      -6.291232     -1.975587      4.249721
  H       0.620974     -6.089951      5.626884
  H       1.148047     -5.505337      7.959759
  H      -0.470093     -4.189775      9.331192
  H      -2.669947     -3.565190      8.407169
  H      -5.293292     -3.147419      6.073082
  N      -6.202408     -5.485483      1.713414
  N      -7.111680     -5.384685      0.913265
  H      -7.150933     -4.618589      0.187371
  H      -7.961047     -6.010231      0.871865
75
Coordinates from ORCA-job orca E -7353.761546253570
  N      -3.155997     -4.106380      1.709740
  C      -3.434187     -5.001338      0.589610
  C      -3.664632     -6.418918      1.098015
  N      -3.013306     -6.541005      2.426340
  C      -3.446529     -7.800474      3.118590
  C      -3.994688     -7.482520      4.509109
  N      -4.626603     -6.184858      4.401679
  Mo     -3.500374     -4.651542      3.672503
  N      -1.725292     -5.391907      4.389773
  C      -0.849129     -6.222007      3.568452
  C      -1.532771     -6.488877      2.242065
  H      -0.626814     -7.163052      4.101134
  H       0.112671     -5.714041      3.386375
  H      -1.186190     -7.435269      1.796157
  H      -1.312312     -5.679251      1.540195
  H      -4.710946     -8.260428      4.809811
  H      -3.190938     -7.454660      5.262285
  H      -4.240623     -8.251747      2.511621
  H      -2.607106     -8.508065      3.164877
  H      -2.573766     -4.978217     -0.099363
  H      -4.315186     -4.646848      0.033414
  H      -3.212894     -7.152710      0.407687
  H      -4.739264     -6.625106      1.191115
  C      -2.624371     -2.894173      1.391763
  C      -2.350315     -2.415634      0.085981
  C      -1.869513     -1.130965     -0.085799
  C      -1.667117     -0.270905      1.018021
  C      -1.901507     -0.723394      2.299220
  C      -2.337356     -2.052210      2.504382
  N      -2.584334     -2.613817      3.731272
  C      -2.006699     -2.086951      4.830424
  C      -0.665369     -1.619234      4.998651
  O      -0.211928     -1.001099      5.934481
  Cl      0.539649     -2.262018      3.720065
  C      -5.863820     -5.913861      4.881441
  C      -6.681981     -6.757309      5.665690
  C      -7.958591     -6.341635      6.009935
  C      -8.449882     -5.092047      5.582881
  C      -7.654226     -4.236948      4.834916
  C      -6.342413     -4.622275      4.498590
  N      -5.452379     -3.879026      3.738562
  C      -5.796368     -2.572235      3.459933
  C      -5.665402     -1.999363      2.186452
  O      -5.413818     -2.444141      1.084293
  Cl     -6.068033     -0.147169      2.302589
  C      -1.363820     -5.203901      5.683727
  C      -0.117671     -5.582218      6.247039
  C       0.176524     -5.243869      7.552661
  C      -0.747216     -4.510776      8.333688
  C      -1.980183     -4.166727      7.821979
  C      -2.335222     -4.551045      6.506789
  N      -3.520509     -4.239982      5.891291
  C      -4.598215     -3.817634      6.577345
  C      -5.005065     -4.323282      7.858947
  O      -4.578679     -5.233755      8.531516
  Cl     -6.488085     -3.386538      8.445497
  H      -2.566359     -3.029564     -0.785846
  H      -1.686886     -0.760512     -1.095812
  H      -1.353156      0.760087      0.853363
  H      -1.784142     -0.063526      3.158692
  H      -2.560823     -2.122935      5.765985
  H      -6.308261     -7.720503      6.012165
  H      -8.587978     -6.989315      6.621666
  H      -9.463277     -4.790046      5.849856
  H      -8.037667     -3.275726      4.494054
  H      -6.277369     -1.979899      4.239365
  H       0.626545     -6.090770      5.636593
  H       1.149506     -5.504930      7.971029
  H      -0.472975     -4.192299      9.339757
  H      -2.671970     -3.568773      8.411619
  H      -5.285748     -3.144337      6.078629
  N      -6.260437     -5.503683      1.696147
  N      -7.171726     -5.388071      0.900925
  H      -7.206866     -4.613533      0.184174
  H      -8.024299     -6.008775      0.854341
75
Coordinates from ORCA-job orca E -7353.763107612515
  N      -3.147502     -4.105756      1.714361
  C      -3.432408     -4.999596      0.594970
  C      -3.660375     -6.417329      1.104930
  N      -3.007783     -6.541189      2.431599
  C      -3.443382     -7.801897      3.121368
  C      -3.990049     -7.483230      4.511717
  N      -4.623589     -6.186716      4.399086
  Mo     -3.489002     -4.655035      3.676693
  N      -1.717879     -5.393534      4.395132
  C      -0.845378     -6.231306      3.576791
  C      -1.526848     -6.491030      2.247963
  H      -0.634219     -7.174419      4.110474
  H       0.121979     -5.732756      3.398646
  H      -1.180976     -7.435383      1.797324
  H      -1.305510     -5.677342      1.550942
  H      -4.704504     -8.261691      4.815271
  H      -3.185865     -7.451030      5.264221
  H      -4.241013     -8.247355      2.514805
  H      -2.606874     -8.513102      3.163326
  H      -2.577828     -4.975320     -0.100777
  H      -4.319904     -4.644877      0.049208
  H      -3.211321     -7.150466      0.411858
  H      -4.734816     -6.626096      1.191882
  C      -2.621277     -2.891822      1.396336
  C      -2.352077     -2.411062      0.090074
  C      -1.876116     -1.124905     -0.081760
  C      -1.674433     -0.264417      1.022238
  C      -1.904046     -0.718435      2.303478
  C      -2.334624     -2.049190      2.508899
  N      -2.575073     -2.612651      3.735947
  C      -1.992456     -2.090124      4.833357
  C      -0.651426     -1.617249      4.996274
  O      -0.197516     -0.997060      5.930277
  Cl      0.550597     -2.255647      3.714088
  C      -5.860464     -5.913571      4.877166
  C      -6.681543     -6.754975      5.660770
  C      -7.956849     -6.335160      6.004167
  C      -8.444394     -5.084090      5.576578
  C      -7.646343     -4.231752      4.828180
  C      -6.335532     -4.621243      4.492536
  N      -5.442607     -3.882942      3.731837
  C      -5.783209     -2.574964      3.452208
  C      -5.656281     -2.001763      2.178484
  O      -5.405959     -2.444261      1.075128
  Cl     -6.057865     -0.149322      2.297850
  C      -1.356105     -5.201915      5.689298
  C      -0.110242     -5.577994      6.253560
  C       0.183257     -5.235722      7.558565
  C      -0.741605     -4.501439      8.336707
  C      -1.974972     -4.159726      7.823721
  C      -2.329231     -4.548051      6.509540
  N      -3.515027     -4.241643      5.891637
  C      -4.597022     -3.821958      6.574731
  C      -5.011684     -4.335638      7.849762
  O      -4.597247     -5.258224      8.513641
  Cl     -6.518078     -3.423260      8.416930
  H      -2.568459     -3.025174     -0.781531
  H      -1.697190     -0.753042     -1.091918
  H      -1.365207      0.767939      0.857241
  H      -1.787548     -0.058640      3.163127
  H      -2.540890     -2.132642      5.771983
  H      -6.310730     -7.719007      6.008019
  H      -8.588479     -6.980624      6.615957
  H      -9.456915     -4.779053      5.843406
  H      -8.027290     -3.269684      4.486867
  H      -6.260284     -1.981254      4.233012
  H       0.634213     -6.088101      5.644622
  H       1.156210     -5.494779      7.978203
  H      -0.468459     -4.180547      9.342328
  H      -2.667581     -3.561412      8.411830
  H      -5.283340     -3.149110      6.073547
  N      -6.317644     -5.526070      1.679897
  N      -7.234210     -5.395803      0.892842
  H      -7.269283     -4.613579      0.184689
  H      -8.089093     -6.013256      0.843992
75
Coordinates from ORCA-job orca E -7353.764459461491
  N      -3.139044     -4.104531      1.719038
  C      -3.432010     -4.996503      0.600051
  C      -3.657025     -6.414081      1.111290
  N      -3.002222     -6.541025      2.435928
  C      -3.439593     -7.802777      3.123355
  C      -3.985770     -7.483681      4.513359
  N      -4.620861     -6.188285      4.396091
  Mo     -3.479331     -4.657431      3.680914
  N      -1.710782     -5.394090      4.399518
  C      -0.841770     -6.238991      3.583927
  C      -1.521117     -6.492012      2.252784
  H      -0.641315     -7.183959      4.118569
  H       0.130812     -5.749497      3.409535
  H      -1.175275     -7.434102      1.797461
  H      -1.299270     -5.674326      1.560482
  H      -4.698567     -8.262813      4.819044
  H      -3.181605     -7.447639      5.265678
  H      -4.239619     -8.243824      2.516769
  H      -2.605168     -8.516526      3.162255
  H      -2.583623     -4.971421     -0.102832
  H      -4.325796     -4.640588      0.065140
  H      -3.212288     -7.147706      0.415568
  H      -4.730950     -6.626110      1.194081
  C      -2.616760     -2.889443      1.400936
  C      -2.350447     -2.407077      0.094408
  C      -1.877389     -1.120070     -0.077170
  C      -1.675901     -0.259417      1.027094
  C      -1.902661     -0.714454      2.308275
  C      -2.330926     -2.046111      2.513440
  N      -2.568090     -2.610088      3.740427
  C      -1.981021     -2.090483      4.835537
  C      -0.641750     -1.608174      4.990565
  O      -0.186258     -0.990180      5.925061
  Cl      0.555626     -2.240741      3.703125
  C      -5.858726     -5.914412      4.870410
  C      -6.683147     -6.755308      5.651164
  C      -7.958594     -6.333618      5.991194
  C      -8.443356     -5.081668      5.562613
  C      -7.642420     -4.230448      4.816122
  C      -6.331298     -4.621820      4.483886
  N      -5.435343     -3.886439      3.724482
  C      -5.773191     -2.577449      3.444907
  C      -5.647222     -2.003555      2.171458
  O      -5.394490     -2.444276      1.067844
  Cl     -6.047371     -0.151139      2.292742
  C      -1.349167     -5.199941      5.694141
  C      -0.103686     -5.573870      6.259561
  C       0.187922     -5.230161      7.564892
  C      -0.739332     -4.497481      8.341326
  C      -1.972863     -4.157762      7.826733
  C      -2.324576     -4.546666      6.512112
  N      -3.510598     -4.243975      5.891778
  C      -4.596071     -3.827141      6.573008
  C      -5.012776     -4.345453      7.844698
  O      -4.591625     -5.262511      8.512396
  Cl     -6.513606     -3.427322      8.419726
  H      -2.566840     -3.021274     -0.777128
  H      -1.700526     -0.747224     -1.087335
  H      -1.369512      0.773750      0.861921
  H      -1.786605     -0.054970      3.168309
  H      -2.522405     -2.140625      5.777859
  H      -6.314493     -7.719802      5.999402
  H      -8.592738     -6.978240      6.601297
  H      -9.456037     -4.775189      5.827171
  H      -8.021529     -3.267929      4.473982
  H      -6.249559     -1.983590      4.226016
  H       0.641794     -6.083893      5.651721
  H       1.160741     -5.487387      7.985936
  H      -0.468417     -4.176569      9.347568
  H      -2.667667     -3.561479      8.414286
  H      -5.282149     -3.154461      6.070947
  N      -6.375368     -5.551653      1.664275
  N      -7.299343     -5.408150      0.889069
  H      -7.339232     -4.618890      0.189099
  H      -8.155490     -6.024320      0.840814
75
Coordinates from ORCA-job orca E -7353.765644864679
  N      -3.129565     -4.102275      1.723933
  C      -3.433180     -4.992351      0.605876
  C      -3.655848     -6.409271      1.118865
  N      -2.997158     -6.540139      2.440622
  C      -3.435949     -7.802150      3.126585
  C      -3.982156     -7.481963      4.515987
  N      -4.618136     -6.187442      4.394199
  Mo     -3.470358     -4.657442      3.685835
  N      -1.702751     -5.393340      4.402560
  C      -0.837977     -6.245130      3.589081
  C      -1.516434     -6.492288      2.256556
  H      -0.647428     -7.191561      4.124847
  H       0.139395     -5.764518      3.417146
  H      -1.170791     -7.432392      1.796981
  H      -1.294659     -5.671217      1.568094
  H      -4.693852     -8.261400      4.823420
  H      -3.178300     -7.442681      5.268456
  H      -4.237495     -8.240316      2.519945
  H      -2.603024     -8.517668      3.163983
  H      -2.591553     -4.967901     -0.104793
  H      -4.332696     -4.633901      0.082052
  H      -3.217426     -7.144989      0.420946
  H      -4.729450     -6.624437      1.200548
  C      -2.609202     -2.887046      1.405229
  C      -2.344046     -2.404427      0.098277
  C      -1.873731     -1.116741     -0.073694
  C      -1.674691     -0.254526      1.030107
  C      -1.900248     -0.709259      2.311368
  C      -2.324785     -2.042158      2.517311
  N      -2.560742     -2.605663      3.744675
  C      -1.971862     -2.089529      4.839152
  C      -0.633321     -1.602063      4.993121
  O      -0.182254     -0.977456      5.925195
  Cl      0.566198     -2.230411      3.707545
  C      -5.858331     -5.913993      4.862241
  C      -6.686744     -6.755558      5.638059
  C      -7.963782     -6.333990      5.971927
  C      -8.446493     -5.081893      5.541381
  C      -7.641964     -4.230572      4.798901
  C      -6.329195     -4.621803      4.473183
  N      -5.429537     -3.887505      3.717460
  C      -5.764518     -2.577960      3.437563
  C      -5.635060     -2.005629      2.163857
  O      -5.382681     -2.449621      1.061369
  Cl     -6.047353     -0.156240      2.278586
  C      -1.340392     -5.197533      5.697410
  C      -0.095019     -5.569889      6.263039
  C       0.195238     -5.226559      7.569105
  C      -0.734315     -4.497024      8.345369
  C      -1.968129     -4.158493      7.829845
  C      -2.317062     -4.545377      6.514178
  N      -3.503081     -4.244407      5.892757
  C      -4.588338     -3.827272      6.575747
  C      -5.001553     -4.347152      7.846998
  O      -4.581033     -5.267728      8.510536
  Cl     -6.508835     -3.437646      8.421510
  H      -2.559646     -3.019348     -0.772913
  H      -1.697905     -0.743858     -1.084032
  H      -1.371741      0.779496      0.864014
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  H      -2.510353     -2.145048      5.782771
  H      -6.319693     -7.720128      5.987747
  H      -8.600859     -6.978862      6.578706
  H      -9.460333     -4.775316      5.801317
  H      -8.019623     -3.268024      4.455229
  H      -6.243976     -1.983903      4.216647
  H       0.651185     -6.079164      5.655357
  H       1.167995     -5.482744      7.990893
  H      -0.465624     -4.178140      9.352870
  H      -2.665775     -3.565953      8.418154
  H      -5.273776     -3.152202      6.076213
  N      -6.433398     -5.578578      1.652911
  N      -7.367973     -5.423503      0.893503
  H      -7.418099     -4.628543      0.200677
  H      -8.224572     -6.039952      0.850002
75
Coordinates from ORCA-job orca E -7353.766686411997
  N      -3.120659     -4.099677      1.728023
  C      -3.435782     -4.987409      0.610973
  C      -3.655896     -6.403962      1.124871
  N      -2.992509     -6.539715      2.443446
  C      -3.432273     -7.801933      3.127715
  C      -3.979768     -7.480851      4.516280
  N      -4.616381     -6.186833      4.391243
  Mo     -3.463881     -4.657295      3.689875
  N      -1.695581     -5.391818      4.403893
  C      -0.834456     -6.249545      3.592381
  C      -1.512307     -6.492081      2.258632
  H      -0.652308     -7.196976      4.129393
  H       0.146920     -5.776611      3.422224
  H      -1.166214     -7.430233      1.795330
  H      -1.290914     -5.668003      1.573545
  H      -4.690620     -8.260573      4.824830
  H      -3.176390     -7.439097      5.269086
  H      -4.233888     -8.238927      2.520327
  H      -2.599944     -8.518100      3.165250
  H      -2.601027     -4.963679     -0.107536
  H      -4.340260     -4.625568      0.097986
  H      -3.224189     -7.141960      0.424738
  H      -4.728851     -6.622597      1.207898
  C      -2.600417     -2.885029      1.409089
  C      -2.333941     -2.402577      0.102058
  C      -1.863775     -1.115039     -0.069683
  C      -1.666599     -0.251790      1.033925
  C      -1.893465     -0.705862      2.315019
  C      -2.317705     -2.038957      2.521031
  N      -2.555707     -2.601260      3.748472
  C      -1.965805     -2.088306      4.842574
  C      -0.628927     -1.593145      4.994824
  O      -0.181534     -0.967257      5.927653
  Cl      0.572360     -2.216684      3.710813
  C      -5.858636     -5.913820      4.854460
  C      -6.689790     -6.755909      5.626720
  C      -7.967407     -6.333838      5.957804
  C      -8.448194     -5.080915      5.527499
  C      -7.641194     -4.229603      4.787603
  C      -6.328035     -4.621535      4.464728
  N      -5.426387     -3.888143      3.710824
  C      -5.758576     -2.577868      3.432681
  C      -5.620130     -2.004384      2.160248
  O      -5.351381     -2.448392      1.061502
  Cl     -6.015902     -0.152693      2.273810
  C      -1.332949     -5.193079      5.698872
  C      -0.086926     -5.561830      6.264557
  C       0.202513     -5.216735      7.570586
  C      -0.729174     -4.489442      8.346013
  C      -1.964028     -4.154212      7.830063
  C      -2.311607     -4.542441      6.514572
  N      -3.499176     -4.246570      5.892062
  C      -4.588508     -3.834825      6.573780
  C      -5.004915     -4.362782      7.839888
  O      -4.579202     -5.280219      8.504813
  Cl     -6.513719     -3.455896      8.417585
  H      -2.548390     -3.017839     -0.769148
  H      -1.686831     -0.742497     -1.079966
  H      -1.364611      0.782431      0.867351
  H      -1.782145     -0.044774      3.174467
  H      -2.500831     -2.150858      5.787748
  H      -6.324063     -7.720869      5.976688
  H      -8.606328     -6.978995      6.562350
  H      -9.462383     -4.773698      5.785352
  H      -8.017432     -3.266530      4.443728
  H      -6.242838     -1.985035      4.209667
  H       0.660338     -6.070034      5.657187
  H       1.175914     -5.469988      7.992647
  H      -0.461867     -4.169991      9.353719
  H      -2.663549     -3.563940      8.418272
  H      -5.275351     -3.161581      6.073373
  N      -6.490789     -5.609706      1.643253
  N      -7.438723     -5.445082      0.903371
  H      -7.504267     -4.645199      0.217334
  H      -8.294514     -6.063805      0.867870
75
Coordinates from ORCA-job orca E -7353.767581110945
  N      -3.109904     -4.096973      1.730898
  C      -3.437118     -4.982250      0.615433
  C      -3.656229     -6.398151      1.129897
  N      -2.988028     -6.538537      2.445064
  C      -3.428194     -7.800727      3.127972
  C      -3.977864     -7.478453      4.515081
  N      -4.614980     -6.184991      4.386688
  Mo     -3.458729     -4.655621      3.692618
  N      -1.688757     -5.388986      4.403356
  C      -0.830959     -6.251787      3.593667
  C      -1.508619     -6.490809      2.259155
  H      -0.655854     -7.199843      4.131984
  H       0.153747     -5.785531      3.424571
  H      -1.161998     -7.427321      1.792853
  H      -1.287836     -5.664290      1.576769
  H      -4.688134     -8.258342      4.824375
  H      -3.175342     -7.434259      5.268607
  H      -4.228653     -8.238246      2.519481
  H      -2.595695     -8.516545      3.167274
  H      -2.608893     -4.960476     -0.110401
  H      -4.345229     -4.616200      0.111990
  H      -3.230536     -7.138215      0.428035
  H      -4.728336     -6.619079      1.215978
  C      -2.585336     -2.884941      1.411796
  C      -2.311868     -2.405164      0.104967
  C      -1.837641     -1.119369     -0.066667
  C      -1.643569     -0.254195      1.036228
  C      -1.877049     -0.705348      2.316983
  C      -2.305094     -2.037194      2.523356
  N      -2.550506     -2.595961      3.750681
  C      -1.962588     -2.085001      4.845271
  C      -0.627468     -1.583310      4.998936
  O      -0.185468     -0.956923      5.933740
  Cl      0.578995     -2.209366      3.723400
  C      -5.859551     -5.913702      4.844809
  C      -6.692749     -6.757444      5.612939
  C      -7.971079     -6.335977      5.941958
  C      -8.450643     -5.082089      5.513387
  C      -7.641705     -4.229633      4.776910
  C      -6.328079     -4.621267      4.455942
  N      -5.425144     -3.886939      3.704628
  C      -5.755948     -2.574934      3.435157
  C      -5.620188     -1.995119      2.165117
  O      -5.368258     -2.439502      1.062602
  Cl     -6.033514     -0.149512      2.282546
  C      -1.325755     -5.187401      5.698243
  C      -0.078910     -5.552295      6.263818
  C       0.209677     -5.205893      7.569910
  C      -0.724389     -4.481721      8.344991
  C      -1.960336     -4.149994      7.828760
  C      -2.306122     -4.538677      6.513194
  N      -3.494987     -4.247334      5.890198
  C      -4.586510     -3.839193      6.572181
  C      -5.002883     -4.372341      7.835270
  O      -4.575050     -5.290006      8.498684
  Cl     -6.518727     -3.474479      8.411701
  H      -2.524067     -3.021206     -0.766182
  H      -1.655204     -0.749047     -1.076773
  H      -1.339136      0.779135      0.868852
  H      -1.768620     -0.042801      3.175679
  H      -2.497110     -2.152297      5.790377
  H      -6.327742     -7.722878      5.962216
  H      -8.611285     -6.982351      6.543789
  H      -9.465209     -4.774972      5.769786
  H      -8.017001     -3.265896      4.433929
  H      -6.242717     -1.987731      4.214802
  H       0.669505     -6.058967      5.656558
  H       1.183753     -5.456205      7.992074
  H      -0.458681     -4.162277      9.353105
  H      -2.662288     -3.562901      8.417255
  H      -5.274823     -3.167135      6.072030
  N      -6.546820     -5.641438      1.634633
  N      -7.509625     -5.469256      0.917125
  H      -7.593273     -4.665471      0.237694
  H      -8.363753     -6.090916      0.892179
75
Coordinates from ORCA-job orca E -7353.768391877971
  N      -3.101562     -4.095153      1.734454
  C      -3.441132     -4.978287      0.620916
  C      -3.658618     -6.394135      1.136482
  N      -2.984097     -6.538667      2.448044
  C      -3.424137     -7.800543      3.130873
  C      -3.977783     -7.476442      4.516020
  N      -4.615066     -6.183306      4.383520
  Mo     -3.454628     -4.654951      3.696374
  N      -1.681968     -5.386885      4.402627
  C      -0.827290     -6.254189      3.594530
  C      -1.505528     -6.490972      2.259983
  H      -0.657732     -7.202444      4.134423
  H       0.160096     -5.793659      3.425431
  H      -1.158691     -7.426393      1.791493
  H      -1.285516     -5.662775      1.579380
  H      -4.688169     -8.256216      4.825205
  H      -3.177083     -7.429943      5.271348
  H      -4.222220     -8.240436      2.520925
  H      -2.590721     -8.515097      3.173758
  H      -2.620230     -4.958282     -0.113172
  H      -4.353112     -4.608911      0.126881
  H      -3.238518     -7.135895      0.432691
  H      -4.730417     -6.616619      1.228187
  C      -2.576279     -2.884329      1.414568
  C      -2.301602     -2.405475      0.107360
  C      -1.826665     -1.120139     -0.064851
  C      -1.634031     -0.253494      1.037312
  C      -1.869326     -0.703208      2.318178
  C      -2.296863     -2.035171      2.525605
  N      -2.545986     -2.591682      3.753357
  C      -1.960439     -2.082214      4.848787
  C      -0.626737     -1.574795      5.005995
  O      -0.193404     -0.939053      5.938420
  Cl      0.586900     -2.196808      3.737146
  C      -5.863874     -5.914787      4.832471
  C      -6.701453     -6.761237      5.592813
  C      -7.982762     -6.342231      5.913540
  C      -8.461142     -5.088296      5.483984
  C      -7.648018     -4.233452      4.754830
  C      -6.331660     -4.622786      4.442359
  N      -5.423844     -3.885526      3.699441
  C      -5.749950     -2.571579      3.436092
  C      -5.590021     -1.982378      2.172697
  O      -5.310649     -2.422002      1.074759
  Cl     -5.983859     -0.135275      2.295224
  C      -1.317564     -5.181895      5.697102
  C      -0.069412     -5.542481      6.261976
  C       0.218849     -5.194892      7.568142
  C      -0.717605     -4.474624      8.343676
  C      -1.955014     -4.146766      7.827711
  C      -2.299084     -4.535221      6.511926
  N      -3.489583     -4.248195      5.889635
  C      -4.580667     -3.841732      6.574888
  C      -4.990810     -4.375988      7.838748
  O      -4.559771     -5.294335      8.499467
  Cl     -6.511532     -3.486135      8.417927
  H      -2.512852     -3.022179     -0.763605
  H      -1.642710     -0.750945     -1.075151
  H      -1.329998      0.779819      0.868963
  H      -1.763235     -0.039158      3.176016
  H      -2.495807     -2.152876      5.793072
  H      -6.337668     -7.726854      5.942889
  H      -8.626206     -6.990781      6.509615
  H      -9.477834     -4.782855      5.734020
  H      -8.022158     -3.269580      4.410871
  H      -6.247269     -1.989219      4.212785
  H       0.680040     -6.047406      5.654402
  H       1.193879     -5.442177      7.989960
  H      -0.453281     -4.155551      9.352323
  H      -2.659913     -3.563741      8.417133
  H      -5.270909     -3.169581      6.077652
  N      -6.603176     -5.676331      1.632614
  N      -7.583683     -5.498672      0.940394
  H      -7.688224     -4.691750      0.267186
  H      -8.435694     -6.124248      0.929310
75
Coordinates from ORCA-job orca E -7353.769115965149
  N      -3.092699     -4.092166      1.736811
  C      -3.444229     -4.971463      0.624377
  C      -3.661139     -6.387684      1.139367
  N      -2.980754     -6.537046      2.447497
  C      -3.420349     -7.799364      3.128968
  C      -3.979026     -7.474692      4.511872
  N      -4.616310     -6.181551      4.377058
  Mo     -3.452375     -4.653903      3.698071
  N      -1.676879     -5.383539      4.399763
  C      -0.824233     -6.253756      3.592774
  C      -1.502882     -6.488819      2.257917
  H      -0.658458     -7.202089      4.133774
  H       0.165006     -5.797264      3.423700
  H      -1.155612     -7.423114      1.787447
  H      -1.283597     -5.658991      1.579071
  H      -4.689587     -8.254551      4.820131
  H      -3.180247     -7.426709      5.269108
  H      -4.214823     -8.242342      2.516521
  H      -2.585306     -8.511692      3.176012
  H      -2.630210     -4.953186     -0.117239
  H      -4.359215     -4.598065      0.138629
  H      -3.245752     -7.129575      0.432857
  H      -4.732132     -6.610415      1.237583
  C      -2.560908     -2.884753      1.417756
  C      -2.278066     -2.408654      0.110980
  C      -1.797126     -1.125715     -0.060690
  C      -1.607293     -0.257590      1.040975
  C      -1.850699     -0.704293      2.321240
  C      -2.282899     -2.034803      2.528904
  N      -2.542089     -2.587440      3.756203
  C      -1.962887     -2.078892      4.854292
  C      -0.630969     -1.566895      5.019326
  O      -0.207683     -0.925800      5.952466
  Cl      0.593779     -2.191550      3.764227
  C      -5.867053     -5.914563      4.822659
  C      -6.706812     -6.762749      5.578531
  C      -7.988429     -6.343631      5.898157
  C      -8.465186     -5.088181      5.471510
  C      -7.649833     -4.231941      4.746395
  C      -6.333247     -4.621425      4.435598
  N      -5.423688     -3.883483      3.695115
  C      -5.747277     -2.568874      3.436540
  C      -5.580619     -1.976934      2.174888
  O      -5.301121     -2.420424      1.078439
  Cl     -5.959371     -0.129618      2.297340
  C      -1.311046     -5.173962      5.693579
  C      -0.060950     -5.528372      6.257496
  C       0.227450     -5.177539      7.562955
  C      -0.711219     -4.460354      8.338328
  C      -1.950690     -4.138280      7.823155
  C      -2.294266     -4.529623      6.508250
  N      -3.487584     -4.250514      5.886821
  C      -4.582056     -3.851792      6.573019
  C      -4.991366     -4.394488      7.832700
  O      -4.552894     -5.309511      8.493411
  Cl     -6.516993     -3.513378      8.415475
  H      -2.487418     -3.025634     -0.760228
  H      -1.606640     -0.758892     -1.070637
  H      -1.299565      0.774545      0.872292
  H      -1.747857     -0.038550      3.178107
  H      -2.502848     -2.151544      5.795799
  H      -6.344694     -7.729689      5.926521
  H      -8.633480     -6.993661      6.490866
  H      -9.482228     -4.782830      5.720191
  H      -8.022755     -3.267154      4.403636
  H      -6.249706     -1.989364      4.212127
  H       0.689726     -6.031428      5.649837
  H       1.203943     -5.420166      7.984042
  H      -0.447576     -4.139333      9.346533
  H      -2.657725     -3.558099      8.412733
  H      -5.276429     -3.183508      6.076192
  N      -6.658546     -5.710792      1.629120
  N      -7.657749     -5.529341      0.965898
  H      -7.784925     -4.719440      0.300373
  H      -8.506304     -6.159592      0.970594
75
Coordinates from ORCA-job orca E -7353.769753925045
  N      -3.084809     -4.088792      1.739939
  C      -3.447824     -4.964102      0.628504
  C      -3.664918     -6.381070      1.142747
  N      -2.978052     -6.534665      2.447431
  C      -3.416327     -7.797692      3.127987
  C      -3.981735     -7.472673      4.508025
  N      -4.618814     -6.179407      4.370658
  Mo     -3.451089     -4.652889      3.700179
  N      -1.672536     -5.379708      4.396605
  C      -0.821194     -6.251392      3.589959
  C      -1.500920     -6.485999      2.255381
  H      -0.656974     -7.199509      4.131879
  H       0.168926     -5.797120      3.420145
  H      -1.153679     -7.419721      1.783742
  H      -1.282636     -5.655317      1.577279
  H      -4.693089     -8.252558      4.814176
  H      -3.185848     -7.423527      5.268251
  H      -4.205752     -8.245316      2.512342
  H      -2.578706     -8.506515      3.180539
  H      -2.640773     -4.947902     -0.120608
  H      -4.365421     -4.586805      0.150510
  H      -3.253660     -7.122126      0.433039
  H      -4.735277     -6.601750      1.249440
  C      -2.546176     -2.884533      1.422297
  C      -2.256132     -2.410152      0.116152
  C      -1.767697     -1.130044     -0.054350
  C      -1.577819     -0.261951      1.047470
  C      -1.828996     -0.706405      2.326887
  C      -2.268379     -2.034737      2.534021
  N      -2.538080     -2.583402      3.760546
  C      -1.965641     -2.074691      4.861100
  C      -0.636375     -1.556246      5.032463
  O      -0.220867     -0.915080      5.968804
  Cl      0.597703     -2.183018      3.788938
  C      -5.871872     -5.914274      4.811841
  C      -6.714937     -6.764813      5.561191
  C      -7.997780     -6.346254      5.876918
  C      -8.472570     -5.089360      5.452603
  C      -7.653859     -4.231028      4.733593
  C      -6.336294     -4.620076      4.427183
  N      -5.423193     -3.880835      3.691730
  C      -5.743989     -2.566526      3.432985
  C      -5.567061     -1.977008      2.170988
  O      -5.286648     -2.430080      1.078399
  Cl     -5.939877     -0.131117      2.282369
  C      -1.304170     -5.165748      5.689383
  C      -0.051696     -5.513788      6.251420
  C       0.237409     -5.160248      7.556180
  C      -0.703302     -4.446912      8.332367
  C      -1.945119     -4.130703      7.818760
  C      -2.288597     -4.524225      6.504626
  N      -3.484922     -4.252743      5.885116
  C      -4.580652     -3.860397      6.574791
  C      -4.985240     -4.410232      7.832073
  O      -4.541047     -5.325353      8.489109
  Cl     -6.516940     -3.540854      8.419472
  H      -2.464950     -3.026396     -0.755669
  H      -1.570966     -0.765047     -1.063774
  H      -1.264572      0.768599      0.879285
  H      -1.727340     -0.039826      3.183240
  H      -2.510059     -2.149083      5.799943
  H      -6.355062     -7.733244      5.907288
  H      -8.645447     -6.998183      6.464687
  H      -9.490591     -4.784643      5.698050
  H      -8.025234     -3.265239      4.391897
  H      -6.253567     -1.987025      4.203998
  H       0.700025     -6.014508      5.643056
  H       1.215616     -5.398240      7.975919
  H      -0.439947     -4.124457      9.340200
  H      -2.654468     -3.554116      8.409178
  H      -5.278964     -3.193906      6.081115
  N      -6.713370     -5.744094      1.630747
  N      -7.732836     -5.560442      1.000173
  H      -7.883619     -4.747700      0.343181
  H      -8.577405     -6.195528      1.024018
75
Coordinates from ORCA-job orca E -7353.770323033704
  N      -3.075714     -4.086502      1.741592
  C      -3.448323     -4.958249      0.630978
  C      -3.667046     -6.375771      1.144610
  N      -2.974825     -6.532538      2.446437
  C      -3.411616     -7.796487      3.126083
  C      -3.985851     -7.471147      4.502247
  N      -4.622328     -6.177674      4.361687
  Mo     -3.450337     -4.652651      3.700269
  N      -1.669158     -5.375805      4.392603
  C      -0.817804     -6.247831      3.586389
  C      -1.498309     -6.483714      2.252216
  H      -0.653343     -7.195262      4.129455
  H       0.172354     -5.793996      3.415722
  H      -1.151293     -7.417621      1.780833
  H      -1.280757     -5.653297      1.573624
  H      -4.698682     -8.250884      4.805153
  H      -3.193990     -7.421070      5.266634
  H      -4.194353     -8.249961      2.506140
  H      -2.570705     -8.500686      3.185850
  H      -2.647280     -4.944590     -0.124487
  H      -4.367763     -4.577410      0.159433
  H      -3.259374     -7.115851      0.432150
  H      -4.736839     -6.591726      1.260580
  C      -2.529921     -2.885415      1.426059
  C      -2.232803     -2.412766      0.120625
  C      -1.738137     -1.135112     -0.048949
  C      -1.550065     -0.266452      1.052850
  C      -1.809176     -0.708542      2.331302
  C      -2.253276     -2.035536      2.538500
  N      -2.533137     -2.580413      3.764392
  C      -1.970310     -2.071193      4.868879
  C      -0.642433     -1.551824      5.052890
  O      -0.239096     -0.901689      5.988112
  Cl      0.605804     -2.182227      3.825876
  C      -5.876747     -5.913113      4.800081
  C      -6.723073     -6.764945      5.544002
  C      -8.005814     -6.344844      5.858462
  C      -8.477164     -5.085344      5.438370
  C      -7.655091     -4.225961      4.724229
  C      -6.338154     -4.617052      4.418869
  N      -5.421862     -3.877929      3.686820
  C      -5.740014     -2.563551      3.428973
  C      -5.562964     -1.976821      2.165018
  O      -5.287621     -2.438683      1.074532
  Cl     -5.915783     -0.130138      2.270697
  C      -1.298215     -5.157003      5.684147
  C      -0.043323     -5.498030      6.244512
  C       0.245965     -5.141554      7.548570
  C      -0.697295     -4.432489      8.325400
  C      -1.941430     -4.122752      7.813134
  C      -2.284278     -4.518587      6.499641
  N      -3.483550     -4.255759      5.881836
  C      -4.581217     -3.872040      6.575075
  C      -4.980037     -4.431238      7.829246
  O      -4.526987     -5.344871      8.482513
  Cl     -6.518041     -3.575950      8.423484
  H      -2.440674     -3.028594     -0.751689
  H      -1.535554     -0.771959     -1.057872
  H      -1.232630      0.762876      0.885131
  H      -1.710374     -0.040417      3.186710
  H      -2.524118     -2.143348      5.802339
  H      -6.366425     -7.735520      5.887313
  H      -8.656038     -6.997707      6.442356
  H      -9.495009     -4.779499      5.683125
  H      -8.023885     -3.258199      4.385278
  H      -6.251387     -1.983594      4.198494
  H       0.709787     -5.996186      5.635733
  H       1.225841     -5.374495      7.967211
  H      -0.434560     -4.108451      9.332879
  H      -2.653520     -3.550047      8.404149
  H      -5.284823     -3.208470      6.084864
  N      -6.764324     -5.776735      1.632205
  N      -7.804679     -5.592415      1.037070
  H      -7.979125     -4.777052      0.389464
  H      -8.644604     -6.232112      1.083008
75
Coordinates from ORCA-job orca E -7353.770843311577
  N      -3.068333     -4.084895      1.743382
  C      -3.448192     -4.954101      0.633468
  C      -3.668829     -6.372207      1.147263
  N      -2.971265     -6.531107      2.446585
  C      -3.406079     -7.796117      3.126005
  C      -3.991379     -7.470499      4.497552
  N      -4.627143     -6.176894      4.352844
  Mo     -3.450174     -4.653720      3.700365
  N      -1.666524     -5.372365      4.389407
  C      -0.813931     -6.243555      3.583403
  C      -1.495212     -6.482240      2.249923
  H      -0.647409     -7.189903      4.127748
  H       0.175401     -5.788343      3.411661
  H      -1.148545     -7.416941      1.779913
  H      -1.278452     -5.653054      1.569666
  H      -4.706249     -8.250136      4.795812
  H      -3.204953     -7.419606      5.267519
  H      -4.180620     -8.256714      2.500946
  H      -2.561139     -8.494522      3.194544
  H      -2.652256     -4.942634     -0.127370
  H      -4.369308     -4.570598      0.167473
  H      -3.265318     -7.111961      0.432463
  H      -4.738640     -6.581379      1.273777
  C      -2.517414     -2.886008      1.430116
  C      -2.215769     -2.414080      0.125312
  C      -1.714604     -1.138933     -0.043225
  C      -1.524701     -0.271264      1.059180
  C      -1.789414     -0.712068      2.336811
  C      -2.240403     -2.037025      2.543531
  N      -2.528256     -2.578631      3.768840
  C      -1.971797     -2.068843      4.875562
  C      -0.646336     -1.544584      5.065588
  O      -0.248634     -0.896792      6.004618
  Cl      0.609440     -2.173748      3.845713
  C      -5.883629     -5.912454      4.786203
  C      -6.734822     -6.765472      5.522942
  C      -8.018207     -6.343832      5.833202
  C      -8.485111     -5.081706      5.416279
  C      -7.658179     -4.221251      4.708747
  C      -6.341358     -4.614599      4.406869
  N      -5.419508     -3.874986      3.681853
  C      -5.731939     -2.558870      3.426540
  C      -5.543148     -1.969472      2.164930
  O      -5.264812     -2.434636      1.076248
  Cl     -5.896435     -0.125789      2.266817
  C      -1.292646     -5.148090      5.679465
  C      -0.035015     -5.481214      6.237943
  C       0.254666     -5.120676      7.540917
  C      -0.691071     -4.415390      8.318117
  C      -1.937760     -4.112979      7.807420
  C      -2.280469     -4.512650      6.495091
  N      -3.483019     -4.259567      5.879180
  C      -4.582518     -3.884920      6.576307
  C      -4.975363     -4.454775      7.826930
  O      -4.514122     -5.368420      8.474668
  Cl     -6.518336     -3.613113      8.430014
  H      -2.424332     -3.028990     -0.747529
  H      -1.507947     -0.776823     -1.051714
  H      -1.201910      0.756578      0.892472
  H      -1.690195     -0.043643      3.191929
  H      -2.530507     -2.141852      5.806143
  H      -6.382165     -7.738199      5.864266
  H      -8.672300     -6.997550      6.411842
  H      -9.503190     -4.774531      5.658509
  H      -8.023582     -3.251298      4.372311
  H      -6.247045     -1.979514      4.194140
  H       0.719584     -5.976801      5.628861
  H       1.236465     -5.347760      7.958304
  H      -0.428553     -4.088637      9.324799
  H      -2.652431     -3.543610      8.398660
  H      -5.291211     -3.223504      6.090480
  N      -6.812304     -5.809889      1.637845
  N      -7.874739     -5.626563      1.081124
  H      -8.073844     -4.808830      0.443879
  H      -8.709232     -6.270725      1.152709
75
Coordinates from ORCA-job orca E -7353.771322257619
  N      -3.061384     -4.084409      1.743443
  C      -3.446431     -4.951686      0.634109
  C      -3.669950     -6.369716      1.148915
  N      -2.967322     -6.529301      2.446014
  C      -3.399136     -7.795602      3.125608
  C      -3.997366     -7.469875      4.491673
  N      -4.632748     -6.176493      4.342107
  Mo     -3.451022     -4.654903      3.698439
  N      -1.665026     -5.368029      4.385267
  C      -0.809626     -6.236491      3.578989
  C      -1.491718     -6.479556      2.246559
  H      -0.638718     -7.181381      4.124457
  H       0.177722     -5.777513      3.406023
  H      -1.145017     -7.415292      1.778761
  H      -1.276479     -5.652249      1.563594
  H      -4.714251     -8.249802      4.784248
  H      -3.217512     -7.417833      5.268241
  H      -4.163926     -8.264720      2.494834
  H      -2.549287     -8.486728      3.204305
  H      -2.654083     -4.942749     -0.130399
  H      -4.368519     -4.565530      0.172117
  H      -3.272029     -7.110414      0.432514
  H      -4.739590     -6.569647      1.287258
  C      -2.503439     -2.888707      1.432442
  C      -2.194904     -2.419336      0.128214
  C      -1.687403     -1.146877     -0.040075
  C      -1.498410     -0.278617      1.062196
  C      -1.770444     -0.716640      2.339083
  C      -2.227328     -2.039706      2.546392
  N      -2.524322     -2.576824      3.771279
  C      -1.977077     -2.064883      4.880893
  C      -0.653792     -1.538318      5.081003
  O      -0.264723     -0.888642      6.022110
  Cl      0.613405     -2.168389      3.873048
  C      -5.890938     -5.911747      4.770984
  C      -6.746857     -6.765704      5.500799
  C      -8.030509     -6.342076      5.807713
  C      -8.492595     -5.077041      5.394568
  C      -7.660832     -4.215634      4.693583
  C      -6.344527     -4.611794      4.394239
  N      -5.417527     -3.872280      3.675535
  C      -5.724921     -2.553544      3.426218
  C      -5.533034     -1.957296      2.167970
  O      -5.252445     -2.418623      1.078010
  Cl     -5.867468     -0.113093      2.280632
  C      -1.288293     -5.138894      5.673882
  C      -0.027932     -5.463711      6.230577
  C       0.261317     -5.100087      7.532913
  C      -0.687788     -4.400302      8.310910
  C      -1.936886     -4.105437      7.801517
  C      -2.278261     -4.507362      6.489639
  N      -3.483314     -4.263105      5.875214
  C      -4.583984     -3.897583      6.576907
  C      -4.968589     -4.478165      7.824509
  O      -4.498603     -5.392731      8.464769
  Cl     -6.517910     -3.653782      8.436891
  H      -2.403191     -3.034425     -0.744569
  H      -1.475579     -0.786859     -1.048226
  H      -1.170759      0.747725      0.895788
  H      -1.672611     -0.046833      3.193249
  H      -2.544190     -2.135804      5.806543
  H      -6.398305     -7.740751      5.839628
  H      -8.688447     -6.996512      6.381150
  H      -9.510629     -4.768159      5.634829
  H      -8.022724     -3.243375      4.359987
  H      -6.238662     -1.976557      4.196516
  H       0.728694     -5.955757      5.621144
  H       1.244928     -5.321054      7.949272
  H      -0.426177     -4.071966      9.317311
  H      -2.655075     -3.540788      8.393274
  H      -5.298051     -3.237856      6.096688
  N      -6.856120     -5.842201      1.646216
  N      -7.940384     -5.661919      1.131855
  H      -8.165667     -4.842287      0.506500
  H      -8.767975     -6.310239      1.233311
75
Coordinates from ORCA-job orca E -7353.771765830041
  N      -3.055108     -4.084476      1.742999
  C      -3.443766     -4.950492      0.633925
  C      -3.670945     -6.367851      1.150860
  N      -2.962890     -6.528073      2.445652
  C      -3.391859     -7.795640      3.125620
  C      -4.004938     -7.470031      4.485463
  N      -4.639182     -6.176616      4.331028
  Mo     -3.451434     -4.657157      3.695952
  N      -1.663451     -5.364797      4.381741
  C      -0.804454     -6.229407      3.574626
  C      -1.487563     -6.477753      2.243406
  H      -0.627567     -7.172612      4.121040
  H       0.180118     -5.765117      3.400183
  H      -1.141036     -7.414942      1.778503
  H      -1.273704     -5.653090      1.556941
  H      -4.724407     -8.250268      4.770849
  H      -3.232773     -7.417671      5.269680
  H      -4.145608     -8.273990      2.488405
  H      -2.536797     -8.478655      3.215833
  H      -2.653762     -4.944223     -0.132881
  H      -4.366435     -4.561928      0.174627
  H      -3.282026     -7.111816      0.433428
  H      -4.740824     -6.556456      1.302528
  C      -2.491295     -2.891318      1.434386
  C      -2.177109     -2.423896      0.130624
  C      -1.665440     -1.153277     -0.037359
  C      -1.478356     -0.284338      1.064875
  C      -1.755877     -0.720397      2.341083
  C      -2.215735     -2.042577      2.549017
  N      -2.519330     -2.576389      3.773510
  C      -1.980632     -2.063164      4.886177
  C      -0.659124     -1.535894      5.097382
  O      -0.279260     -0.882713      6.039653
  Cl      0.619826     -2.162804      3.899399
  C      -5.898953     -5.909916      4.755031
  C      -6.760833     -6.764074      5.477264
  C      -8.044595     -6.337404      5.780059
  C      -8.500459     -5.068996      5.370480
  C      -7.662637     -4.207251      4.676838
  C      -6.346914     -4.607244      4.380984
  N      -5.413726     -3.868924      3.669055
  C      -5.713259     -2.546942      3.424506
  C      -5.509037     -1.943161      2.171808
  O      -5.224241     -2.398882      1.080441
  Cl     -5.844636     -0.100621      2.292378
  C      -1.284012     -5.130344      5.668853
  C      -0.020815     -5.446154      6.223824
  C       0.268051     -5.078225      7.525150
  C      -0.684328     -4.383221      8.303388
  C      -1.935949     -4.096599      7.795325
  C      -2.276384     -4.502417      6.484458
  N      -3.484146     -4.268108      5.871207
  C      -4.587616     -3.914254      6.576119
  C      -4.966436     -4.509123      7.818265
  O      -4.486449     -5.423550      8.451448
  Cl     -6.520546     -3.701087      8.441577
  H      -2.384889     -3.039341     -0.742024
  H      -1.449723     -0.794668     -1.045187
  H      -1.147909      0.741164      0.898781
  H      -1.660151     -0.049357      3.194462
  H      -2.556019     -2.132783      5.806835
  H      -6.417330     -7.741837      5.813399
  H      -8.707378     -6.992137      6.347562
  H      -9.518437     -4.757575      5.607809
  H      -8.019964     -3.232456      4.345645
  H      -6.226934     -1.971437      4.196007
  H       0.737972     -5.934766      5.614301
  H       1.253630     -5.292253      7.940473
  H      -0.423307     -4.052112      9.309048
  H      -2.657248     -3.535784      8.387022
  H      -5.307471     -3.257213      6.100698
  N      -6.894044     -5.872731      1.659976
  N      -8.000633     -5.696688      1.191799
  H      -8.254350     -4.875475      0.580096
  H      -8.819832     -6.348689      1.327795
75
Coordinates from ORCA-job orca E -7353.772184061771
  N      -3.050775     -4.084133      1.741417
  C      -3.441588     -4.949728      0.632659
  C      -3.672925     -6.365361      1.153078
  N      -2.958526     -6.525475      2.444972
  C      -3.383185     -7.794542      3.125563
  C      -4.012272     -7.469606      4.478568
  N      -4.646018     -6.176652      4.319096
  Mo     -3.452959     -4.658340      3.692321
  N      -1.662683     -5.359857      4.377721
  C      -0.799139     -6.218779      3.568833
  C      -1.483661     -6.473368      2.239225
  H      -0.614084     -7.160110      4.115698
  H       0.181562     -5.747154      3.392442
  H      -1.136713     -7.411877      1.777416
  H      -1.272187     -5.651553      1.548737
  H      -4.733874     -8.250841      4.755885
  H      -3.248519     -7.416701      5.270982
  H      -4.124648     -8.283449      2.481848
  H      -2.522113     -8.467943      3.228143
  H      -2.652385     -4.946755     -0.134824
  H      -4.363990     -4.558974      0.174248
  H      -3.296670     -7.114866      0.435147
  H      -4.742534     -6.541259      1.319634
  C      -2.478831     -2.894598      1.434824
  C      -2.155597     -2.430804      0.131739
  C      -1.637235     -1.163068     -0.035851
  C      -1.452193     -0.293008      1.066038
  C      -1.737964     -0.725621      2.341427
  C      -2.204245     -2.045657      2.549838
  N      -2.516604     -2.574797      3.773647
  C      -1.986225     -2.059516      4.888749
  C      -0.667900     -1.527712      5.108179
  O      -0.294767     -0.879679      6.056535
  Cl      0.620725     -2.149459      3.917615
  C      -5.907566     -5.908858      4.737532
  C      -6.775278     -6.764335      5.450932
  C      -8.059758     -6.336019      5.748703
  C      -8.509995     -5.064249      5.343361
  C      -7.666212     -4.201065      4.658566
  C      -6.350533     -4.603662      4.366802
  N      -5.411701     -3.865556      3.662290
  C      -5.705519     -2.540481      3.424416
  C      -5.495921     -1.927903      2.177281
  O      -5.206734     -2.373521      1.082992
  Cl     -5.817408     -0.083301      2.315244
  C      -1.281013     -5.121689      5.663611
  C      -0.015303     -5.429117      6.217000
  C       0.272315     -5.058998      7.518141
  C      -0.683945     -4.370488      8.297308
  C      -1.937695     -4.091267      7.790167
  C      -2.275938     -4.498445      6.479322
  N      -3.485453     -4.272127      5.866866
  C      -4.590211     -3.927764      6.575741
  C      -4.961213     -4.534055      7.814280
  O      -4.473460     -5.450711      8.438388
  Cl     -6.520863     -3.743761      8.447176
  H      -2.362052     -3.047090     -0.740608
  H      -1.414749     -0.807090     -1.043135
  H      -1.116566      0.730822      0.900005
  H      -1.643799     -0.053419      3.194057
  H      -2.567774     -2.130347      5.805537
  H      -6.436068     -7.744718      5.783747
  H      -8.727277     -6.991962      6.309208
  H      -9.528322     -4.751156      5.577052
  H      -8.019334     -3.223781      4.330127
  H      -6.217112     -1.968089      4.199557
  H       0.746011     -5.913273      5.607060
  H       1.259555     -5.266674      7.932713
  H      -0.424282     -4.038673      9.303095
  H      -2.662942     -3.535944      8.382453
  H      -5.314772     -3.271498      6.106461
  N      -6.926877     -5.901792      1.680213
  N      -8.054870     -5.731940      1.262463
  H      -8.340054     -4.909776      0.666649
  H      -8.863264     -6.387454      1.437785
75
Coordinates from ORCA-job orca E -7353.772578205167
  N      -3.046052     -4.083393      1.739111
  C      -3.437991     -4.949006      0.630711
  C      -3.675091     -6.361737      1.155620
  N      -2.953525     -6.522862      2.443627
  C      -3.374306     -7.793256      3.124492
  C      -4.020117     -7.469272      4.470146
  N      -4.652525     -6.176385      4.306194
  Mo     -3.453420     -4.659288      3.687890
  N      -1.661217     -5.355735      4.373906
  C      -0.793131     -6.208371      3.562718
  C      -1.479173     -6.469077      2.234603
  H      -0.599281     -7.147894      4.109581
  H       0.183381     -5.728973      3.384124
  H      -1.131765     -7.408870      1.775849
  H      -1.269832     -5.650138      1.540198
  H      -4.744154     -8.251411      4.738575
  H      -3.265123     -7.416826      5.271002
  H      -4.102834     -8.292781      2.474040
  H      -2.507494     -8.456888      3.240060
  H      -2.648041     -4.950381     -0.135898
  H      -4.358804     -4.555854      0.170973
  H      -3.316005     -7.118928      0.437266
  H      -4.744339     -6.524163      1.337700
  C      -2.466734     -2.897235      1.434200
  C      -2.135255     -2.436708      0.131790
  C      -1.612539     -1.170879     -0.035363
  C      -1.431545     -0.299027      1.065907
  C      -1.724496     -0.728658      2.340503
  C      -2.193500     -2.047820      2.549455
  N      -2.512994     -2.573586      3.772501
  C      -1.991797     -2.057142      4.890850
  C      -0.676068     -1.523390      5.122112
  O      -0.313618     -0.873232      6.073093
  Cl      0.625246     -2.139793      3.942827
  C      -5.915367     -5.906593      4.719728
  C      -6.789154     -6.763034      5.424478
  C      -8.073684     -6.332192      5.718561
  C      -8.517503     -5.056265      5.318942
  C      -7.667665     -4.192142      4.642791
  C      -6.352652     -4.598323      4.353422
  N      -5.408712     -3.861085      3.655121
  C      -5.695956     -2.533354      3.422061
  C      -5.477446     -1.915412      2.179675
  O      -5.185291     -2.353509      1.083476
  Cl     -5.795142     -0.068539      2.328471
  C      -1.278432     -5.114885      5.658980
  C      -0.010694     -5.414819      6.211325
  C       0.275209     -5.043151      7.512550
  C      -0.684845     -4.360757      8.292322
  C      -1.940358     -4.088188      7.785644
  C      -2.276162     -4.496418      6.474654
  N      -3.486922     -4.277162      5.862049
  C      -4.594262     -3.942788      6.572885
  C      -4.961185     -4.561144      7.806339
  O      -4.466244     -5.478638      8.423688
  Cl     -6.524967     -3.785295      8.447227
  H      -2.339344     -3.054193     -0.740270
  H      -1.383779     -0.817212     -1.042058
  H      -1.093259      0.723881      0.899592
  H      -1.633849     -0.055034      3.192354
  H      -2.580969     -2.128631      5.802666
  H      -6.454578     -7.746442      5.752985
  H      -8.745950     -6.989083      6.272248
  H      -9.535669     -4.740653      5.550053
  H      -8.015797     -3.211830      4.317990
  H      -6.206798     -1.962499      4.198762
  H       0.753207     -5.894498      5.601056
  H       1.263817     -5.244972      7.926729
  H      -0.426743     -4.028464      9.298360
  H      -2.669118     -3.537755      8.378261
  H      -5.322720     -3.287625      6.107992
  N      -6.953192     -5.929063      1.705375
  N      -8.101348     -5.766496      1.341547
  H      -8.420664     -4.944055      0.764122
  H      -8.896352     -6.425190      1.559587
75
Coordinates from ORCA-job orca E -7353.772944697294
  N      -3.041758     -4.081460      1.736390
  C      -3.433927     -4.947431      0.628536
  C      -3.678252     -6.356079      1.158687
  N      -2.948280     -6.519720      2.441467
  C      -3.365152     -7.791396      3.122077
  C      -4.027619     -7.468847      4.460170
  N      -4.658347     -6.175793      4.292321
  Mo     -3.453464     -4.659204      3.682948
  N      -1.659569     -5.351670      4.370183
  C      -0.787149     -6.197574      3.556262
  C      -1.474628     -6.463885      2.229368
  H      -0.584267     -7.135469      4.102592
  H       0.185062     -5.710364      3.375276
  H      -1.126371     -7.404635      1.773294
  H      -1.267319     -5.647410      1.531626
  H      -4.754126     -8.251843      4.719328
  H      -3.281390     -7.417570      5.269372
  H      -4.080538     -8.301308      2.464970
  H      -2.492961     -8.445378      3.250470
  H      -2.641721     -4.954362     -0.135755
  H      -4.351720     -4.551663      0.165004
  H      -3.340082     -7.121853      0.439341
  H      -4.746680     -6.505411      1.356350
  C      -2.455187     -2.898778      1.432693
  C      -2.115313     -2.441537      0.131159
  C      -1.587711     -1.177714     -0.035156
  C      -1.410155     -0.304316      1.065520
  C      -1.710539     -0.730987      2.339290
  C      -2.183328     -2.048901      2.548107
  N      -2.510059     -2.572041      3.770074
  C      -1.997007     -2.055536      4.891551
  C      -0.684585     -1.517086      5.132520
  O      -0.332035     -0.868123      6.088025
  Cl      0.627374     -2.125704      3.962422
  C      -5.922445     -5.904660      4.700998
  C      -6.802061     -6.762780      5.396647
  C      -8.086629     -6.330070      5.687595
  C      -8.524505     -5.049719      5.295067
  C      -7.669046     -4.184086      4.628145
  C      -6.354681     -4.593276      4.340114
  N      -5.406593     -3.855913      3.647836
  C      -5.688327     -2.526055      3.419814
  C      -5.462839     -1.905134      2.180683
  O      -5.168724     -2.337487      1.083318
  Cl     -5.773283     -0.054182      2.338500
  C      -1.276948     -5.109762      5.655006
  C      -0.007836     -5.403756      6.206981
  C       0.275786     -5.031967      7.508812
  C      -0.687941     -4.355465      8.289067
  C      -1.944622     -4.088036      7.782184
  C      -2.277460     -4.496035      6.470545
  N      -3.488718     -4.282097      5.857029
  C      -4.598225     -3.954841      6.568698
  C      -4.963081     -4.580982      7.798577
  O      -4.464186     -5.499464      8.411425
  Cl     -6.530220     -3.815160      8.443356
  H      -2.316687     -3.060065     -0.740828
  H      -1.352071     -0.826412     -1.041102
  H      -1.068598      0.717447      0.898899
  H      -1.622930     -0.056373      3.190652
  H      -2.591323     -2.130842      5.799748
  H      -6.471684     -7.749309      5.719920
  H      -8.763266     -6.988463      6.234141
  H      -9.542428     -4.731929      5.524339
  H      -8.012327     -3.200498      4.308068
  H      -6.199008     -1.956421      4.197389
  H       0.758599     -5.878959      5.596359
  H       1.265271     -5.229180      7.923103
  H      -0.431863     -4.023710      9.295806
  H      -2.676674     -3.542378      8.375212
  H      -5.328679     -3.299690      6.106896
  N      -6.974260     -5.956217      1.735145
  N      -8.140390     -5.802441      1.428336
  H      -8.496212     -4.980448      0.872122
  H      -8.918763     -6.464606      1.691024
75
Coordinates from ORCA-job orca E -7353.773272619504
  N      -3.036719     -4.078489      1.733265
  C      -3.428379     -4.945208      0.626106
  C      -3.681571     -6.348964      1.161951
  N      -2.942514     -6.516719      2.438407
  C      -3.356319     -7.789363      3.118316
  C      -4.035028     -7.468222      4.448694
  N      -4.663197     -6.174442      4.277337
  Mo     -3.452458     -4.658244      3.677564
  N      -1.657549     -5.348351      4.366574
  C      -0.781288     -6.187863      3.550085
  C      -1.469677     -6.458934      2.223852
  H      -0.570250     -7.124392      4.095624
  H       0.187051     -5.693723      3.366926
  H      -1.120302     -7.400396      1.770169
  H      -1.263812     -5.644421      1.523561
  H      -4.764489     -8.251461      4.698561
  H      -3.297513     -7.418883      5.266069
  H      -4.058891     -8.308711      2.454641
  H      -2.479686     -8.434669      3.259091
  H      -2.632664     -4.958963     -0.134633
  H      -4.341785     -4.546831      0.156205
  H      -3.365592     -7.122703      0.440903
  H      -4.749069     -6.486314      1.373948
  C      -2.444099     -2.898860      1.430381
  C      -2.097458     -2.444317      0.129722
  C      -1.565982     -1.181974     -0.035639
  C      -1.391434     -0.307324      1.064524
  C      -1.698039     -0.731678      2.337604
  C      -2.173599     -2.048625      2.545885
  N      -2.506852     -2.570338      3.766647
  C      -2.001994     -2.054175      4.891321
  C      -0.693084     -1.510043      5.141873
  O      -0.351939     -0.859281      6.100309
  Cl      0.629766     -2.112461      3.983195
  C      -5.928233     -5.901986      4.682067
  C      -6.813386     -6.761680      5.369169
  C      -8.097488     -6.326827      5.658480
  C      -8.529522     -5.041767      5.274202
  C      -7.668855     -4.174723      4.616192
  C      -6.355651     -4.587287      4.327477
  N      -5.404423     -3.849566      3.640094
  C      -5.680681     -2.517838      3.417439
  C      -5.448954     -1.895799      2.180187
  O      -5.154791     -2.325441      1.082439
  Cl     -5.751166     -0.040640      2.343532
  C      -1.276360     -5.106894      5.651705
  C      -0.006571     -5.396818      6.204072
  C       0.274295     -5.026365      7.506975
  C      -0.692870     -4.355261      8.287519
  C      -1.950082     -4.091289      7.779763
  C      -2.279620     -4.497749      6.466968
  N      -3.490674     -4.287194      5.851675
  C      -4.602330     -3.964956      6.562922
  C      -4.967540     -4.595697      7.790105
  O      -4.467013     -5.514538      8.401239
  Cl     -6.537485     -3.835654      8.434998
  H      -2.296261     -3.063586     -0.742382
  H      -1.324590     -0.832529     -1.040877
  H      -1.047369      0.713535      0.897599
  H      -1.613358     -0.056229      3.188583
  H      -2.601084     -2.133430      5.795981
  H      -6.487341     -7.751547      5.686478
  H      -8.778126     -6.986680      6.198283
  H      -9.546777     -4.721579      5.503157
  H      -8.007273     -3.187599      4.301832
  H      -6.191489     -1.948632      4.195116
  H       0.762201     -5.867852      5.593126
  H       1.264108     -5.220514      7.921920
  H      -0.439253     -4.024920      9.295347
  H      -2.684929     -3.549876      8.373223
  H      -5.333395     -3.309509      6.102530
  N      -6.991827     -5.986007      1.765893
  N      -8.173498     -5.842785      1.517986
  H      -8.566731     -5.022238      0.985156
  H      -8.931872     -6.509179      1.824905
75
Coordinates from ORCA-job orca E -7353.773575575134
  N      -3.031359     -4.074806      1.730308
  C      -3.421777     -4.942373      0.623728
  C      -3.685072     -6.341029      1.165181
  N      -2.936771     -6.513999      2.434928
  C      -3.348396     -7.787254      3.114018
  C      -4.042942     -7.467335      4.436580
  N      -4.667626     -6.172204      4.261940
  Mo     -3.450916     -4.656664      3.672386
  N      -1.655798     -5.345831      4.363279
  C      -0.776116     -6.179458      3.544509
  C      -1.464847     -6.454444      2.218437
  H      -0.557984     -7.114871      4.089122
  H       0.188860     -5.679332      3.359587
  H      -1.114180     -7.396421      1.766882
  H      -1.259933     -5.641414      1.516306
  H      -4.776028     -8.250076      4.676990
  H      -3.314360     -7.420625      5.262175
  H      -4.038677     -8.314973      2.443917
  H      -2.468267     -8.424962      3.266634
  H      -2.621602     -4.963731     -0.132430
  H      -4.329658     -4.541492      0.145328
  H      -3.389637     -7.120833      0.441737
  H      -4.751636     -6.467752      1.389761
  C      -2.433973     -2.897621      1.428178
  C      -2.082380     -2.445066      0.128333
  C      -1.547677     -1.183855     -0.035975
  C      -1.375053     -0.308633      1.063991
  C      -1.686558     -0.731396      2.336530
  C      -2.164617     -2.047408      2.543905
  N      -2.503385     -2.568860      3.763424
  C      -2.005521     -2.053806      4.891084
  C      -0.700113     -1.503086      5.149316
  O      -0.369372     -0.850430      6.110123
  Cl      0.631727     -2.099689      4.000615
  C      -5.933695     -5.898516      4.662755
  C      -6.824746     -6.759886      5.340579
  C      -8.108471     -6.322967      5.627913
  C      -8.534442     -5.032970      5.252744
  C      -7.668266     -4.164330      4.604501
  C      -6.356302     -4.580365      4.314927
  N      -5.402096     -3.841999      3.632575
  C      -5.672421     -2.508341      3.416164
  C      -5.434932     -1.885054      2.180405
  O      -5.141871     -2.313848      1.082548
  Cl     -5.726297     -0.026749      2.348240
  C      -1.276435     -5.105584      5.648977
  C      -0.006335     -5.392851      6.202003
  C       0.272070     -5.024031      7.505946
  C      -0.697811     -4.357007      8.286509
  C      -1.955179     -4.095192      7.777685
  C      -2.281959     -4.500148      6.463849
  N      -3.492634     -4.291952      5.846649
  C      -4.605888     -3.972614      6.557162
  C      -4.972807     -4.605679      7.782417
  O      -4.472762     -5.525093      8.393211
  Cl     -6.544309     -3.847338      8.425920
  H      -2.279323     -3.064601     -0.744068
  H      -1.302015     -0.835612     -1.040602
  H      -1.028700      0.711437      0.897055
  H      -1.603924     -0.055316      3.187185
  H      -2.607913     -2.138052      5.793103
  H      -6.503589     -7.753349      5.651477
  H      -8.793387     -6.984475      6.160265
  H      -9.551026     -4.710513      5.481534
  H      -8.001781     -3.173577      4.296364
  H      -6.183163     -1.939266      4.193892
  H       0.764267     -5.860525      5.590757
  H       1.261919     -5.216303      7.921679
  H      -0.446487     -4.028025      9.295359
  H      -2.691988     -3.556903      8.371502
  H      -5.336600     -3.316446      6.097340
  N      -7.008355     -6.020770      1.796474
  N      -8.202731     -5.890573      1.608855
  H      -8.633327     -5.072754      1.101121
  H      -8.937324     -6.562606      1.958305
75
Coordinates from ORCA-job orca E -7353.773882852645
  N      -3.026008     -4.070429      1.727541
  C      -3.414813     -4.938961      0.621537
  C      -3.688919     -6.332553      1.168396
  N      -2.931441     -6.511259      2.431428
  C      -3.341873     -7.784618      3.109892
  C      -4.051526     -7.465470      4.424683
  N      -4.671666     -6.168317      4.246992
  Mo     -3.448719     -4.654083      3.667754
  N      -1.654235     -5.343656      4.360376
  C      -0.771761     -6.172272      3.539637
  C      -1.460487     -6.450358      2.213391
  H      -0.547839     -7.106825      4.083320
  H       0.190472     -5.667287      3.353368
  H      -1.108580     -7.392778      1.763760
  H      -1.256027     -5.638479      1.509966
  H      -4.788972     -8.246894      4.655516
  H      -3.332078     -7.422093      5.258498
  H      -4.020833     -8.319505      2.433765
  H      -2.459214     -8.415974      3.273580
  H      -2.609638     -4.968427     -0.129377
  H      -4.316389     -4.535765      0.133231
  H      -3.410858     -7.116204      0.441942
  H      -4.754425     -6.450388      1.403956
  C      -2.425021     -2.895121      1.425981
  C      -2.070314     -2.444081      0.126715
  C      -1.533178     -1.183649     -0.036763
  C      -1.361559     -0.308300      1.063184
  C      -1.676448     -0.730001      2.335435
  C      -2.156369     -2.045202      2.541939
  N      -2.499434     -2.567146      3.760355
  C      -2.007511     -2.053073      4.890522
  C      -0.705402     -1.495552      5.154661
  O      -0.384026     -0.839777      6.116515
  Cl      0.634091     -2.088386      4.015406
  C      -5.939056     -5.893178      4.643341
  C      -6.836969     -6.756253      5.310298
  C      -8.120688     -6.317237      5.594117
  C      -8.539957     -5.022088      5.228474
  C      -7.667266     -4.151635      4.591852
  C      -6.356410     -4.571350      4.302571
  N      -5.398948     -3.832390      3.625808
  C      -5.662500     -2.496703      3.416215
  C      -5.419527     -1.871431      2.181937
  O      -5.128616     -2.300884      1.084003
  Cl     -5.697694     -0.011690      2.353736
  C      -1.276693     -5.105345      5.646851
  C      -0.006642     -5.391524      6.200654
  C       0.269562     -5.025198      7.505793
  C      -0.702449     -4.361589      8.286520
  C      -1.959626     -4.100490      7.776559
  C      -2.283977     -4.502992      6.461455
  N      -3.494076     -4.295737      5.842362
  C      -4.608611     -3.978677      6.552199
  C      -4.977381     -4.613477      7.775780
  O      -4.478096     -5.533225      8.386763
  Cl     -6.550928     -3.856665      8.416903
  H      -2.266266     -3.063620     -0.745967
  H      -1.284864     -0.836103     -1.040984
  H      -1.013331      0.711147      0.896396
  H      -1.594956     -0.053251      3.185650
  H      -2.612388     -2.141747      5.790405
  H      -6.521693     -7.753643      5.614493
  H      -8.810738     -6.980611      6.117489
  H      -9.556149     -4.697527      5.456058
  H      -7.995542     -3.157197      4.290012
  H      -6.172692     -1.927502      4.194207
  H       0.765302     -5.856478      5.589014
  H       1.259159     -5.216938      7.922382
  H      -0.453326     -4.034561      9.296552
  H      -2.697804     -3.564785      8.370994
  H      -5.339116     -3.322203      6.092526
  N      -7.024131     -6.062486      1.827672
  N      -8.228060     -5.948618      1.701700
  H      -8.696095     -5.135183      1.220625
  H      -8.934440     -6.628522      2.091589
75
Coordinates from ORCA-job orca E -7353.774232810793
  N      -3.021005     -4.065058      1.725012
  C      -3.408055     -4.934609      0.619583
  C      -3.693354     -6.323469      1.171191
  N      -2.927249     -6.508447      2.427839
  C      -3.337821     -7.781319      3.105708
  C      -4.061412     -7.462337      4.412923
  N      -4.675573     -6.162321      4.232463
  Mo     -3.445836     -4.650140      3.663938
  N      -1.653258     -5.342091      4.358107
  C      -0.768934     -6.167014      3.535819
  C      -1.457277     -6.446854      2.208990
  H      -0.541153     -7.101157      4.078539
  H       0.191491     -5.658768      3.348834
  H      -1.104275     -7.389616      1.760915
  H      -1.252503     -5.635651      1.505046
  H      -4.804157     -8.241405      4.634073
  H      -3.351288     -7.423191      5.254932
  H      -4.007108     -8.321664      2.424126
  H      -2.453802     -8.408080      3.279217
  H      -2.597563     -4.972473     -0.125615
  H      -4.302747     -4.529303      0.120414
  H      -3.427640     -7.107971      0.440670
  H      -4.757412     -6.435480      1.415788
  C      -2.417695     -2.890925      1.424028
  C      -2.061758     -2.440709      0.125141
  C      -1.522862     -1.180730     -0.037529
  C      -1.351198     -0.305968      1.062773
  C      -1.667887     -0.727330      2.334963
  C      -2.149161     -2.041832      2.540464
  N      -2.495121     -2.565315      3.757917
  C      -2.007258     -2.052620      4.890117
  C      -0.707816     -1.488908      5.157705
  O      -0.393436     -0.829656      6.119461
  Cl      0.636859     -2.080048      4.025635
  C      -5.944687     -5.885342      4.623389
  C      -6.850606     -6.749943      5.277809
  C      -8.134518     -6.308457      5.556847
  C      -8.546322     -5.007991      5.200861
  C      -7.666061     -4.135829      4.577358
  C      -6.356139     -4.559558      4.289849
  N      -5.394789     -3.819897      3.619878
  C      -5.650498     -2.482029      3.418103
  C      -5.402399     -1.853095      2.185689
  O      -5.114785     -2.284556      1.087496
  Cl     -5.664336      0.005554      2.361670
  C      -1.277235     -5.106158      5.645474
  C      -0.007520     -5.392864      6.199957
  C       0.267184     -5.029325      7.506201
  C      -0.705992     -4.367809      8.287166
  C      -1.962732     -4.105996      7.776232
  C      -2.285475     -4.505775      6.459978
  N      -3.494990     -4.298217      5.839326
  C      -4.610422     -3.982926      6.548615
  C      -4.981168     -4.619021      7.770757
  O      -4.482960     -5.538888      8.382425
  Cl     -6.556948     -3.863176      8.408890
  H      -2.257692     -3.059857     -0.747883
  H      -1.273506     -0.833217     -1.041504
  H      -1.001415      0.713035      0.896533
  H      -1.586403     -0.049949      3.184655
  H      -2.613219     -2.145646      5.788806
  H      -6.542418     -7.751573      5.575190
  H      -8.830566     -6.973671      6.069901
  H      -9.562328     -4.681288      5.426236
  H      -7.988602     -3.137601      4.281939
  H      -6.159619     -1.912821      4.196911
  H       0.765049     -5.856125      5.587814
  H       1.256341     -5.221844      7.923494
  H      -0.458625     -4.042839      9.298297
  H      -2.701369     -3.571847      8.371483
  H      -5.340951     -3.326670      6.088733
  N      -7.038194     -6.115134      1.858583
  N      -8.247875     -6.022273      1.795250
  H      -8.754000     -5.215351      1.342480
  H      -8.920629     -6.714039      2.222029
75
Coordinates from ORCA-job orca E -7353.774659054482
  N      -3.017259     -4.058391      1.722984
  C      -3.403769     -4.929245      0.618334
  C      -3.699312     -6.314576      1.173886
  N      -2.925641     -6.504931      2.425050
  C      -3.337578     -7.776516      3.102922
  C      -4.072809     -7.456384      4.403199
  N      -4.679531     -6.152854      4.219736
  Mo     -3.442157     -4.643751      3.661974
  N      -1.652971     -5.340670      4.356517
  C      -0.768485     -6.164004      3.533048
  C      -1.456641     -6.443701      2.205605
  H      -0.539582     -7.098402      4.074792
  H       0.191455     -5.654830      3.345970
  H      -1.103176     -7.386795      1.758495
  H      -1.250884     -5.632731      1.501826
  H      -4.821670     -8.231930      4.615405
  H      -3.371766     -7.421775      5.252975
  H      -3.999962     -8.320354      2.417209
  H      -2.453402     -8.400762      3.284309
  H      -2.588794     -4.975168     -0.121874
  H      -4.292196     -4.522219      0.109263
  H      -3.437810     -7.096457      0.438623
  H      -4.761430     -6.425174      1.425438
  C      -2.412664     -2.884866      1.422636
  C      -2.057226     -2.435020      0.123805
  C      -1.516640     -1.175506     -0.038285
  C      -1.343440     -0.302045      1.062716
  C      -1.660354     -0.723494      2.335136
  C      -2.143020     -2.037195      2.539891
  N      -2.490332     -2.562599      3.756830
  C      -2.003942     -2.050982      4.890132
  C      -0.705994     -1.482983      5.157884
  O      -0.394620     -0.820054      6.117997
  Cl      0.640709     -2.076365      4.029928
  C      -5.951143     -5.873625      4.603068
  C      -6.866610     -6.739537      5.242413
  C      -8.151781     -6.295902      5.512602
  C      -8.555555     -4.990502      5.164767
  C      -7.665987     -4.116510      4.557175
  C      -6.355966     -4.543928      4.275916
  N      -5.389105     -3.803173      3.615797
  C      -5.635958     -2.462941      3.423155
  C      -5.382488     -1.826553      2.194186
  O      -5.098428     -2.260114      1.095084
  Cl     -5.625828      0.026972      2.376523
  C      -1.277327     -5.107444      5.644741
  C      -0.008102     -5.396619      6.199208
  C       0.266425     -5.036362      7.506412
  C      -0.706477     -4.375586      8.288252
  C      -1.962699     -4.111279      7.777111
  C      -2.285281     -4.507701      6.459877
  N      -3.494531     -4.298159      5.838791
  C      -4.610445     -3.985346      6.548238
  C      -4.982056     -4.623901      7.768720
  O      -4.483968     -5.543736      8.380392
  Cl     -6.561280     -3.871357      8.404333
  H      -2.254535     -3.053503     -0.749427
  H      -1.267699     -0.827605     -1.042222
  H      -0.991959      0.716534      0.897430
  H      -1.577105     -0.045397      3.184065
  H      -2.609718     -2.146782      5.788611
  H      -6.566755     -7.745427      5.533825
  H      -8.855174     -6.963089      6.012989
  H      -9.572278     -4.662164      5.384510
  H      -7.982393     -3.114767      4.267140
  H      -6.143933     -1.894856      4.203832
  H       0.764029     -5.859427      5.586179
  H       1.255086     -5.231246      7.923800
  H      -0.459893     -4.053062      9.300360
  H      -2.700644     -3.577707      8.373766
  H      -5.342201     -3.330413      6.088417
  N      -7.049794     -6.183271      1.888859
  N      -8.261345     -6.117515      1.888165
  H      -8.806338     -5.320189      1.464382
  H      -8.894547     -6.826551      2.346303
75
Coordinates from ORCA-job orca E -7353.775106500158
  N      -3.016336     -4.050763      1.721208
  C      -3.404608     -4.922868      0.617568
  C      -3.707771     -6.306793      1.175207
  N      -2.928420     -6.499686      2.422818
  C      -3.341521     -7.769820      3.101226
  C      -4.086192     -7.447571      4.395196
  N      -4.684994     -6.140680      4.208488
  Mo     -3.439206     -4.635067      3.661088
  N      -1.653852     -5.338243      4.354378
  C      -0.770601     -6.161117      3.529226
  C      -1.460148     -6.439920      2.201987
  H      -0.541583     -7.096052      4.069933
  H       0.189324     -5.652077      3.341721
  H      -1.107341     -7.383593      1.755432
  H      -1.253452     -5.629468      1.497986
  H      -4.840938     -8.219307      4.599813
  H      -3.393251     -7.417045      5.251732
  H      -3.998527     -8.316826      2.412727
  H      -2.457265     -8.391789      3.289529
  H      -2.586545     -4.975016     -0.118965
  H      -4.288469     -4.514107      0.101774
  H      -3.444691     -7.085447      0.436856
  H      -4.768728     -6.417545      1.430667
  C      -2.409335     -2.878441      1.421813
  C      -2.053416     -2.429281      0.123009
  C      -1.509509     -1.171077     -0.038480
  C      -1.334026     -0.299034      1.063252
  C      -1.651590     -0.720116      2.335825
  C      -2.137046     -2.032580      2.540207
  N      -2.485638     -2.558842      3.756958
  C      -1.999452     -2.048359      4.891068
  C      -0.702038     -1.479129      5.158574
  O      -0.390969     -0.814269      6.117332
  Cl      0.645329     -2.075242      4.032057
  C      -5.958463     -5.858125      4.584994
  C      -6.882411     -6.723855      5.212168
  C      -8.168627     -6.277642      5.473672
  C      -8.565188     -4.968675      5.130065
  C      -7.667029     -4.094208      4.535618
  C      -6.356527     -4.525114      4.262123
  N      -5.383440     -3.783713      3.612327
  C      -5.621832     -2.441228      3.428985
  C      -5.363435     -1.794926      2.204951
  O      -5.083532     -2.228194      1.103687
  Cl     -5.589535      0.052373      2.397027
  C      -1.277568     -5.108074      5.643369
  C      -0.008818     -5.400340      6.197110
  C       0.266165     -5.043877      7.505331
  C      -0.705882     -4.383936      8.288788
  C      -1.961724     -4.116495      7.778117
  C      -2.284689     -4.508776      6.459877
  N      -3.493951     -4.296552      5.839311
  C      -4.610796     -3.988445      6.549114
  C      -4.982170     -4.632347      7.766768
  O      -4.482151     -5.551925      8.377046
  Cl     -6.567122     -3.888444      8.400322
  H      -2.252721     -3.047149     -0.750226
  H      -1.260103     -0.823189     -1.042286
  H      -0.979788      0.718759      0.899011
  H      -1.565666     -0.041435      3.183978
  H      -2.605113     -2.145954      5.789453
  H      -6.590176     -7.733025      5.499830
  H      -8.878592     -6.945559      5.963738
  H      -9.582708     -4.638456      5.343191
  H      -7.977719     -3.089821      4.248668
  H      -6.128801     -1.875828      4.212619
  H       0.762560     -5.862764      5.582866
  H       1.254461     -5.241484      7.922280
  H      -0.459420     -4.064552      9.301911
  H      -2.698855     -3.583755      8.376571
  H      -5.345071     -3.335843      6.089897
  N      -7.049340     -6.263046      1.909116
  N      -8.260453     -6.229031      1.969520
  H      -8.844885     -5.444186      1.576333
  H      -8.850759     -6.956454      2.455659
75
Coordinates from ORCA-job orca E -7353.775491111859
  N      -3.018056     -4.043265      1.720316
  C      -3.410261     -4.915014      0.617498
  C      -3.717058     -6.299460      1.174799
  N      -2.934517     -6.492459      2.421316
  C      -3.347644     -7.761602      3.100887
  C      -4.100358     -7.437136      4.389446
  N      -4.691889     -6.127632      4.199701
  Mo     -3.437506     -4.625506      3.661346
  N      -1.655482     -5.335301      4.351852
  C      -0.774114     -6.157637      3.523937
  C      -1.466654     -6.435264      2.197834
  H      -0.544678     -7.093171      4.063370
  H       0.185601     -5.648632      3.335438
  H      -1.115848     -7.379778      1.751352
  H      -1.259344     -5.625798      1.492941
  H      -4.860278     -8.205480      4.587313
  H      -3.414401     -7.410359      5.251742
  H      -3.999438     -8.312623      2.410591
  H      -2.462579     -8.380185      3.296050
  H      -2.591167     -4.970049     -0.117644
  H      -4.292198     -4.504023      0.100180
  H      -3.450574     -7.076417      0.436040
  H      -4.778067     -6.409349      1.431561
  C      -2.407821     -2.872652      1.422102
  C      -2.050812     -2.423994      0.123275
  C      -1.502722     -1.167678     -0.037653
  C      -1.324470     -0.296959      1.064740
  C      -1.642609     -0.717600      2.337291
  C      -2.131583     -2.028755      2.541648
  N      -2.480612     -2.554738      3.758487
  C      -1.993562     -2.045816      4.893268
  C      -0.695757     -1.478951      5.161493
  O      -0.383014     -0.815685      6.120721
  Cl      0.652299     -2.079573      4.036454
  C      -5.966501     -5.841729      4.569785
  C      -6.895693     -6.705953      5.190913
  C      -8.183960     -6.259144      5.441316
  C      -8.577341     -4.950680      5.091399
  C      -7.672948     -4.076628      4.505199
  C      -6.359739     -4.507730      4.245054
  N      -5.378834     -3.764730      3.608563
  C      -5.610674     -2.420364      3.433362
  C      -5.341619     -1.762840      2.217041
  O      -5.056685     -2.191066      1.114364
  Cl     -5.552820      0.080239      2.422885
  C      -1.277545     -5.108565      5.641366
  C      -0.009027     -5.403761      6.193492
  C       0.267032     -5.051098      7.502665
  C      -0.703738     -4.392274      8.288442
  C      -1.959508     -4.121678      7.779013
  C      -2.283311     -4.509656      6.459903
  N      -3.492622     -4.293877      5.840596
  C      -4.609881     -3.989431      6.551192
  C      -4.980257     -4.638824      7.766178
  O      -4.477867     -5.558475      8.374246
  Cl     -6.568066     -3.901270      8.401259
  H      -2.252510     -3.041351     -0.749778
  H      -1.252140     -0.820028     -1.041236
  H      -0.967162      0.719902      0.901369
  H      -1.553709     -0.038978      3.185142
  H      -2.599636     -2.144356      5.791309
  H      -6.607241     -7.715451      5.481071
  H      -8.898250     -6.926317      5.926092
  H      -9.596769     -4.620027      5.294441
  H      -7.980362     -3.072049      4.215451
  H      -6.120542     -1.859629      4.218750
  H       0.761536     -5.865490      5.577701
  H       1.255294     -5.251053      7.918539
  H      -0.456510     -4.076302      9.302441
  H      -2.695990     -3.590025      8.379306
  H      -5.345847     -3.337467      6.093761
  N      -7.045532     -6.343450      1.920991
  N      -8.253851     -6.343056      2.039028
  H      -8.876648     -5.573203      1.677844
  H      -8.800030     -7.086056      2.551962
75
Coordinates from ORCA-job orca E -7353.775721059581
  N      -3.018458     -4.035930      1.717919
  C      -3.415520     -4.903665      0.614084
  C      -3.722675     -6.290535      1.167057
  N      -2.942277     -6.482410      2.416600
  C      -3.355450     -7.751544      3.096348
  C      -4.114044     -7.426043      4.381304
  N      -4.699686     -6.114583      4.191007
  Mo     -3.437539     -4.615612      3.659395
  N      -1.658716     -5.331770      4.347456
  C      -0.778735     -6.153293      3.516726
  C      -1.473998     -6.429165      2.191595
  H      -0.549159     -7.089491      4.054877
  H       0.180769     -5.644093      3.328027
  H      -1.126197     -7.374698      1.744858
  H      -1.265252     -5.620947      1.485693
  H      -4.878193     -8.191686      4.573293
  H      -3.432788     -7.403793      5.247508
  H      -4.002476     -8.306255      2.404564
  H      -2.469120     -8.366212      3.297647
  H      -2.596988     -4.957595     -0.121572
  H      -4.297699     -4.488715      0.100471
  H      -3.450669     -7.067415      0.430844
  H      -4.785032     -6.398478      1.420809
  C      -2.398982     -2.869664      1.422882
  C      -2.032944     -2.423307      0.125292
  C      -1.474507     -1.171659     -0.033467
  C      -1.294404     -0.302127      1.069777
  C      -1.620121     -0.720378      2.340914
  C      -2.119446     -2.028109      2.544041
  N      -2.474759     -2.550560      3.759989
  C      -1.988180     -2.043290      4.896101
  C      -0.689908     -1.481229      5.167119
  O      -0.375042     -0.818886      6.126252
  Cl      0.656720     -2.070102      4.031572
  C      -5.971748     -5.824101      4.564254
  C      -6.898168     -6.682970      5.196271
  C      -8.186326     -6.234838      5.445014
  C      -8.581248     -4.930604      5.080608
  C      -7.676920     -4.060210      4.487899
  C      -6.362336     -4.491078      4.234233
  N      -5.377458     -3.748709      3.602285
  C      -5.608747     -2.402977      3.435944
  C      -5.352686     -1.734759      2.223042
  O      -5.093456     -2.153958      1.110374
  Cl     -5.566922      0.105389      2.446299
  C      -1.280038     -5.108357      5.637811
  C      -0.012126     -5.405637      6.189292
  C       0.263694     -5.056134      7.499560
  C      -0.706727     -4.398866      8.286869
  C      -1.962252     -4.125925      7.777842
  C      -2.285480     -4.509949      6.457623
  N      -3.494325     -4.291126      5.838387
  C      -4.614647     -3.993031      6.547041
  C      -4.986736     -4.651496      7.756585
  O      -4.483257     -5.573454      8.360197
  Cl     -6.587130     -3.933660      8.382948
  H      -2.236038     -3.039877     -0.747970
  H      -1.216605     -0.825965     -1.035866
  H      -0.929229      0.712191      0.907986
  H      -1.528974     -0.042676      3.189249
  H      -2.596876     -2.141012      5.792474
  H      -6.607935     -7.689388      5.495047
  H      -8.899097     -6.897453      5.938225
  H      -9.601198     -4.598843      5.279171
  H      -7.984410     -3.057822      4.190570
  H      -6.115237     -1.849933      4.229088
  H       0.758649     -5.866186      5.572869
  H       1.251811     -5.257401      7.915112
  H      -0.459192     -4.086052      9.301767
  H      -2.699147     -3.595557      8.378782
  H      -5.352828     -3.343712      6.089041
  N      -7.040229     -6.418114      1.914652
  N      -8.243403     -6.451123      2.082445
  H      -8.900946     -5.696302      1.754828
  H      -8.747282     -7.207557      2.617277
75
Coordinates from ORCA-job orca E -7353.775936780617
  N      -3.019525     -4.029733      1.716326
  C      -3.421551     -4.892379      0.611685
  C      -3.726917     -6.279936      1.162400
  N      -2.946088     -6.473503      2.412570
  C      -3.358474     -7.743528      3.092030
  C      -4.126414     -7.419530      4.372548
  N      -4.707338     -6.106461      4.182674
  Mo     -3.438191     -4.610569      3.656721
  N      -1.660635     -5.329482      4.345187
  C      -0.780126     -6.147828      3.510711
  C      -1.477399     -6.423700      2.185706
  H      -0.547483     -7.084068      4.047401
  H       0.177726     -5.635815      3.321375
  H      -1.132414     -7.370276      1.739117
  H      -1.267496     -5.617038      1.478373
  H      -4.894424     -8.183559      4.555646
  H      -3.451191     -7.403305      5.243716
  H      -3.997103     -8.303718      2.396915
  H      -2.470044     -8.352166      3.301901
  H      -2.606044     -4.943758     -0.127427
  H      -4.306036     -4.474284      0.104862
  H      -3.462073     -7.061662      0.429375
  H      -4.791051     -6.380684      1.417418
  C      -2.399025     -2.863883      1.422594
  C      -2.034405     -2.414668      0.125131
  C      -1.475768     -1.163212     -0.032279
  C      -1.294187     -0.295239      1.072095
  C      -1.617587     -0.716082      2.342633
  C      -2.116177     -2.024685      2.544506
  N      -2.468494     -2.548586      3.759940
  C      -1.980625     -2.045458      4.897513
  C      -0.680421     -1.491760      5.174169
  O      -0.363971     -0.841009      6.140750
  Cl      0.671096     -2.101764      4.054942
  C      -5.978194     -5.812140      4.555346
  C      -6.902537     -6.665570      5.197432
  C      -8.192400     -6.217770      5.437618
  C      -8.589399     -4.919305      5.054769
  C      -7.684412     -4.052087      4.457910
  C      -6.367042     -4.481156      4.215972
  N      -5.375853     -3.739310      3.592651
  C      -5.604383     -2.393156      3.425164
  C      -5.316447     -1.722557      2.221665
  O      -5.016525     -2.134051      1.117029
  Cl     -5.515198      0.123591      2.453712
  C      -1.282126     -5.108819      5.635899
  C      -0.014449     -5.405864      6.187437
  C       0.259653     -5.058834      7.498864
  C      -0.712147     -4.404645      8.286968
  C      -1.967517     -4.131566      7.777429
  C      -2.288396     -4.512526      6.455865
  N      -3.495877     -4.292343      5.834896
  C      -4.618485     -3.996615      6.541295
  C      -4.992579     -4.658227      7.748469
  O      -4.486666     -5.578081      8.353415
  Cl     -6.591941     -3.940284      8.376375
  H      -2.239165     -3.029935     -0.748650
  H      -1.218513     -0.815805     -1.034269
  H      -0.929920      0.719541      0.911168
  H      -1.526187     -0.040763      3.192814
  H      -2.591377     -2.143692      5.792425
  H      -6.608826     -7.667142      5.508750
  H      -8.904379     -6.875293      5.938739
  H      -9.611110     -4.587568      5.244188
  H      -7.992112     -3.052886      4.149951
  H      -6.124394     -1.842191      4.210888
  H       0.757695     -5.863964      5.570857
  H       1.247725     -5.259538      7.914802
  H      -0.465338     -4.094304      9.302808
  H      -2.706235     -3.603495      8.378161
  H      -5.355916     -3.346662      6.082879
  N      -7.040930     -6.474261      1.928283
  N      -8.236832     -6.535929      2.147138
  H      -8.926867     -5.795172      1.857363
  H      -8.699223     -7.298764      2.708406
75
Coordinates from ORCA-job orca E -7353.775062275109
  N      -3.025932     -4.030600      1.720384
  C      -3.433942     -4.888887      0.614333
  C      -3.727382     -6.282840      1.156671
  N      -2.957387     -6.470413      2.414739
  C      -3.369877     -7.741384      3.093686
  C      -4.125209     -7.417834      4.380967
  N      -4.708166     -6.105624      4.195006
  Mo     -3.441663     -4.609472      3.662255
  N      -1.664957     -5.331091      4.346400
  C      -0.788128     -6.152037      3.511251
  C      -1.487646     -6.422963      2.187754
  H      -0.559758     -7.089598      4.046883
  H       0.171338     -5.643703      3.322789
  H      -1.145641     -7.369138      1.738025
  H      -1.277815     -5.615004      1.481626
  H      -4.891118     -8.182338      4.569430
  H      -3.443137     -7.401830      5.245903
  H      -4.017431     -8.295819      2.403723
  H      -2.483177     -8.353935      3.294603
  H      -2.626358     -4.930631     -0.132702
  H      -4.326275     -4.470190      0.123252
  H      -3.443053     -7.060619      0.427469
  H      -4.792216     -6.394971      1.397650
  C      -2.402329     -2.866091      1.427606
  C      -2.034866     -2.416895      0.130414
  C      -1.471881     -1.167845     -0.026340
  C      -1.288247     -0.300719      1.078561
  C      -1.613760     -0.720899      2.348466
  C      -2.117357     -2.028028      2.550155
  N      -2.470212     -2.549324      3.765942
  C      -1.976086     -2.047155      4.901730
  C      -0.671981     -1.504106      5.173557
  O      -0.344032     -0.856449      6.138149
  Cl      0.668559     -2.104764      4.033185
  C      -5.977536     -5.810912      4.572040
  C      -6.894183     -6.659465      5.229810
  C      -8.185926     -6.215251      5.467024
  C      -8.590843     -4.925691      5.064839
  C      -7.691547     -4.061869      4.455163
  C      -6.370907     -4.485399      4.220597
  N      -5.380311     -3.744165      3.596518
  C      -5.617002     -2.399571      3.425994
  C      -5.339877     -1.725745      2.223578
  O      -5.048069     -2.129495      1.114303
  Cl     -5.560100      0.118103      2.460389
  C      -1.283170     -5.110574      5.636306
  C      -0.014754     -5.408844      6.184732
  C       0.263751     -5.059029      7.494571
  C      -0.704350     -4.401034      8.283971
  C      -1.960832     -4.127182      7.777770
  C      -2.286537     -4.511126      6.458190
  N      -3.494844     -4.287942      5.839983
  C      -4.614822     -3.985671      6.546812
  C      -4.988786     -4.643611      7.755642
  O      -4.487732     -5.565871      8.359807
  Cl     -6.579373     -3.916364      8.386494
  H      -2.241419     -3.031251     -0.743445
  H      -1.212263     -0.821146     -1.027986
  H      -0.920643      0.712774      0.918173
  H      -1.520234     -0.047306      3.199783
  H      -2.584823     -2.140224      5.797999
  H      -6.592438     -7.653638      5.555160
  H      -8.892470     -6.868134      5.980864
  H      -9.614337     -4.596925      5.249337
  H      -8.004757     -3.068876      4.134668
  H      -6.138043     -1.853570      4.214060
  H       0.755263     -5.869133      5.567151
  H       1.252909     -5.259670      7.907931
  H      -0.453083     -4.088355      9.298017
  H      -2.697091     -3.595993      8.378528
  H      -5.348436     -3.332155      6.088538
  N      -7.022070     -6.475704      1.891361
  N      -8.202279     -6.531538      2.073668
  H      -8.871148     -5.789336      1.777348
  H      -8.672443     -7.292383      2.602894
75
Coordinates from ORCA-job orca E -7353.775056129811
  N      -3.000962     -4.027528      1.719935
  C      -3.409964     -4.870124      0.606889
  C      -3.714608     -6.256147      1.146768
  N      -2.944874     -6.464061      2.401351
  C      -3.359570     -7.739527      3.072084
  C      -4.124247     -7.428200      4.359391
  N      -4.708946     -6.114826      4.180788
  Mo     -3.444016     -4.619511      3.653238
  N      -1.664898     -5.335410      4.341228
  C      -0.781525     -6.147057      3.506097
  C      -1.474770     -6.415109      2.178662
  H      -0.548755     -7.084695      4.039224
  H       0.175423     -5.633209      3.321130
  H      -1.132168     -7.359615      1.726364
  H      -1.263598     -5.603178      1.476809
  H      -4.893924     -8.194365      4.534902
  H      -3.446009     -7.422817      5.229085
  H      -3.999076     -8.293448      2.372070
  H      -2.471515     -8.349874      3.277352
  H      -2.610222     -4.914103     -0.147955
  H      -4.300704     -4.440078      0.124592
  H      -3.458116     -7.036683      0.407453
  H      -4.777100     -6.356875      1.390844
  C      -2.363218     -2.867757      1.433041
  C      -1.976474     -2.419743      0.141108
  C      -1.400494     -1.175302     -0.007510
  C      -1.222345     -0.310459      1.100162
  C      -1.569590     -0.729563      2.365238
  C      -2.089251     -2.032146      2.557079
  N      -2.463638     -2.554301      3.766587
  C      -1.978032     -2.058886      4.907593
  C      -0.677433     -1.508508      5.185040
  O      -0.359847     -0.849185      6.144535
  Cl      0.655539     -2.045586      4.009576
  C      -5.976395     -5.826784      4.567876
  C      -6.881139     -6.675028      5.242894
  C      -8.172403     -6.233585      5.491246
  C      -8.585447     -4.948937      5.088159
  C      -7.695714     -4.084922      4.464426
  C      -6.376627     -4.504257      4.217188
  N      -5.392110     -3.762746      3.581104
  C      -5.641266     -2.417816      3.412963
  C      -5.404704     -1.753212      2.197386
  O      -5.168260     -2.156995      1.079361
  Cl     -5.666286      0.095940      2.426307
  C      -1.288422     -5.114552      5.631887
  C      -0.018769     -5.406525      6.182279
  C       0.257405     -5.051018      7.490886
  C      -0.713789     -4.392653      8.276900
  C      -1.971097     -4.125181      7.769347
  C      -2.295650     -4.516370      6.451035
  N      -3.502858     -4.296023      5.827613
  C      -4.619029     -3.974603      6.532445
  C      -5.002538     -4.614241      7.746663
  O      -4.525474     -5.545237      8.355308
  Cl     -6.569178     -3.848036      8.372426
  H      -2.177230     -3.029470     -0.737140
  H      -1.125617     -0.829896     -1.005948
  H      -0.842751      0.699240      0.943806
  H      -1.482567     -0.060300      3.220692
  H      -2.589512     -2.154577      5.801287
  H      -6.568116     -7.662877      5.574352
  H      -8.870675     -6.882451      6.021679
  H      -9.607617     -4.623068      5.283959
  H      -8.015573     -3.096065      4.142186
  H      -6.155241     -1.874328      4.205255
  H       0.753746     -5.864792      5.565930
  H       1.247251     -5.245971      7.905711
  H      -0.463757     -4.073973      9.289576
  H      -2.708404     -3.592484      8.367298
  H      -5.335974     -3.307341      6.071429
  N      -7.096970     -6.494564      1.902481
  N      -8.288651     -6.525260      2.127774
  H      -8.983198     -5.756905      1.854264
  H      -8.755145     -7.296730      2.681065
75
Coordinates from ORCA-job orca E -7353.774378864586
  N      -3.010533     -4.023754      1.708646
  C      -3.420985     -4.886531      0.602688
  C      -3.723554     -6.277145      1.154704
  N      -2.942520     -6.469966      2.404283
  C      -3.355750     -7.741067      3.081601
  C      -4.117855     -7.417950      4.365800
  N      -4.702122     -6.105672      4.177289
  Mo     -3.438578     -4.609741      3.648831
  N      -1.657847     -5.324921      4.337202
  C      -0.777060     -6.146814      3.506764
  C      -1.472578     -6.421514      2.179509
  H      -0.549022     -7.083675      4.045874
  H       0.184082     -5.638224      3.319047
  H      -1.128879     -7.368394      1.732851
  H      -1.259968     -5.614517      1.473415
  H      -4.884666     -8.181250      4.552947
  H      -3.438027     -7.400923      5.232771
  H      -3.999239     -8.297646      2.386374
  H      -2.467230     -8.353814      3.286568
  H      -2.615505     -4.937436     -0.148142
  H      -4.312102     -4.467073      0.106543
  H      -3.455968     -7.058910      0.421605
  H      -4.788083     -6.383558      1.416387
  C      -2.389643     -2.856281      1.418536
  C      -2.022919     -2.402784      0.123324
  C      -1.464738     -1.149536     -0.029512
  C      -1.286034     -0.283749      1.077320
  C      -1.612412     -0.708588      2.345686
  C      -2.110110     -2.018439      2.542896
  N      -2.468347     -2.543466      3.756888
  C      -1.988483     -2.040275      4.898433
  C      -0.686933     -1.493132      5.191453
  O      -0.380094     -0.849058      6.168198
  Cl      0.677461     -2.131138      4.104256
  C      -5.969447     -5.810173      4.562873
  C      -6.880535     -6.653664      5.231592
  C      -8.162096     -6.196043      5.495782
  C      -8.567390     -4.903267      5.101712
  C      -7.675926     -4.047018      4.475457
  C      -6.363404     -4.481005      4.218783
  N      -5.378850     -3.744674      3.580784
  C      -5.606515     -2.399316      3.402023
  C      -5.303472     -1.740796      2.185638
  O      -4.986299     -2.169721      1.087743
  Cl     -5.483974      0.110918      2.390514
  C      -1.284502     -5.103487      5.629823
  C      -0.019324     -5.401943      6.188536
  C       0.245443     -5.062451      7.503321
  C      -0.733034     -4.414536      8.289464
  C      -1.985132     -4.138766      7.773374
  C      -2.296059     -4.510485      6.447027
  N      -3.501099     -4.290296      5.822760
  C      -4.628365     -4.002004      6.528446
  C      -4.997839     -4.666391      7.737145
  O      -4.473226     -5.577749      8.345614
  Cl     -6.621449     -3.975304      8.359190
  H      -2.224880     -3.014986     -0.753418
  H      -1.205774     -0.799406     -1.029977
  H      -0.922237      0.732311      0.919964
  H      -1.524938     -0.034603      3.197683
  H      -2.610420     -2.132154      5.787067
  H      -6.579370     -7.650048      5.554019
  H      -8.862035     -6.842329      6.023033
  H      -9.584090     -4.565631      5.308308
  H      -7.989769     -3.049776      4.163586
  H      -6.129904     -1.839209      4.182726
  H       0.756795     -5.858577      5.575671
  H       1.230443     -5.266584      7.924808
  H      -0.494266     -4.111786      9.309291
  H      -2.729858     -3.616804      8.373727
  H      -5.374324     -3.359901      6.066358
  N      -7.067781     -6.501176      1.900644
  N      -8.285297     -6.557543      2.137481
  H      -8.985449     -5.819820      1.842345
  H      -8.752787     -7.329332      2.710157
75
Coordinates from ORCA-job orca E -7353.776069473642
  N      -3.013515     -4.027928      1.719954
  C      -3.424232     -4.882924      0.612191
  C      -3.725984     -6.273293      1.159002
  N      -2.952179     -6.467620      2.411713
  C      -3.364320     -7.740787      3.085489
  C      -4.126581     -7.423307      4.370009
  N      -4.707232     -6.108975      4.187065
  Mo     -3.441344     -4.613393      3.657873
  N      -1.663897     -5.332653      4.342926
  C      -0.783496     -6.147912      3.505790
  C      -1.482930     -6.421334      2.182756
  H      -0.548922     -7.084670      4.039833
  H       0.172864     -5.634663      3.315983
  H      -1.142103     -7.368247      1.734282
  H      -1.273864     -5.614566      1.475886
  H      -4.896938     -8.186904      4.548410
  H      -3.449445     -7.415058      5.240349
  H      -4.006523     -8.295853      2.390169
  H      -2.475997     -8.351148      3.288687
  H      -2.620415     -4.928841     -0.139627
  H      -4.317252     -4.459295      0.123929
  H      -3.458945     -7.055587      0.427845
  H      -4.790350     -6.371576      1.403244
  C      -2.383860     -2.866211      1.429311
  C      -2.014009     -2.415952      0.133758
  C      -1.453094     -1.165331     -0.020333
  C      -1.273563     -0.298428      1.085448
  C      -1.601836     -0.720200      2.353947
  C      -2.103922     -2.028242      2.552686
  N      -2.464759     -2.549726      3.766152
  C      -1.978252     -2.049328      4.905622
  C      -0.673927     -1.511971      5.193346
  O      -0.357015     -0.867217      6.164300
  Cl      0.678809     -2.127448      4.078838
  C      -5.978114     -5.819974      4.561763
  C      -6.894474     -6.674510      5.216227
  C      -8.189352     -6.235603      5.448786
  C      -8.594615     -4.942667      5.052259
  C      -7.694019     -4.070970      4.449815
  C      -6.373378     -4.493027      4.212655
  N      -5.382334     -3.750504      3.587465
  C      -5.615941     -2.404392      3.422345
  C      -5.326951     -1.730352      2.225454
  O      -5.024606     -2.130440      1.119268
  Cl     -5.544647      0.116129      2.467810
  C      -1.282589     -5.109659      5.632032
  C      -0.012232     -5.402304      6.179352
  C       0.267710     -5.046389      7.487106
  C      -0.700973     -4.387595      8.275099
  C      -1.959321     -4.119752      7.770214
  C      -2.286913     -4.510636      6.452880
  N      -3.495592     -4.290899      5.833057
  C      -4.613647     -3.974173      6.537861
  C      -4.994306     -4.620285      7.751147
  O      -4.502872     -5.545602      8.359453
  Cl     -6.573350     -3.868687      8.383284
  H      -2.218992     -3.028112     -0.742066
  H      -1.193121     -0.816919     -1.021020
  H      -0.908012      0.716177      0.926160
  H      -1.514077     -0.046718      3.206112
  H      -2.595463     -2.137847      5.795734
  H      -6.588711     -7.667350      5.544972
  H      -8.896470     -6.891603      5.961708
  H      -9.619359     -4.617162      5.236424
  H      -8.008344     -3.075765      4.132558
  H      -6.140087     -1.858280      4.207521
  H       0.757973     -5.861795      5.561539
  H       1.258382     -5.241860      7.899469
  H      -0.448484     -4.068741      9.286930
  H      -2.694872     -3.586704      8.369818
  H      -5.339764     -3.314402      6.074947
  N      -7.077585     -6.504118      1.901908
  N      -8.268879     -6.548474      2.124893
  H      -8.948731     -5.803228      1.844648
  H      -8.738533     -7.310682      2.677688
75
Coordinates from ORCA-job orca E -7353.776130696899
  N      -3.007575     -4.022031      1.716320
  C      -3.416010     -4.871540      0.606071
  C      -3.721343     -6.259903      1.149246
  N      -2.950178     -6.462126      2.403468
  C      -3.367175     -7.735629      3.076356
  C      -4.132649     -7.420030      4.360646
  N      -4.710795     -6.104550      4.179859
  Mo     -3.442240     -4.611619      3.652224
  N      -1.665972     -5.331100      4.341571
  C      -0.784152     -6.147027      3.506426
  C      -1.479465     -6.417403      2.179476
  H      -0.552694     -7.084962      4.041101
  H       0.174424     -5.634754      3.320010
  H      -1.139083     -7.364374      1.730656
  H      -1.266088     -5.609426      1.474273
  H      -4.904701     -8.182606      4.535154
  H      -3.457630     -7.415592      5.232071
  H      -4.007749     -8.289107      2.377886
  H      -2.480352     -8.347301      3.282288
  H      -2.612339     -4.916894     -0.145068
  H      -4.306572     -4.445129      0.118329
  H      -3.458704     -7.040472      0.413395
  H      -4.786826     -6.356796      1.391239
  C      -2.378528     -2.859072      1.428365
  C      -2.003526     -2.407947      0.134620
  C      -1.437176     -1.159459     -0.015663
  C      -1.257174     -0.295428      1.092221
  C      -1.591400     -0.718110      2.359122
  C      -2.099860     -2.024281      2.553251
  N      -2.463092     -2.549295      3.764331
  C      -1.972909     -2.052945      4.903609
  C      -0.669260     -1.509615      5.180688
  O      -0.346447     -0.865105      6.148290
  Cl      0.671224     -2.090213      4.033117
  C      -5.978134     -5.811359      4.562434
  C      -6.889145     -6.659297      5.227622
  C      -8.176592     -6.209701      5.478638
  C      -8.583770     -4.919925      5.080067
  C      -7.690773     -4.058934      4.460068
  C      -6.373058     -4.484714      4.214361
  N      -5.385113     -3.747632      3.579508
  C      -5.622560     -2.402526      3.403338
  C      -5.345860     -1.737460      2.192251
  O      -5.059262     -2.144071      1.081962
  Cl     -5.567969      0.115421      2.416498
  C      -1.289540     -5.111075      5.632834
  C      -0.022160     -5.408074      6.185217
  C       0.251212     -5.059755      7.496298
  C      -0.721441     -4.405514      8.283720
  C      -1.976738     -4.132887      7.773981
  C      -2.296665     -4.512907      6.451624
  N      -3.502802     -4.290832      5.828342
  C      -4.624935     -3.986052      6.532126
  C      -5.000081     -4.634665      7.745370
  O      -4.495045     -5.552429      8.356374
  Cl     -6.596670     -3.906258      8.368643
  H      -2.206044     -3.018845     -0.742813
  H      -1.171732     -0.810911     -1.015123
  H      -0.885617      0.717055      0.935666
  H      -1.501720     -0.048101      3.213543
  H      -2.584406     -2.148470      5.799064
  H      -6.582784     -7.651952      5.554383
  H      -8.878392     -6.857974      6.002906
  H      -9.604757     -4.588917      5.275421
  H      -8.006619     -3.066406      4.141631
  H      -6.143574     -1.851731      4.188285
  H       0.750396     -5.866483      5.569285
  H       1.239130     -5.259706      7.912901
  H      -0.474460     -4.094614      9.299422
  H      -2.716025     -3.604893      8.374358
  H      -5.357373     -3.333137      6.069515
  N      -7.069317     -6.540259      1.911363
  N      -8.254063     -6.590719      2.159227
  H      -8.954189     -5.839058      1.896401
  H      -8.702014     -7.364856      2.720448
75
Coordinates from ORCA-job orca E -7353.776255076844
  N      -3.006985     -4.023287      1.715850
  C      -3.416100     -4.875681      0.606769
  C      -3.723762     -6.263350      1.153340
  N      -2.950271     -6.463724      2.405430
  C      -3.365824     -7.736973      3.078704
  C      -4.130374     -7.420275      4.362741
  N      -4.708917     -6.104860      4.181003
  Mo     -3.441021     -4.611921      3.652178
  N      -1.664510     -5.331631      4.340964
  C      -0.783437     -6.147903      3.505381
  C      -1.480272     -6.419566      2.179548
  H      -0.550757     -7.085415      4.040113
  H       0.174540     -5.635267      3.317448
  H      -1.140580     -7.367149      1.731617
  H      -1.267651     -5.612643      1.473219
  H      -4.902181     -8.182394      4.537965
  H      -3.455199     -7.415046      5.233813
  H      -4.006921     -8.290763      2.381169
  H      -2.478557     -8.348595      3.283746
  H      -2.611804     -4.923988     -0.143939
  H      -4.305980     -4.449267      0.116657
  H      -3.463935     -7.046015      0.419054
  H      -4.788852     -6.357522      1.398946
  C      -2.378383     -2.860082      1.426686
  C      -2.005176     -2.408903      0.132398
  C      -1.441404     -1.159000     -0.018988
  C      -1.262051     -0.293964      1.088243
  C      -1.593855     -0.716945      2.355739
  C      -2.099279     -2.024304      2.551034
  N      -2.461715     -2.548987      3.762772
  C      -1.975591     -2.049288      4.902331
  C      -0.672589     -1.504026      5.184104
  O      -0.354675     -0.857875      6.153316
  Cl      0.675303     -2.096927      4.051509
  C      -5.978397     -5.812881      4.559133
  C      -6.892747     -6.662785      5.219022
  C      -8.182975     -6.216620      5.462149
  C      -8.588599     -4.926202      5.063873
  C      -7.691657     -4.061663      4.451505
  C      -6.372969     -4.486574      4.209913
  N      -5.383249     -3.746991      3.580471
  C      -5.619021     -2.401294      3.410956
  C      -5.332140     -1.729980      2.210070
  O      -5.032707     -2.131185      1.104022
  Cl     -5.558372      0.118164      2.446302
  C      -1.287445     -5.111476      5.631789
  C      -0.019780     -5.408868      6.183465
  C       0.254743     -5.059978      7.494017
  C      -0.716662     -4.403901      8.281341
  C      -1.971996     -4.130723      7.772247
  C      -2.293824     -4.512821      6.450959
  N      -3.499951     -4.289701      5.828117
  C      -4.621178     -3.981349      6.531617
  C      -5.001300     -4.630698      7.743478
  O      -4.505473     -5.553755      8.351782
  Cl     -6.588993     -3.890277      8.370705
  H      -2.207934     -3.020052     -0.744692
  H      -1.178189     -0.810025     -1.018926
  H      -0.893252      0.719778      0.930775
  H      -1.505168     -0.045826      3.209550
  H      -2.590884     -2.141275      5.794327
  H      -6.588008     -7.656203      5.545307
  H      -8.888211     -6.868103      5.980093
  H      -9.611046     -4.597115      5.254137
  H      -8.006083     -3.067977      4.133834
  H      -6.143484     -1.853567      4.194696
  H       0.751965     -5.868140      5.567215
  H       1.242778     -5.260318      7.910057
  H      -0.468691     -4.091885      9.296379
  H      -2.709704     -3.600805      8.372437
  H      -5.350309     -3.325388      6.068993
  N      -7.073246     -6.540113      1.916154
  N      -8.260920     -6.589372      2.170321
  H      -8.959054     -5.841281      1.907011
  H      -8.711782     -7.359703      2.736648
75
Coordinates from ORCA-job orca E -7353.776294452931
  N      -3.007069     -4.022250      1.717978
  C      -3.417701     -4.874517      0.608324
  C      -3.725660     -6.263035      1.155188
  N      -2.951838     -6.463379      2.406370
  C      -3.366318     -7.737988      3.077499
  C      -4.128535     -7.422897      4.363211
  N      -4.707394     -6.106880      4.184313
  Mo     -3.441673     -4.613055      3.653666
  N      -1.664469     -5.332143      4.340625
  C      -0.783827     -6.147216      3.503925
  C      -1.482009     -6.419178      2.179173
  H      -0.549393     -7.084410      4.037704
  H       0.172882     -5.633512      3.315135
  H      -1.142922     -7.366949      1.731151
  H      -1.270202     -5.612569      1.472466
  H      -4.900449     -8.185089      4.538029
  H      -3.452222     -7.419191      5.233579
  H      -4.009027     -8.290343      2.380029
  H      -2.478693     -8.350228      3.279518
  H      -2.614384     -4.922733     -0.143902
  H      -4.308675     -4.447489      0.119706
  H      -3.467121     -7.046441      0.421547
  H      -4.790411     -6.356782      1.401521
  C      -2.377618     -2.859449      1.429641
  C      -2.005282     -2.407067      0.135566
  C      -1.442290     -1.156884     -0.014906
  C      -1.262907     -0.292748      1.093019
  C      -1.593917     -0.716762      2.360288
  C      -2.098410     -2.024410      2.554838
  N      -2.461750     -2.548986      3.766240
  C      -1.976300     -2.050285      4.906739
  C      -0.672244     -1.510420      5.192354
  O      -0.354569     -0.866519      6.163589
  Cl      0.676112     -2.112027      4.066448
  C      -5.977350     -5.815209      4.562852
  C      -6.892020     -6.665985      5.221937
  C      -8.185675     -6.224795      5.456595
  C      -8.592001     -4.934952      5.056420
  C      -7.693129     -4.066947      4.449058
  C      -6.372948     -4.489641      4.211692
  N      -5.383757     -3.750368      3.581936
  C      -5.619008     -2.405192      3.408029
  C      -5.328411     -1.738855      2.201699
  O      -5.024567     -2.144328      1.095504
  Cl     -5.548136      0.113046      2.429718
  C      -1.285630     -5.110546      5.630574
  C      -0.016679     -5.405929      6.180589
  C       0.259896     -5.054500      7.490018
  C      -0.710603     -4.397410      8.277603
  C      -1.967055     -4.126182      7.770151
  C      -2.291264     -4.511737      6.450441
  N      -3.498306     -4.289805      5.828926
  C      -4.617975     -3.976743      6.532662
  C      -4.998812     -4.622714      7.746192
  O      -4.506171     -5.547122      8.355026
  Cl     -6.581726     -3.874375      8.375360
  H      -2.208398     -3.017115     -0.742147
  H      -1.180139     -0.806881     -1.014649
  H      -0.895127      0.721285      0.936226
  H      -1.505920     -0.045991      3.214546
  H      -2.593171     -2.140201      5.797528
  H      -6.586412     -7.658416      5.550529
  H      -8.892281     -6.878465      5.971469
  H      -9.616344     -4.608809      5.241443
  H      -8.008249     -3.073696      4.129576
  H      -6.144228     -1.854012      4.190391
  H       0.754376     -5.865434      5.563731
  H       1.248932     -5.253103      7.904752
  H      -0.460983     -4.082927      9.291452
  H      -2.703844     -3.595074      8.370347
  H      -5.345416     -3.319089      6.069218
  N      -7.084811     -6.540736      1.915460
  N      -8.272373     -6.581242      2.169478
  H      -8.962455     -5.832070      1.905909
  H      -8.730225     -7.346371      2.733297
75
Coordinates from ORCA-job orca E -7353.776366865005
  N      -3.004262     -4.020718      1.716410
  C      -3.414976     -4.871818      0.605744
  C      -3.725425     -6.259895      1.152094
  N      -2.952434     -6.462191      2.403354
  C      -3.367798     -7.737857      3.072672
  C      -4.128676     -7.424282      4.359700
  N      -4.707318     -6.107852      4.183060
  Mo     -3.443052     -4.613734      3.650915
  N      -1.665644     -5.331785      4.338958
  C      -0.784646     -6.146911      3.502837
  C      -1.482041     -6.418774      2.177466
  H      -0.550199     -7.084079      4.036755
  H       0.172125     -5.632961      3.314465
  H      -1.143491     -7.367000      1.730073
  H      -1.268951     -5.612637      1.470625
  H      -4.901171     -8.186170      4.533524
  H      -3.451826     -7.422341      5.229687
  H      -4.011726     -8.288253      2.374576
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  H      -3.469378     -7.043710      0.418041
  H      -4.790362     -6.352290      1.398869
  C      -2.373532     -2.858260      1.429341
  C      -1.998493     -2.405895      0.135929
  C      -1.434321     -1.155996     -0.013274
  C      -1.256320     -0.292253      1.095254
  C      -1.589984     -0.716337      2.361974
  C      -2.095858     -2.023736      2.555313
  N      -2.461580     -2.548801      3.766029
  C      -1.976582     -2.051229      4.907359
  C      -0.671683     -1.513959      5.193723
  O      -0.353325     -0.871775      6.165687
  Cl      0.675822     -2.117423      4.068085
  C      -5.976886     -5.815839      4.563253
  C      -6.889560     -6.665064      5.225913
  C      -8.182109     -6.222633      5.463275
  C      -8.589389     -4.933522      5.061965
  C      -7.692680     -4.067616      4.450036
  C      -6.373376     -4.491100      4.210373
  N      -5.385695     -3.752416      3.578378
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  C      -5.329270     -1.740081      2.202268
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  Cl     -5.556680      0.110279      2.433722
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  C      -0.018729     -5.403688      6.180049
  C       0.256808     -5.051658      7.489562
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  C      -1.970885     -4.124189      7.767948
  C      -2.293816     -4.509763      6.447869
  N      -3.500627     -4.288846      5.825774
  C      -4.621235     -3.976896      6.528559
  C      -5.000744     -4.620569      7.743609
  O      -4.503471     -5.541265      8.355851
  Cl     -6.589686     -3.877300      8.368183
  H      -2.200061     -3.015629     -0.742457
  H      -1.170050     -0.805992     -1.012595
  H      -0.887425      0.721531      0.939209
  H      -1.502973     -0.045995      3.216680
  H      -2.594421     -2.140472      5.798361
  H      -6.582943     -7.656818      5.555507
  H      -8.886986     -6.874533      5.981390
  H      -9.612863     -4.606304      5.249529
  H      -8.008470     -3.074513      4.130295
  H      -6.149355     -1.857206      4.185959
  H       0.752834     -5.863375      5.563919
  H       1.245623     -5.249865      7.905168
  H      -0.465986     -4.080124      9.290442
  H      -2.708452     -3.593431      8.367733
  H      -5.350621     -3.321987      6.063264
  N      -7.091156     -6.555303      1.916555
  N      -8.275848     -6.589388      2.180518
  H      -8.964607     -5.836980      1.923002
  H      -8.733125     -7.352853      2.745787
75
Coordinates from ORCA-job orca E -7353.776518325485
  N      -2.994268     -4.012368      1.711804
  C      -3.407208     -4.857753      0.597748
  C      -3.727770     -6.243829      1.141278
  N      -2.956429     -6.454791      2.392431
  C      -3.375980     -7.733640      3.055932
  C      -4.129765     -7.425428      4.348150
  N      -4.706203     -6.107486      4.179826
  Mo     -3.446420     -4.613159      3.642206
  N      -1.669035     -5.330719      4.332601
  C      -0.788420     -6.147003      3.497146
  C      -1.484429     -6.416171      2.169558
  H      -0.555790     -7.085465      4.030741
  H       0.169996     -5.633738      3.310580
  H      -1.149587     -7.366186      1.723248
  H      -1.266138     -5.611330      1.462619
  H      -4.904671     -8.185354      4.518861
  H      -3.450463     -7.430693      5.215744
  H      -4.025757     -8.275638      2.357006
  H      -2.490807     -8.352634      3.248312
  H      -2.604222     -4.910192     -0.154399
  H      -4.294118     -4.422441      0.109630
  H      -3.481833     -7.029187      0.405345
  H      -4.793231     -6.328444      1.391142
  C      -2.358375     -2.851819      1.429428
  C      -1.974892     -2.399391      0.138563
  C      -1.405838     -1.150949     -0.006048
  C      -1.230887     -0.289318      1.104649
  C      -1.572723     -0.713973      2.369219
  C      -2.083967     -2.020158      2.558063
  N      -2.458672     -2.545807      3.765867
  C      -1.979914     -2.046857      4.909080
  C      -0.674007     -1.511502      5.200518
  O      -0.358631     -0.867311      6.172504
  Cl      0.677987     -2.117755      4.080755
  C      -5.974940     -5.815821      4.563523
  C      -6.881553     -6.662587      5.235516
  C      -8.171619     -6.217776      5.480019
  C      -8.583574     -4.932653      5.071781
  C      -7.693487     -4.071369      4.447117
  C      -6.374851     -4.493766      4.204650
  N      -5.390507     -3.755121      3.567223
  C      -5.632422     -2.411480      3.390824
  C      -5.335004     -1.742837      2.192110
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  Cl     -5.579673      0.106722      2.427558
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  C      -0.028294     -5.410158      6.178418
  C       0.244222     -5.060902      7.488984
  C      -0.727629     -4.401862      8.273969
  C      -1.981186     -4.126608      7.762388
  C      -2.301681     -4.509467      6.440776
  N      -3.505678     -4.283248      5.816508
  C      -4.626815     -3.967274      6.515721
  C      -5.013052     -4.606568      7.731263
  O      -4.523688     -5.528507      8.346375
  Cl     -6.596369     -3.850871      8.351392
  H      -2.172436     -3.007618     -0.741917
  H      -1.134847     -0.800769     -1.003627
  H      -0.857459      0.723373      0.951595
  H      -1.487589     -0.045636      3.225636
  H      -2.604955     -2.127424      5.794940
  H      -6.571171     -7.652511      5.567585
  H      -8.872229     -6.866041      6.006143
  H      -9.605916     -4.604602      5.263486
  H      -8.013057     -3.080847      4.123922
  H      -6.164341     -1.862429      4.168310
  H       0.743622     -5.871485      5.563903
  H       1.230982     -5.262777      7.907314
  H      -0.480919     -4.089159      9.289111
  H      -2.718258     -3.594032      8.361010
  H      -5.351601     -3.310476      6.047826
  N      -7.105065     -6.626379      1.929485
  N      -8.276887     -6.641452      2.242429
  H      -8.968261     -5.877401      2.014096
  H      -8.722992     -7.402551      2.819554
75
Coordinates from ORCA-job orca E -7353.776614703656
  N      -2.986051     -4.004335      1.709222
  C      -3.400083     -4.846720      0.592025
  C      -3.729618     -6.231483      1.133521
  N      -2.959546     -6.449234      2.384664
  C      -3.382500     -7.731252      3.041997
  C      -4.124771     -7.427984      4.342020
  N      -4.702277     -6.109441      4.182103
  Mo     -3.450431     -4.612744      3.635684
  N      -1.671694     -5.328126      4.327944
  C      -0.791838     -6.146313      3.493827
  C      -1.486368     -6.413877      2.164783
  H      -0.561181     -7.085311      4.027444
  H       0.167697     -5.634474      3.308464
  H      -1.153823     -7.365138      1.719618
  H      -1.264238     -5.610159      1.457831
  H      -4.899443     -8.187402      4.514694
  H      -3.438947     -7.437351      5.204191
  H      -4.041549     -8.263033      2.344025
  H      -2.499764     -8.357455      3.222567
  H      -2.596275     -4.902916     -0.159307
  H      -4.283936     -4.405917      0.102817
  H      -3.492523     -7.019251      0.397148
  H      -4.794610     -6.312414      1.389813
  C      -2.347894     -2.844025      1.431758
  C      -1.958622     -2.389924      0.143453
  C      -1.386471     -1.142076      0.003301
  C      -1.213551     -0.283181      1.116123
  C      -1.561070     -0.709647      2.378491
  C      -2.076641     -2.014933      2.563136
  N      -2.456786     -2.541984      3.769038
  C      -1.974232     -2.049125      4.913322
  C      -0.663798     -1.526395      5.202545
  O      -0.340961     -0.889569      6.175027
  Cl      0.679266     -2.138733      4.077572
  C      -5.971158     -5.818679      4.569361
  C      -6.872895     -6.663868      5.250431
  C      -8.163931     -6.221663      5.496089
  C      -8.581648     -4.941908      5.078563
  C      -7.695515     -4.081219      4.445663
  C      -6.375909     -4.500171      4.203191
  N      -5.395936     -3.761274      3.558784
  C      -5.644067     -2.419665      3.375672
  C      -5.342847     -1.753560      2.176143
  O      -5.014508     -2.151301      1.078345
  Cl     -5.601362      0.096396      2.406684
  C      -1.300211     -5.108023      5.619433
  C      -0.036027     -5.410735      6.178097
  C       0.233945     -5.061640      7.489028
  C      -0.737908     -4.398673      8.271205
  C      -1.988965     -4.119751      7.756211
  C      -2.307491     -4.502839      6.433934
  N      -3.510247     -4.275786      5.808476
  C      -4.632269     -3.957683      6.505147
  C      -5.021175     -4.592530      7.722452
  O      -4.532016     -5.512153      8.342035
  Cl     -6.607875     -3.835128      8.335894
  H      -2.152830     -2.996152     -0.739018
  H      -1.110842     -0.790694     -0.992533
  H      -0.836807      0.728896      0.966298
  H      -1.477328     -0.043269      3.236379
  H      -2.599203     -2.128124      5.803147
  H      -6.558261     -7.650817      5.587056
  H      -8.861953     -6.869290      6.027823
  H      -9.604890     -4.616432      5.269831
  H      -8.019844     -3.094719      4.116108
  H      -6.180861     -1.869691      4.148915
  H       0.735985     -5.875124      5.565928
  H       1.218773     -5.266658      7.910278
  H      -0.492964     -4.086087      9.286805
  H      -2.725687     -3.584457      8.352798
  H      -5.356450     -3.302048      6.033981
  N      -7.121979     -6.676934      1.936106
  N      -8.284485     -6.661108      2.282676
  H      -8.963680     -5.882423      2.071382
  H      -8.736826     -7.413563      2.866448
75
Coordinates from ORCA-job orca E -7353.776706857515
  N      -2.983819     -3.998932      1.706448
  C      -3.399074     -4.839000      0.587300
  C      -3.732754     -6.224090      1.125188
  N      -2.963272     -6.445929      2.377247
  C      -3.388734     -7.729918      3.030040
  C      -4.116960     -7.429903      4.338484
  N      -4.697483     -6.111855      4.185123
  Mo     -3.453678     -4.611786      3.630624
  N      -1.673806     -5.326483      4.322412
  C      -0.795833     -6.146805      3.488629
  C      -1.489725     -6.411731      2.158909
  H      -0.568585     -7.086783      4.021478
  H       0.165090     -5.637824      3.304727
  H      -1.157763     -7.362791      1.712809
  H      -1.266048     -5.607371      1.453193
  H      -4.888814     -8.190426      4.518114
  H      -3.422034     -7.439291      5.193197
  H      -4.058690     -8.251908      2.335321
  H      -2.508802     -8.363381      3.197573
  H      -2.593857     -4.896804     -0.162497
  H      -4.280854     -4.394645      0.097535
  H      -3.498081     -7.012004      0.388444
  H      -4.796244     -6.305575      1.386580
  C      -2.340009     -2.841158      1.432602
  C      -1.944056     -2.387800      0.146112
  C      -1.366454     -1.142321      0.008710
  C      -1.195208     -0.284628      1.122615
  C      -1.549860     -0.710112      2.383285
  C      -2.070282     -2.013616      2.565693
  N      -2.459239     -2.537058      3.769812
  C      -1.985155     -2.040141      4.915404
  C      -0.675018     -1.517342      5.215439
  O      -0.360764     -0.875051      6.189523
  Cl      0.680702     -2.136625      4.105775
  C      -5.964926     -5.821778      4.578212
  C      -6.859344     -6.664803      5.270862
  C      -8.150706     -6.225557      5.521510
  C      -8.575697     -4.950794      5.096487
  C      -7.695880     -4.091256      4.452235
  C      -6.375690     -4.506791      4.206404
  N      -5.400478     -3.767925      3.553480
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  C      -5.350638     -1.765092      2.160602
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  Cl     -5.617808      0.084886      2.381713
  C      -1.304272     -5.109426      5.614626
  C      -0.042517     -5.417863      6.175696
  C       0.226089     -5.071861      7.487480
  C      -0.744435     -4.405570      8.268558
  C      -1.993087     -4.120916      7.751404
  C      -2.310931     -4.501769      6.428199
  N      -3.512160     -4.269954      5.802298
  C      -4.633100     -3.946400      6.497890
  C      -5.024951     -4.578519      7.715741
  O      -4.539818     -5.499403      8.336538
  Cl     -6.609528     -3.815060      8.327123
  H      -2.136625     -2.993078     -0.737303
  H      -1.085221     -0.791777     -0.985812
  H      -0.814041      0.725858      0.975112
  H      -1.467561     -0.043899      3.241644
  H      -2.619470     -2.109469      5.796595
  H      -6.538604     -7.647376      5.613325
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  H      -9.598907     -4.627238      5.291359
  H      -8.025998     -3.108433      4.117445
  H      -6.193903     -1.877107      4.133620
  H       0.728831     -5.884555      5.564562
  H       1.209090     -5.281729      7.910537
  H      -0.500230     -4.095106      9.284898
  H      -2.728777     -3.583088      8.346991
  H      -5.353890     -3.287534      6.025875
  N      -7.131623     -6.709480      1.932278
  N      -8.287977     -6.665509      2.293853
  H      -8.951433     -5.871975      2.090213
  H      -8.752575     -7.409394      2.877120
75
Coordinates from ORCA-job orca E -7353.776838825742
  N      -2.986679     -3.993074      1.704973
  C      -3.399265     -4.832827      0.584779
  C      -3.736569     -6.218027      1.118216
  N      -2.967457     -6.443172      2.372646
  C      -3.396980     -7.726871      3.023083
  C      -4.109679     -7.427462      4.339768
  N      -4.693808     -6.110990      4.189416
  Mo     -3.456107     -4.607060      3.628314
  N      -1.677088     -5.324532      4.320789
  C      -0.801535     -6.148988      3.487954
  C      -1.493797     -6.410139      2.156867
  H      -0.581070     -7.090590      4.020501
  H       0.162457     -5.645454      3.306739
  H      -1.160896     -7.360126      1.709057
  H      -1.268242     -5.604189      1.453541
  H      -4.877058     -8.190132      4.530890
  H      -3.403917     -7.432932      5.186026
  H      -4.079665     -8.238731      2.333316
  H      -2.521022     -8.368875      3.177559
  H      -2.588686     -4.892235     -0.158935
  H      -4.276938     -4.386736      0.089823
  H      -3.500417     -7.004931      0.381252
  H      -4.798787     -6.299897      1.384000
  C      -2.340463     -2.836417      1.433792
  C      -1.941506     -2.383743      0.148284
  C      -1.360400     -1.139826      0.011679
  C      -1.188724     -0.282825      1.125796
  C      -1.546026     -0.707865      2.385566
  C      -2.070071     -2.009984      2.567654
  N      -2.461346     -2.530751      3.771895
  C      -1.981917     -2.037144      4.916276
  C      -0.668483     -1.526281      5.214639
  O      -0.346845     -0.886819      6.186733
  Cl      0.679716     -2.158661      4.105044
  C      -5.961488     -5.824147      4.581852
  C      -6.851809     -6.670171      5.277864
  C      -8.145385     -6.236814      5.530647
  C      -8.576200     -4.964241      5.102268
  C      -7.700016     -4.101586      4.453237
  C      -6.377558     -4.511218      4.207589
  N      -5.403687     -3.768873      3.551389
  C      -5.662379     -2.431442      3.356837
  C      -5.357344     -1.765337      2.154662
  O      -5.015240     -2.165070      1.058091
  Cl     -5.625032      0.082788      2.371942
  C      -1.309312     -5.110397      5.613980
  C      -0.050598     -5.425805      6.177680
  C       0.217812     -5.080710      7.489887
  C      -0.749654     -4.407669      8.268851
  C      -1.995808     -4.116629      7.749343
  C      -2.314382     -4.498054      6.426217
  N      -3.514566     -4.261664      5.799898
  C      -4.634059     -3.931591      6.494369
  C      -5.030804     -4.563291      7.710761
  O      -4.553881     -5.488262      8.330420
  Cl     -6.607052     -3.788402      8.323821
  H      -2.134555     -2.989271     -0.734821
  H      -1.076501     -0.789911     -0.982068
  H      -0.804657      0.726863      0.979869
  H      -1.463050     -0.040991      3.243433
  H      -2.614387     -2.102491      5.798411
  H      -6.525775     -7.650006      5.623906
  H      -8.832564     -6.883927      6.077923
  H      -9.600415     -4.644170      5.298435
  H      -8.035038     -3.120805      4.115282
  H      -6.205109     -1.881506      4.127306
  H       0.719368     -5.896439      5.567934
  H       1.198972     -5.295974      7.914818
  H      -0.505038     -4.097201      9.285186
  H      -2.729398     -3.573544      8.342577
  H      -5.349489     -3.266913      6.022686
  N      -7.120916     -6.741810      1.928279
  N      -8.271777     -6.673195      2.302227
  H      -8.918988     -5.864486      2.104823
  H      -8.747648     -7.409820      2.886365
75
Coordinates from ORCA-job orca E -7353.776991428424
  N      -2.989887     -3.989200      1.702518
  C      -3.393960     -4.830756      0.581025
  C      -3.737859     -6.214589      1.110331
  N      -2.969824     -6.444556      2.367252
  C      -3.406553     -7.726314      3.015539
  C      -4.094964     -7.424884      4.344237
  N      -4.686800     -6.111720      4.195503
  Mo     -3.456367     -4.602931      3.624838
  N      -1.679967     -5.325707      4.320109
  C      -0.808261     -6.158190      3.490638
  C      -1.496438     -6.412760      2.156774
  H      -0.600412     -7.102470      4.023615
  H       0.161674     -5.664674      3.314420
  H      -1.161026     -7.360441      1.706088
  H      -1.267754     -5.603512      1.458243
  H      -4.852704     -8.191508      4.557029
  H      -3.371458     -7.420229      5.175632
  H      -4.108759     -8.223068      2.334678
  H      -2.537625     -8.382072      3.151305
  H      -2.573223     -4.893498     -0.151231
  H      -4.263988     -4.383436      0.074052
  H      -3.502149     -7.000894      0.372789
  H      -4.798060     -6.296580      1.382101
  C      -2.343609     -2.831706      1.433192
  C      -1.943663     -2.379007      0.148319
  C      -1.361921     -1.135125      0.011415
  C      -1.190409     -0.277856      1.125055
  C      -1.548556     -0.703068      2.384296
  C      -2.073413     -2.005056      2.566787
  N      -2.463930     -2.524370      3.771936
  C      -1.981841     -2.033334      4.915935
  C      -0.667694     -1.521471      5.213946
  O      -0.346367     -0.883550      6.187991
  Cl      0.682327     -2.147730      4.098528
  C      -5.953714     -5.827059      4.589661
  C      -6.839374     -6.675134      5.290692
  C      -8.134523     -6.247443      5.548373
  C      -8.571471     -4.977440      5.118085
  C      -7.699834     -4.112289      4.462374
  C      -6.376007     -4.516605      4.213861
  N      -5.406020     -3.773104      3.548988
  C      -5.673074     -2.438904      3.347454
  C      -5.371356     -1.773043      2.143482
  O      -5.029037     -2.177019      1.046901
  Cl     -5.643675      0.071631      2.351379
  C      -1.315135     -5.115302      5.614690
  C      -0.061358     -5.441809      6.182549
  C       0.205912     -5.099567      7.495815
  C      -0.757744     -4.417830      8.271736
  C      -1.999806     -4.116532      7.748297
  C      -2.318179     -4.496366      6.424495
  N      -3.516204     -4.253171      5.796496
  C      -4.634189     -3.915835      6.489875
  C      -5.036050     -4.547413      7.704481
  O      -4.566883     -5.476924      8.322599
  Cl     -6.606588     -3.763775      8.318002
  H      -2.137414     -2.985460     -0.733869
  H      -1.077008     -0.785415     -0.981905
  H      -0.805350      0.731913      0.980199
  H      -1.465051     -0.035249      3.241338
  H      -2.613684     -2.105430      5.801131
  H      -6.508165     -7.652692      5.639617
  H      -8.816176     -6.896832      6.102103
  H      -9.596301     -4.661026      5.317621
  H      -8.040261     -3.134469      4.120953
  H      -6.218571     -1.889618      4.116804
  H       0.706534     -5.918549      5.574964
  H       1.183644     -5.323924      7.923993
  H      -0.513489     -4.109180      9.288698
  H      -2.730990     -3.567033      8.338516
  H      -5.343461     -3.244214      6.018810
  N      -7.100533     -6.764077      1.918923
  N      -8.246929     -6.652225      2.297460
  H      -8.860762     -5.818836      2.101611
  H      -8.750958     -7.372955      2.879969
75
Coordinates from ORCA-job orca E -7353.777165370026
  N      -2.996663     -3.983886      1.701172
  C      -3.386993     -4.828267      0.577795
  C      -3.739541     -6.209245      1.103529
  N      -2.972708     -6.445406      2.361941
  C      -3.418036     -7.723995      3.008198
  C      -4.075304     -7.419024      4.351218
  N      -4.678314     -6.110991      4.203457
  Mo     -3.455794     -4.596507      3.622661
  N      -1.684485     -5.327026      4.321935
  C      -0.817619     -6.169266      3.496812
  C      -1.499723     -6.414201      2.158810
  H      -0.626133     -7.116851      4.029760
  H       0.159601     -5.688658      3.327859
  H      -1.160156     -7.358112      1.703217
  H      -1.267209     -5.599410      1.467987
  H      -4.819001     -8.191176      4.592102
  H      -3.330101     -7.399238      5.163117
  H      -4.144439     -8.202045      2.339727
  H      -2.558700     -8.396758      3.120857
  H      -2.552843     -4.894733     -0.138867
  H      -4.246676     -4.380989      0.053707
  H      -3.505888     -6.994156      0.364070
  H      -4.798995     -6.288913      1.379677
  C      -2.350874     -2.825215      1.431925
  C      -1.951535     -2.373006      0.146779
  C      -1.367760     -1.130185      0.008385
  C      -1.192894     -0.273322      1.121330
  C      -1.550787     -0.698259      2.380853
  C      -2.078609     -1.998828      2.564150
  N      -2.467802     -2.515711      3.770701
  C      -1.978436     -2.027108      4.911739
  C      -0.662223     -1.521921      5.203788
  O      -0.332529     -0.880119      6.170474
  Cl      0.674957     -2.164014      4.089157
  C      -5.943919     -5.829873      4.599377
  C      -6.824432     -6.681239      5.303128
  C      -8.121672     -6.260875      5.563034
  C      -8.565630     -4.994278      5.131809
  C      -7.699716     -4.125964      4.471590
  C      -6.374204     -4.522890      4.221897
  N      -5.409563     -3.777666      3.548485
  C      -5.687434     -2.447517      3.339480
  C      -5.390343     -1.783153      2.134052
  O      -5.046880     -2.193712      1.040088
  Cl     -5.674228      0.055777      2.329093
  C      -1.322234     -5.119977      5.618020
  C      -0.073139     -5.457292      6.189635
  C       0.192894     -5.118867      7.504270
  C      -0.767812     -4.430540      8.277776
  C      -2.006109     -4.119472      7.750723
  C      -2.323630     -4.495749      6.425698
  N      -3.518964     -4.244647      5.795278
  C      -4.636410     -3.901677      6.487403
  C      -5.043187     -4.533988      7.699967
  O      -4.577952     -5.466855      8.317056
  Cl     -6.615259     -3.748453      8.310699
  H      -2.148225     -2.980228     -0.734099
  H      -1.082865     -0.781111     -0.985193
  H      -0.805183      0.735389      0.976952
  H      -1.464103     -0.030269      3.237296
  H      -2.603963     -2.094368      5.796700
  H      -6.487580     -7.656061      5.654583
  H      -8.797562     -6.913407      6.120865
  H      -9.591647     -4.683320      5.333573
  H      -8.046233     -3.151455      4.127749
  H      -6.237412     -1.899378      4.106229
  H       0.692677     -5.939510      5.583843
  H       1.167301     -5.352079      7.935549
  H      -0.524305     -4.124739      9.295762
  H      -2.735597     -3.564932      8.338600
  H      -5.340964     -3.224439      6.016220
  N      -7.070387     -6.789569      1.909236
  N      -8.209253     -6.619144      2.290540
  H      -8.775764     -5.751919      2.099944
  H      -8.749576     -7.316479      2.869179
75
Coordinates from ORCA-job orca E -7353.777383532616
  N      -3.000180     -3.983099      1.701190
  C      -3.375694     -4.829358      0.574538
  C      -3.738754     -6.206714      1.098065
  N      -2.975326     -6.450241      2.356929
  C      -3.431506     -7.725560      3.000409
  C      -4.060878     -7.417210      4.355761
  N      -4.671678     -6.112911      4.208904
  Mo     -3.452439     -4.595226      3.621344
  N      -1.688382     -5.335376      4.325193
  C      -0.826708     -6.188584      3.505455
  C      -1.501951     -6.422084      2.162469
  H      -0.652994     -7.139558      4.038735
  H       0.158613     -5.721931      3.344636
  H      -1.160124     -7.362784      1.701777
  H      -1.263223     -5.601826      1.480156
  H      -4.793755     -8.193056      4.620141
  H      -3.297626     -7.385399      5.151112
  H      -4.180625     -8.184005      2.342643
  H      -2.583049     -8.415947      3.092701
  H      -2.529564     -4.898584     -0.127760
  H      -4.225297     -4.382490      0.034223
  H      -3.510260     -6.990901      0.356144
  H      -4.799891     -6.278012      1.373317
  C      -2.359352     -2.820293      1.431289
  C      -1.964935     -2.366008      0.145263
  C      -1.385995     -1.120884      0.005618
  C      -1.210825     -0.263682      1.118548
  C      -1.564450     -0.690700      2.378987
  C      -2.087792     -1.993168      2.562461
  N      -2.469734     -2.514156      3.770414
  C      -1.977496     -2.029730      4.912127
  C      -0.662286     -1.516326      5.201515
  O      -0.334714     -0.874733      6.170255
  Cl      0.675645     -2.148574      4.079890
  C      -5.935657     -5.833980      4.606581
  C      -6.813969     -6.688082      5.309259
  C      -8.110956     -6.269076      5.570493
  C      -8.556926     -5.001731      5.142781
  C      -7.695079     -4.132920      4.480570
  C      -6.370015     -4.528023      4.228741
  N      -5.410335     -3.784123      3.547367
  C      -5.695596     -2.456697      3.331937
  C      -5.404192     -1.798087      2.123351
  O      -5.062705     -2.217606      1.032850
  Cl     -5.693214      0.038422      2.306004
  C      -1.327278     -5.129289      5.622323
  C      -0.080875     -5.473196      6.196040
  C       0.185774     -5.133823      7.510624
  C      -0.772356     -4.439081      8.281590
  C      -2.008774     -4.122744      7.752654
  C      -2.326943     -4.499723      6.428010
  N      -3.519836     -4.242743      5.795021
  C      -4.635232     -3.888568      6.484886
  C      -5.048374     -4.514332      7.698254
  O      -4.592611     -5.450837      8.317115
  Cl     -6.611168     -3.711210      8.307777
  H      -2.162716     -2.974044     -0.735101
  H      -1.104912     -0.770333     -0.988694
  H      -0.826248      0.746323      0.974069
  H      -1.477179     -0.023160      3.235961
  H      -2.598992     -2.111042      5.802190
  H      -6.475178     -7.662776      5.660340
  H      -8.784168     -6.922795      6.128605
  H      -9.582695     -4.691781      5.347675
  H      -8.043672     -3.157328      4.139259
  H      -6.247860     -1.907105      4.096203
  H       0.682858     -5.960703      5.591773
  H       1.158481     -5.371517      7.943574
  H      -0.528176     -4.132419      9.299275
  H      -2.736459     -3.563179      8.338231
  H      -5.331819     -3.204525      6.011405
  N      -7.038448     -6.819439      1.898500
  N      -8.165793     -6.584785      2.279216
  H      -8.677432     -5.681384      2.099115
  H      -8.744726     -7.253918      2.851835
75
Coordinates from ORCA-job orca E -7353.777686466271
  N      -2.997930     -3.984651      1.702630
  C      -3.357035     -4.833275      0.571221
  C      -3.733989     -6.204980      1.096468
  N      -2.977067     -6.455534      2.354383
  C      -3.446364     -7.727839      2.993886
  C      -4.046864     -7.417284      4.361771
  N      -4.662864     -6.114800      4.218220
  Mo     -3.445720     -4.596349      3.621417
  N      -1.689974     -5.345497      4.330287
  C      -0.834899     -6.212388      3.517707
  C      -1.502580     -6.433533      2.169628
  H      -0.680863     -7.166181      4.052519
  H       0.159375     -5.761657      3.365085
  H      -1.161335     -7.372103      1.704264
  H      -1.255523     -5.608575      1.496068
  H      -4.772347     -8.194301      4.645394
  H      -3.267415     -7.378648      5.141549
  H      -4.219863     -8.161932      2.347108
  H      -2.611663     -8.438683      3.063825
  H      -2.500828     -4.905687     -0.118578
  H      -4.196892     -4.387079      0.015488
  H      -3.516969     -6.991935      0.353296
  H      -4.798934     -6.259610      1.366500
  C      -2.367662     -2.814727      1.430136
  C      -1.984267     -2.355423      0.142604
  C      -1.416448     -1.104877      0.001731
  C      -1.239793     -0.248299      1.115226
  C      -1.583070     -0.680369      2.377203
  C      -2.097702     -1.986477      2.559865
  N      -2.468602     -2.515019      3.768991
  C      -1.973195     -2.032738      4.910017
  C      -0.659991     -1.505267      5.191482
  O      -0.334100     -0.858829      6.157866
  Cl      0.674880     -2.125182      4.061474
  C      -5.925439     -5.837283      4.619387
  C      -6.803635     -6.693086      5.319922
  C      -8.100366     -6.273395      5.577427
  C      -8.547203     -5.006619      5.150308
  C      -7.687502     -4.138232      4.488649
  C      -6.362346     -4.532713      4.237762
  N      -5.408909     -3.792580      3.547310
  C      -5.700223     -2.466677      3.324721
  C      -5.419677     -1.819958      2.108656
  O      -5.085588     -2.249604      1.021405
  Cl     -5.719013      0.017873      2.276036
  C      -1.330443     -5.140562      5.628733
  C      -0.086411     -5.490463      6.204210
  C       0.179645     -5.151948      7.519080
  C      -0.777608     -4.454148      8.288510
  C      -2.012120     -4.132787      7.758111
  C      -2.329198     -4.506987      6.432593
  N      -3.518431     -4.242919      5.795765
  C      -4.633378     -3.878775      6.481625
  C      -5.054259     -4.495506      7.697078
  O      -4.605347     -5.433268      8.320471
  Cl     -6.615228     -3.679159      8.298252
  H      -2.182942     -2.962931     -0.738081
  H      -1.144992     -0.750170     -0.993910
  H      -0.862870      0.764762      0.969776
  H      -1.495175     -0.015388      3.236294
  H      -2.587910     -2.124162      5.804135
  H      -6.465044     -7.668498      5.669531
  H      -8.775534     -6.928542      6.130353
  H      -9.573882     -4.698357      5.353109
  H      -8.037381     -3.163070      4.148232
  H      -6.251351     -1.912781      4.086671
  H       0.675852     -5.982290      5.601394
  H       1.150689     -5.393245      7.953357
  H      -0.533817     -4.148935      9.306670
  H      -2.738721     -3.571038      8.343077
  H      -5.323571     -3.191664      6.002587
  N      -7.007748     -6.857980      1.885939
  N      -8.114762     -6.538971      2.265413
  H      -8.550030     -5.593902      2.103968
  H      -8.744312     -7.166779      2.830851
75
Coordinates from ORCA-job orca E -7353.777976066604
  N      -2.993279     -3.985529      1.704452
  C      -3.342374     -4.834220      0.568156
  C      -3.730586     -6.201985      1.095482
  N      -2.981857     -6.457431      2.352855
  C      -3.463494     -7.728312      2.987386
  C      -4.039026     -7.419012      4.365939
  N      -4.654613     -6.114975      4.229911
  Mo     -3.439302     -4.597872      3.623247
  N      -1.690301     -5.353472      4.334164
  C      -0.843403     -6.234133      3.527627
  C      -1.505716     -6.443927      2.175685
  H      -0.707369     -7.189640      4.064230
  H       0.158574     -5.798622      3.381084
  H      -1.168883     -7.382145      1.706262
  H      -1.250194     -5.615870      1.509049
  H      -4.763304     -8.193686      4.658544
  H      -3.249112     -7.382837      5.134658
  H      -4.258589     -8.137359      2.350065
  H      -2.642910     -8.457759      3.035170
  H      -2.481591     -4.907197     -0.115721
  H      -4.177069     -4.388231      0.005245
  H      -3.523206     -6.991868      0.352344
  H      -4.800285     -6.238292      1.356042
  C      -2.375250     -2.808327      1.429854
  C      -2.003169     -2.342984      0.141119
  C      -1.447107     -1.087052      0.000782
  C      -1.270117     -0.232385      1.116051
  C      -1.603295     -0.670012      2.379254
  C      -2.107845     -1.979930      2.559632
  N      -2.468461     -2.517306      3.768729
  C      -1.969729     -2.036905      4.909252
  C      -0.657968     -1.499269      5.182575
  O      -0.332423     -0.849795      6.147155
  Cl      0.673022     -2.113712      4.047494
  C      -5.916390     -5.838178      4.635001
  C      -6.794607     -6.693674      5.335156
  C      -8.091521     -6.272768      5.585762
  C      -8.540218     -5.009281      5.153124
  C      -7.681825     -4.142517      4.491564
  C      -6.354887     -4.535689      4.246191
  N      -5.407095     -3.799069      3.549456
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  C      -5.430891     -1.842731      2.092389
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  C      -1.332006     -5.151124      5.634192
  C      -0.089717     -5.506396      6.210393
  C       0.176261     -5.169400      7.525529
  C      -0.779681     -4.469365      8.294598
  C      -2.012609     -4.143214      7.763851
  C      -2.329438     -4.514458      6.437508
  N      -3.515300     -4.242707      5.797961
  C      -4.629234     -3.866982      6.478565
  C      -5.059888     -4.471093      7.697379
  O      -4.621817     -5.409479      8.327530
  Cl     -6.614721     -3.634334      8.287824
  H      -2.200409     -2.948866     -0.741202
  H      -1.185369     -0.727485     -0.995979
  H      -0.901437      0.783305      0.970232
  H      -1.515755     -0.008677      3.241345
  H      -2.577608     -2.135794      5.807641
  H      -6.455946     -7.667854      5.685605
  H      -8.770106     -6.926672      6.133537
  H      -9.568372     -4.702828      5.350272
  H      -8.033117     -3.169166      4.149459
  H      -6.248300     -1.913323      4.078042
  H       0.671145     -6.001622      5.608519
  H       1.146321     -5.413495      7.960036
  H      -0.535773     -4.166155      9.313299
  H      -2.737247     -3.579997      8.349627
  H      -5.312223     -3.178118      5.992186
  N      -6.976665     -6.918872      1.870557
  N      -8.055423     -6.515344      2.249899
  H      -8.408188     -5.531220      2.116049
  H      -8.733779     -7.099056      2.805153
75
Coordinates from ORCA-job orca E -7353.778191864294
  N      -2.984938     -3.989517      1.704519
  C      -3.327968     -4.838752      0.564933
  C      -3.722705     -6.204106      1.094990
  N      -2.982583     -6.460124      2.354191
  C      -3.471771     -7.731215      2.985233
  C      -4.032209     -7.424755      4.371200
  N      -4.646564     -6.118306      4.242789
  Mo     -3.434133     -4.602266      3.624984
  N      -1.687798     -5.359172      4.337343
  C      -0.847087     -6.250693      3.536286
  C      -1.505197     -6.453161      2.182027
  H      -0.724479     -7.206874      4.074979
  H       0.160457     -5.826530      3.393559
  H      -1.173038     -7.391957      1.710457
  H      -1.243956     -5.623656      1.519243
  H      -4.757937     -8.196735      4.665695
  H      -3.236972     -7.393662      5.133996
  H      -4.280182     -8.123037      2.353483
  H      -2.660348     -8.472158      3.016611
  H      -2.465024     -4.911063     -0.116752
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  H      -3.521243     -6.997988      0.354260
  H      -4.794680     -6.229068      1.347914
  C      -2.380916     -2.805114      1.428743
  C      -2.019484     -2.333375      0.139625
  C      -1.478363     -1.070421      0.000448
  C      -1.304724     -0.216908      1.117214
  C      -1.627279     -0.660900      2.380966
  C      -2.118819     -1.975824      2.559024
  N      -2.470640     -2.520773      3.767612
  C      -1.968777     -2.039098      4.906176
  C      -0.658485     -1.492701      5.170538
  O      -0.332654     -0.838187      6.131252
  Cl      0.668959     -2.103120      4.031391
  C      -5.909545     -5.841548      4.650517
  C      -6.790260     -6.696306      5.349679
  C      -8.086508     -6.273395      5.598760
  C      -8.534473     -5.009563      5.165494
  C      -7.674696     -4.144075      4.502887
  C      -6.346887     -4.539395      4.257696
  N      -5.404455     -3.807067      3.553772
  C      -5.698770     -2.482305      3.313570
  C      -5.441522     -1.868506      2.075910
  O      -5.118226     -2.317247      0.994510
  Cl     -5.757910     -0.020684      2.207827
  C      -1.332288     -5.160258      5.639017
  C      -0.092490     -5.521529      6.216894
  C       0.172388     -5.187317      7.532752
  C      -0.781992     -4.484572      8.301227
  C      -2.012569     -4.152721      7.769112
  C      -2.328600     -4.520790      6.441541
  N      -3.511671     -4.242351      5.799902
  C      -4.624609     -3.857939      6.475901
  C      -5.062573     -4.450274      7.698493
  O      -4.632690     -5.387193      8.336134
  Cl     -6.613646     -3.598241      8.277238
  H      -2.212596     -2.937912     -0.744495
  H      -1.226710     -0.705421     -0.996898
  H      -0.947673      0.803093      0.971283
  H      -1.543266     -0.001925      3.245391
  H      -2.570246     -2.139461      5.807604
  H      -6.453078     -7.671716      5.698154
  H      -8.768098     -6.927414      6.142869
  H      -9.562451     -4.701856      5.361207
  H      -8.024922     -3.169595      4.161492
  H      -6.236938     -1.912870      4.072937
  H       0.667460     -6.019672      5.616253
  H       1.140934     -5.435398      7.968130
  H      -0.538776     -4.184063      9.320868
  H      -2.734920     -3.587775      8.355637
  H      -5.302815     -3.169112      5.983386
  N      -6.958047     -6.954189      1.849468
  N      -8.008458     -6.474635      2.220012
  H      -8.280393     -5.463352      2.104444
  H      -8.736975     -7.011512      2.761209
75
Coordinates from ORCA-job orca E -7353.778396012758
  N      -2.979361     -3.990715      1.703163
  C      -3.319002     -4.839862      0.561883
  C      -3.718963     -6.203942      1.091576
  N      -2.986626     -6.460299      2.355293
  C      -3.482201     -7.731464      2.983656
  C      -4.026285     -7.428923      4.376459
  N      -4.638927     -6.120291      4.257065
  Mo     -3.432375     -4.604152      3.626750
  N      -1.687145     -5.362477      4.339289
  C      -0.853244     -6.264263      3.542277
  C      -1.508366     -6.460187      2.186538
  H      -0.743827     -7.221037      4.082177
  H       0.159205     -5.851610      3.402640
  H      -1.180882     -7.399650      1.713033
  H      -1.242483     -5.629782      1.526700
  H      -4.752353     -8.198761      4.673173
  H      -3.225186     -7.402834      5.132154
  H      -4.302271     -8.108124      2.358618
  H      -2.679141     -8.481530      2.998059
  H      -2.453277     -4.911682     -0.116709
  H      -4.150536     -4.393491     -0.005461
  H      -3.517925     -6.999986      0.353623
  H      -4.791803     -6.222915      1.338940
  C      -2.387061     -2.800929      1.428248
  C      -2.031189     -2.324353      0.139689
  C      -1.500988     -1.056593      0.002499
  C      -1.333122     -0.204289      1.120654
  C      -1.650479     -0.652784      2.384110
  C      -2.131338     -1.971423      2.559897
  N      -2.477514     -2.521529      3.767733
  C      -1.970373     -2.038798      4.903700
  C      -0.659947     -1.490501      5.159589
  O      -0.330639     -0.833212      6.116896
  Cl      0.662712     -2.104632      4.017785
  C      -5.901921     -5.844826      4.667362
  C      -6.780614     -6.699476      5.368609
  C      -8.077632     -6.280120      5.618785
  C      -8.530386     -5.020391      5.180766
  C      -7.673017     -4.154975      4.513264
  C      -6.342201     -4.545621      4.269975
  N      -5.404152     -3.813926      3.560198
  C      -5.700467     -2.491511      3.306600
  C      -5.455906     -1.895869      2.057461
  O      -5.135921     -2.355840      0.978965
  Cl     -5.780668     -0.045011      2.166027
  C      -1.334589     -5.168624      5.642545
  C      -0.098874     -5.540166      6.222557
  C       0.166277     -5.209511      7.539160
  C      -0.783082     -4.499100      8.306496
  C      -2.010046     -4.157570      7.772518
  C      -2.327664     -4.523821      6.444521
  N      -3.508655     -4.237037      5.802533
  C      -4.618618     -3.842309      6.475162
  C      -5.063345     -4.422739      7.701752
  O      -4.643380     -5.358234      8.346998
  Cl     -6.607673     -3.553623      8.270149
  H      -2.218301     -2.928170     -0.746039
  H      -1.254348     -0.687918     -0.994710
  H      -0.984595      0.818388      0.975838
  H      -1.570682      0.005059      3.249635
  H      -2.565081     -2.139258      5.809206
  H      -6.440347     -7.672759      5.717999
  H      -8.757087     -6.934789      6.164777
  H      -9.558996     -4.715278      5.375765
  H      -8.026502     -3.184291      4.168122
  H      -6.229067     -1.912290      4.064837
  H       0.658404     -6.043633      5.623150
  H       1.132154     -5.465801      7.975766
  H      -0.539321     -4.200905      9.326671
  H      -2.727501     -3.586945      8.359026
  H      -5.291686     -3.151989      5.978320
  N      -6.939804     -6.990242      1.823664
  N      -7.954454     -6.431707      2.184279
  H      -8.136624     -5.398102      2.086994
  H      -8.735392     -6.914517      2.704707
75
Coordinates from ORCA-job orca E -7353.778547439177
  N      -2.973017     -3.994501      1.700620
  C      -3.311724     -4.843483      0.559986
  C      -3.712895     -6.207153      1.087903
  N      -2.987655     -6.461415      2.358039
  C      -3.486219     -7.733301      2.984806
  C      -4.031219     -7.436051      4.378095
  N      -4.637228     -6.123619      4.266479
  Mo     -3.432677     -4.608558      3.628344
  N      -1.685836     -5.366086      4.341462
  C      -0.854218     -6.271632      3.545875
  C      -1.508627     -6.466371      2.190174
  H      -0.749700     -7.228345      4.086234
  H       0.159656     -5.863097      3.406909
  H      -1.184880     -7.407271      1.717096
  H      -1.240649     -5.637109      1.529721
  H      -4.763012     -8.203447      4.666885
  H      -3.232218     -7.419800      5.136440
  H      -4.305793     -8.107086      2.357468
  H      -2.683568     -8.483527      2.995654
  H      -2.444459     -4.914608     -0.117165
  H      -4.143345     -4.396117     -0.006610
  H      -3.505961     -7.004801      0.353833
  H      -4.785778     -6.227471      1.330314
  C      -2.390571     -2.800836      1.427980
  C      -2.036241     -2.320548      0.140756
  C      -1.517704     -1.047558      0.005673
  C      -1.360478     -0.194793      1.124579
  C      -1.674972     -0.647443      2.387063
  C      -2.143761     -1.970591      2.561110
  N      -2.485953     -2.524657      3.768072
  C      -1.974661     -2.038087      4.900895
  C      -0.664344     -1.488406      5.149319
  O      -0.331126     -0.827855      6.102953
  Cl      0.654939     -2.103729      4.003147
  C      -5.900469     -5.847050      4.676345
  C      -6.780424     -6.701551      5.377364
  C      -8.077075     -6.282480      5.634106
  C      -8.528230     -5.019351      5.200349
  C      -7.669490     -4.153603      4.530093
  C      -6.339104     -4.546620      4.281534
  N      -5.402434     -3.817815      3.566615
  C      -5.698022     -2.497412      3.300989
  C      -5.465452     -1.916964      2.042940
  O      -5.151833     -2.386489      0.965452
  Cl     -5.795117     -0.064417      2.131757
  C      -1.335217     -5.174447      5.645151
  C      -0.102115     -5.552265      6.226854
  C       0.164159     -5.222272      7.543500
  C      -0.781019     -4.505103      8.309589
  C      -2.005970     -4.158193      7.774187
  C      -2.325565     -4.525481      6.446660
  N      -3.506561     -4.234874      5.805917
  C      -4.614580     -3.837580      6.477797
  C      -5.058192     -4.410150      7.709085
  O      -4.638954     -5.341029      8.360860
  Cl     -6.601703     -3.537366      8.271022
  H      -2.215075     -2.925324     -0.745878
  H      -1.273052     -0.675958     -0.990749
  H      -1.022219      0.831705      0.981330
  H      -1.602678      0.011425      3.252473
  H      -2.564042     -2.135753      5.809105
  H      -6.440441     -7.676601      5.724192
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  H      -9.554710     -4.710538      5.401538
  H      -8.020411     -3.179251      4.188095
  H      -6.214974     -1.908524      4.059695
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  H       1.128386     -5.484118      7.981017
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  H      -2.719707     -3.582380      8.360114
  H      -5.289205     -3.149673      5.979709
  N      -6.929074     -7.010411      1.799451
  N      -7.915108     -6.396146      2.147292
  H      -8.028549     -5.351671      2.059122
  H      -8.736324     -6.833672      2.646443
75
Coordinates from ORCA-job orca E -7353.778622233198
  N      -2.973237     -3.993123      1.698182
  C      -3.307407     -4.843327      0.558052
  C      -3.714198     -6.205324      1.082862
  N      -2.991862     -6.461252      2.356944
  C      -3.494569     -7.732128      2.981787
  C      -4.031543     -7.436861      4.377399
  N      -4.636133     -6.123794      4.271021
  Mo     -3.435336     -4.608373      3.627576
  N      -1.688954     -5.369335      4.342340
  C      -0.859499     -6.277625      3.547391
  C      -1.512677     -6.469796      2.190831
  H      -0.760617     -7.235283      4.087111
  H       0.156341     -5.873524      3.410687
  H      -1.189816     -7.410756      1.717380
  H      -1.242224     -5.640515      1.531370
  H      -4.761237     -8.204690      4.668924
  H      -3.228558     -7.422364      5.131167
  H      -4.317586     -8.100791      2.356846
  H      -2.695086     -8.485498      2.987061
  H      -2.434804     -4.917784     -0.112280
  H      -4.133944     -4.394091     -0.014788
  H      -3.503587     -7.003256      0.350344
  H      -4.787467     -6.228005      1.325644
  C      -2.394313     -2.797627      1.428359
  C      -2.037199     -2.315864      0.142520
  C      -1.522653     -1.041077      0.009004
  C      -1.372752     -0.187966      1.128269
  C      -1.689246     -0.642371      2.389666
  C      -2.153127     -1.967409      2.562521
  N      -2.493397     -2.523321      3.769406
  C      -1.977598     -2.036396      4.900326
  C      -0.665950     -1.489292      5.143738
  O      -0.327127     -0.828974      6.095479
  Cl      0.647772     -2.107716      3.992121
  C      -5.896982     -5.846423      4.682773
  C      -6.772808     -6.699886      5.388379
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  C      -8.523856     -5.022410      5.213180
  C      -7.669288     -4.157580      4.537874
  C      -6.339392     -4.548021      4.287342
  N      -5.403751     -3.820086      3.567977
  C      -5.703142     -2.502773      3.293273
  C      -5.475947     -1.929232      2.031882
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  Cl     -5.810956     -0.079992      2.106377
  C      -1.339457     -5.179559      5.646071
  C      -0.109332     -5.564688      6.229605
  C       0.158109     -5.235518      7.546211
  C      -0.782691     -4.510772      8.310620
  C      -2.005155     -4.157330      7.773599
  C      -2.326965     -4.525703      6.446868
  N      -3.507298     -4.230283      5.806997
  C      -4.612891     -3.829461      6.479416
  C      -5.056979     -4.399260      7.712412
  O      -4.641359     -5.330263      8.365239
  Cl     -6.595512     -3.521001      8.275144
  H      -2.210800     -2.922231     -0.744024
  H      -1.275238     -0.668689     -0.986403
  H      -1.037979      0.839881      0.987046
  H      -1.621106      0.017627      3.254444
  H      -2.562780     -2.134796      5.811746
  H      -6.430022     -7.672739      5.737862
  H      -8.743335     -6.937067      6.204229
  H      -9.550068     -4.714842      5.417540
  H      -8.022510     -3.185968      4.193152
  H      -6.216737     -1.909504      4.050772
  H       0.643376     -6.076603      5.631856
  H       1.119968     -5.504018      7.985080
  H      -0.536725     -4.211450      9.329975
  H      -2.715482     -3.575482      8.357835
  H      -5.286268     -3.139777      5.982618
  N      -6.916871     -7.039725      1.786795
  N      -7.875554     -6.380262      2.131832
  H      -7.933308     -5.330747      2.053141
  H      -8.725687     -6.781468      2.613873
75
Coordinates from ORCA-job orca E -7353.778689689985
  N      -2.973326     -3.998059      1.697735
  C      -3.305478     -4.849638      0.559896
  C      -3.708847     -6.211821      1.084226
  N      -2.988193     -6.464100      2.361065
  C      -3.488342     -7.735432      2.986664
  C      -4.043258     -7.441282      4.374956
  N      -4.641737     -6.125925      4.269346
  Mo     -3.435921     -4.613082      3.630134
  N      -1.687388     -5.373707      4.345721
  C      -0.854114     -6.276073      3.548438
  C      -1.509246     -6.471848      2.193127
  H      -0.748467     -7.233627      4.087090
  H       0.158930     -5.865661      3.410222
  H      -1.186207     -7.413501      1.721220
  H      -1.240394     -5.644084      1.531139
  H      -4.778694     -8.207891      4.654612
  H      -3.249577     -7.433727      5.138595
  H      -4.297774     -8.116871      2.352294
  H      -2.681208     -8.480037      3.007040
  H      -2.432556     -4.924047     -0.109934
  H      -4.132247     -4.401761     -0.013526
  H      -3.487594     -7.009296      0.354407
  H      -4.781932     -6.244533      1.322763
  C      -2.398518     -2.801086      1.428901
  C      -2.039347     -2.318752      0.143726
  C      -1.530797     -1.041813      0.010395
  C      -1.389673     -0.186924      1.129151
  C      -1.707275     -0.642168      2.390073
  C      -2.163664     -1.969656      2.563070
  N      -2.499953     -2.528019      3.770094
  C      -1.982356     -2.037757      4.899364
  C      -0.671456     -1.487511      5.138342
  O      -0.329681     -0.827193      6.089393
  Cl      0.640010     -2.102113      3.980279
  C      -5.901767     -5.843774      4.680345
  C      -6.780958     -6.693409      5.386447
  C      -8.075771     -6.272114      5.652258
  C      -8.525673     -5.009679      5.219205
  C      -7.668170     -4.147695      4.543635
  C      -6.340208     -4.543056      4.289237
  N      -5.400086     -3.817893      3.571983
  C      -5.695551     -2.500177      3.295191
  C      -5.473526     -1.930767      2.031956
  O      -5.167998     -2.413707      0.957306
  Cl     -5.801418     -0.082602      2.100203
  C      -1.336188     -5.181301      5.647989
  C      -0.104291     -5.563306      6.230369
  C       0.165345     -5.230833      7.545659
  C      -0.775041     -4.505417      8.310092
  C      -1.999197     -4.155479      7.774387
  C      -2.323187     -4.527898      6.449496
  N      -3.505693     -4.235816      5.811894
  C      -4.611422     -3.841464      6.487081
  C      -5.048623     -4.413481      7.722067
  O      -4.624776     -5.340810      8.374788
  Cl     -6.592615     -3.546939      8.287765
  H      -2.207097     -2.928120     -0.741867
  H      -1.280870     -0.669265     -0.984355
  H      -1.060344      0.842491      0.988521
  H      -1.644215      0.019515      3.253689
  H      -2.563931     -2.138569      5.813340
  H      -6.442065     -7.667742      5.735722
  H      -8.749578     -6.924623      6.209359
  H      -9.549706     -4.697738      5.428070
  H      -8.016640     -3.174263      4.200792
  H      -6.202312     -1.902829      4.054053
  H       0.648083     -6.074930      5.631978
  H       1.128243     -5.497407      7.983497
  H      -0.527388     -4.202368      9.327887
  H      -2.709402     -3.572720      8.358083
  H      -5.291800     -3.156728      5.992769
  N      -6.919860     -7.033713      1.775470
  N      -7.875777     -6.363678      2.104901
  H      -7.918697     -5.313645      2.018015
  H      -8.738222     -6.749520      2.572812
75
Coordinates from ORCA-job orca E -7353.778744016411
  N      -2.975527     -4.001428      1.698670
  C      -3.298098     -4.855305      0.560315
  C      -3.706874     -6.214616      1.084563
  N      -2.987737     -6.468993      2.362334
  C      -3.491377     -7.739240      2.986277
  C      -4.045083     -7.444989      4.374988
  N      -4.642665     -6.129304      4.271349
  Mo     -3.435689     -4.617216      3.631547
  N      -1.688722     -5.382116      4.350184
  C      -0.855540     -6.284724      3.553387
  C      -1.508939     -6.478110      2.196979
  H      -0.751979     -7.243259      4.091128
  H       0.158451     -5.875542      3.417348
  H      -1.185379     -7.419187      1.724303
  H      -1.237835     -5.649618      1.536836
  H      -4.779753     -8.212404      4.656048
  H      -3.249949     -7.438233      5.137681
  H      -4.300798     -8.119034      2.350888
  H      -2.686130     -8.486093      3.008011
  H      -2.419399     -4.932877     -0.101591
  H      -4.118483     -4.408067     -0.022539
  H      -3.485670     -7.013047      0.355347
  H      -4.781137     -6.249481      1.322156
  C      -2.405995     -2.801604      1.429959
  C      -2.048648     -2.317845      0.144854
  C      -1.547855     -1.037969      0.011040
  C      -1.412288     -0.181810      1.129465
  C      -1.726949     -0.639076      2.390562
  C      -2.175499     -1.969120      2.563541
  N      -2.505012     -2.531011      3.771263
  C      -1.985182     -2.039278      4.898855
  C      -0.675292     -1.482695      5.132398
  O      -0.331972     -0.820179      6.081705
  Cl      0.633102     -2.091934      3.967789
  C      -5.901719     -5.845395      4.682724
  C      -6.784092     -6.696504      5.384100
  C      -8.077709     -6.272047      5.649560
  C      -8.522479     -5.004740      5.223792
  C      -7.662715     -4.142076      4.553142
  C      -6.337930     -4.542312      4.295057
  N      -5.397786     -3.820917      3.574654
  C      -5.694321     -2.504076      3.293135
  C      -5.480504     -1.942579      2.025564
  O      -5.183386     -2.434532      0.952595
  Cl     -5.807187     -0.095517      2.082121
  C      -1.336277     -5.187395      5.651462
  C      -0.104006     -5.569287      6.233684
  C       0.167819     -5.232900      7.547487
  C      -0.771110     -4.504254      8.310873
  C      -1.995780     -4.155232      7.775838
  C      -2.321851     -4.531273      6.452550
  N      -3.504588     -4.239357      5.815370
  C      -4.608920     -3.843598      6.491612
  C      -5.043033     -4.412246      7.729340
  O      -4.615747     -5.337538      8.383543
  Cl     -6.587877     -3.546893      8.295518
  H      -2.212911     -2.929749     -0.739674
  H      -1.299227     -0.664112     -0.983529
  H      -1.089389      0.849696      0.988896
  H      -1.667147      0.023094      3.254059
  H      -2.561990     -2.143979      5.814930
  H      -6.449605     -7.674647      5.729385
  H      -8.754298     -6.926829      6.201485
  H      -9.545752     -4.690938      5.434006
  H      -8.006953     -3.164319      4.214864
  H      -6.196585     -1.902286      4.051691
  H       0.646907     -6.083418      5.635566
  H       1.131005     -5.499002      7.984970
  H      -0.521479     -4.197527      9.327089
  H      -2.705090     -3.569773      8.358095
  H      -5.290825     -3.159914      5.997284
  N      -6.916497     -7.041203      1.767744
  N      -7.843300     -6.325665      2.088630
  H      -7.832009     -5.274150      2.008049
  H      -8.732435     -6.671671      2.537204
75
Coordinates from ORCA-job orca E -7353.778813467366
  N      -2.978789     -4.009203      1.701208
  C      -3.289886     -4.867087      0.561892
  C      -3.699431     -6.224381      1.089252
  N      -2.981910     -6.476546      2.367458
  C      -3.485027     -7.746400      2.992092
  C      -4.046407     -7.450058      4.377739
  N      -4.643614     -6.134612      4.272540
  Mo     -3.433155     -4.624316      3.635314
  N      -1.686695     -5.391113      4.356877
  C      -0.851254     -6.291287      3.560250
  C      -1.503418     -6.484229      2.203426
  H      -0.745315     -7.250228      4.097307
  H       0.162092     -5.879505      3.425215
  H      -1.178730     -7.424666      1.730160
  H      -1.231904     -5.654999      1.544383
  H      -4.781916     -8.217582      4.656609
  H      -3.254474     -7.443294      5.143741
  H      -4.288225     -8.132163      2.352373
  H      -2.677633     -8.490836      3.023221
  H      -2.406642     -4.945332     -0.093900
  H      -4.106235     -4.424040     -0.029829
  H      -3.475967     -7.024937      0.362341
  H      -4.774980     -6.263695      1.322375
  C      -2.418451     -2.804752      1.430777
  C      -2.066932     -2.318717      0.144858
  C      -1.578384     -1.034331      0.009627
  C      -1.448572     -0.176381      1.127536
  C      -1.756004     -0.636288      2.389573
  C      -2.192488     -1.970076      2.563236
  N      -2.510620     -2.536939      3.772171
  C      -1.987805     -2.043266      4.897543
  C      -0.680060     -1.477116      5.122493
  O      -0.334519     -0.812921      6.069554
  Cl      0.623167     -2.077458      3.948519
  C      -5.901490     -5.847658      4.686373
  C      -6.787973     -6.698227      5.382849
  C      -8.078804     -6.269017      5.648191
  C      -8.518235     -4.997960      5.228931
  C      -7.655593     -4.136534      4.562873
  C      -6.333188     -4.542079      4.301835
  N      -5.392489     -3.825299      3.579600
  C      -5.687421     -2.508024      3.293386
  C      -5.487084     -1.959385      2.018199
  O      -5.205526     -2.464319      0.947201
  Cl     -5.807559     -0.111158      2.060076
  C      -1.333287     -5.195000      5.657395
  C      -0.099682     -5.574447      6.238780
  C       0.173017     -5.235248      7.551349
  C      -0.766387     -4.506865      8.314604
  C      -1.992105     -4.160588      7.780827
  C      -2.319037     -4.539170      6.458612
  N      -3.501394     -4.247864      5.821043
  C      -4.604639     -3.849703      6.497616
  C      -5.038968     -4.416320      7.736628
  O      -4.613185     -5.342550      8.389804
  Cl     -6.579170     -3.546684      8.305418
  H      -2.227134     -2.933587     -0.738392
  H      -1.334521     -0.658281     -0.985309
  H      -1.135823      0.858201      0.985701
  H      -1.699940      0.025903      3.253418
  H      -2.556959     -2.155448      5.817698
  H      -6.458960     -7.679623      5.723511
  H      -8.757420     -6.925438      6.194018
  H      -9.540483     -4.681720      5.439844
  H      -7.995244     -3.155902      4.228853
  H      -6.180705     -1.899236      4.052436
  H       0.650973     -6.089115      5.640711
  H       1.137130     -5.498708      7.987931
  H      -0.515616     -4.197736      9.329712
  H      -2.702020     -3.575317      8.362576
  H      -5.285519     -3.165692      6.003128
  N      -6.924596     -7.021385      1.753130
  N      -7.819436     -6.256213      2.054077
  H      -7.749974     -5.207588      1.972758
  H      -8.738051     -6.552729      2.476788
75
Coordinates from ORCA-job orca E -7353.778875962094
  N      -2.986670     -4.020541      1.705896
  C      -3.285319     -4.883366      0.566088
  C      -3.690711     -6.239857      1.097943
  N      -2.974587     -6.486078      2.376846
  C      -3.474454     -7.755446      3.004877
  C      -4.046804     -7.455000      4.385445
  N      -4.643893     -6.140265      4.275666
  Mo     -3.429012     -4.632663      3.642263
  N      -1.682483     -5.400551      4.366120
  C      -0.844418     -6.297616      3.569026
  C      -1.496494     -6.490881      2.212636
  H      -0.733648     -7.256501      4.105507
  H       0.167398     -5.881651      3.433614
  H      -1.170744     -7.430503      1.738280
  H      -1.226134     -5.660716      1.554312
  H      -4.783878     -8.222120      4.661233
  H      -3.260027     -7.446969      5.156394
  H      -4.268599     -8.151299      2.360591
  H      -2.663425     -8.494918      3.049278
  H      -2.398014     -4.959009     -0.083966
  H      -4.099331     -4.447949     -0.033699
  H      -3.461698     -7.042741      0.374921
  H      -4.768317     -6.285676      1.323409
  C      -2.438934     -2.810428      1.431598
  C      -2.098889     -2.321669      0.143687
  C      -1.624757     -1.032479      0.005368
  C      -1.497478     -0.172961      1.122270
  C      -1.792646     -0.635329      2.386284
  C      -2.214860     -1.973038      2.562159
  N      -2.516644     -2.544769      3.773210
  C      -1.989525     -2.048081      4.895186
  C      -0.685196     -1.468523      5.109001
  O      -0.337965     -0.801793      6.053626
  Cl      0.613392     -2.056144      3.923642
  C      -5.900794     -5.851006      4.692008
  C      -6.793340     -6.703213      5.379407
  C      -8.082642     -6.269954      5.640814
  C      -8.515066     -4.993653      5.229628
  C      -7.646995     -4.131323      4.573346
  C      -6.326048     -4.541851      4.311774
  N      -5.384367     -3.829341      3.589063
  C      -5.675601     -2.511015      3.296273
  C      -5.495453     -1.981478      2.010158
  O      -5.236552     -2.504160      0.941681
  Cl     -5.803549     -0.129836      2.031491
  C      -1.327643     -5.204010      5.666101
  C      -0.092541     -5.581007      6.246035
  C       0.180834     -5.239978      7.557692
  C      -0.759088     -4.513000      8.321713
  C      -1.985896     -4.169210      7.789717
  C      -2.313465     -4.549051      6.467991
  N      -3.495319     -4.258432      5.829917
  C      -4.597877     -3.857469      6.506300
  C      -5.032550     -4.421627      7.746629
  O      -4.606025     -5.347860      8.399638
  Cl     -6.571403     -3.550356      8.315297
  H      -2.256839     -2.939549     -0.737686
  H      -1.389795     -0.653912     -0.990725
  H      -1.196378      0.864482      0.977556
  H      -1.737985      0.026157      3.250648
  H      -2.548294     -2.169884      5.820258
  H      -6.471073     -7.689115      5.712590
  H      -8.766393     -6.930272      6.175225
  H      -9.537117     -4.675467      5.438073
  H      -7.981244     -3.147494      4.244387
  H      -6.153702     -1.891863      4.056809
  H       0.657967     -6.095756      5.647830
  H       1.146203     -5.500440      7.992876
  H      -0.507084     -4.202818      9.336146
  H      -2.696588     -3.585314      8.371691
  H      -5.278070     -3.173847      6.010425
  N      -6.937090     -6.983436      1.731851
  N      -7.783133     -6.153723      2.003054
  H      -7.635320     -5.113146      1.920847
  H      -8.736597     -6.380711      2.388867
75
Coordinates from ORCA-job orca E -7353.778930316395
  N      -2.991106     -4.023600      1.707597
  C      -3.291660     -4.887525      0.568641
  C      -3.687348     -6.247225      1.102474
  N      -2.969746     -6.486808      2.380628
  C      -3.462728     -7.757279      3.012610
  C      -4.044883     -7.454077      4.388906
  N      -4.643789     -6.140713      4.272428
  Mo     -3.427615     -4.633369      3.643738
  N      -1.679136     -5.397253      4.366733
  C      -0.837709     -6.289880      3.568261
  C      -1.491667     -6.486763      2.213359
  H      -0.719531     -7.247692      4.104913
  H       0.171276     -5.867803      3.430321
  H      -1.164543     -7.426130      1.739321
  H      -1.225266     -5.656745      1.553153
  H      -4.783091     -8.221144      4.661787
  H      -3.262859     -7.442849      5.164616
  H      -4.249875     -8.163103      2.365685
  H      -2.646186     -8.489828      3.065788
  H      -2.407043     -4.957905     -0.085429
  H      -4.110947     -4.456746     -0.027073
  H      -3.452931     -7.050145      0.381324
  H      -4.765520     -6.297585      1.325158
  C      -2.444030     -2.813408      1.431144
  C      -2.108807     -2.324691      0.141959
  C      -1.633919     -1.035870      0.002004
  C      -1.501210     -0.176498      1.118542
  C      -1.791868     -0.638303      2.383537
  C      -2.215030     -1.975695      2.561078
  N      -2.514087     -2.546167      3.773043
  C      -1.986785     -2.049664      4.894893
  C      -0.683151     -1.469152      5.108468
  O      -0.336182     -0.803699      6.053837
  Cl      0.615925     -2.053138      3.921895
  C      -5.900674     -5.851711      4.690327
  C      -6.793041     -6.702900      5.379514
  C      -8.081707     -6.266699      5.642319
  C      -8.513142     -4.990044      5.230522
  C      -7.644976     -4.129616      4.572407
  C      -6.324192     -4.541704      4.310638
  N      -5.382152     -3.828599      3.589926
  C      -5.670525     -2.508729      3.298684
  C      -5.493927     -1.980804      2.011002
  O      -5.240431     -2.504429      0.941489
  Cl     -5.795571     -0.126607      2.032919
  C      -1.325097     -5.202787      5.667472
  C      -0.089586     -5.578016      6.247328
  C       0.180990     -5.240310      7.560414
  C      -0.761611     -4.518227      8.325729
  C      -1.988392     -4.175237      7.793353
  C      -2.313132     -4.551664      6.469798
  N      -3.494239     -4.261798      5.830458
  C      -4.598464     -3.862076      6.505841
  C      -5.035805     -4.430747      7.743010
  O      -4.611330     -5.360043      8.392684
  Cl     -6.573403     -3.559598      8.312998
  H      -2.270549     -2.941920     -0.739133
  H      -1.402861     -0.657231     -0.994940
  H      -1.199644      0.860710      0.972073
  H      -1.733944      0.022507      3.248341
  H      -2.544987     -2.173057      5.820058
  H      -6.471073     -7.688731      5.712170
  H      -8.766966     -6.924072      6.177973
  H      -9.534168     -4.669402      5.440362
  H      -7.978809     -3.145430      4.243977
  H      -6.144163     -1.888831      4.061371
  H       0.663006     -6.089470      5.648925
  H       1.146667     -5.499298      7.995812
  H      -0.511588     -4.211582      9.341767
  H      -2.701357     -3.595365      8.376421
  H      -5.276593     -3.176634      6.010228
  N      -6.946435     -6.962379      1.727542
  N      -7.797856     -6.137379      1.987545
  H      -7.658579     -5.096531      1.895106
  H      -8.751325     -6.367576      2.372337
75
Coordinates from ORCA-job orca E -7353.779000702069
  N      -2.996593     -4.027309      1.708576
  C      -3.299738     -4.893113      0.571302
  C      -3.684251     -6.256609      1.105906
  N      -2.965387     -6.487841      2.385588
  C      -3.451446     -7.759539      3.021748
  C      -4.039605     -7.454936      4.395618
  N      -4.640745     -6.142472      4.273798
  Mo     -3.427057     -4.634512      3.645379
  N      -1.675497     -5.392997      4.368227
  C      -0.831359     -6.282257      3.568628
  C      -1.487021     -6.482848      2.215070
  H      -0.707116     -7.238924      4.105495
  H       0.175123     -5.855234      3.428267
  H      -1.158551     -7.421792      1.741112
  H      -1.225327     -5.652750      1.552952
  H      -4.778233     -8.222312      4.666772
  H      -3.260402     -7.440433      5.174364
  H      -4.234348     -8.172652      2.373965
  H      -2.630121     -8.486097      3.078806
  H      -2.417107     -4.956917     -0.086156
  H      -4.124782     -4.467596     -0.019797
  H      -3.442608     -7.059241      0.387403
  H      -4.762776     -6.313713      1.327331
  C      -2.453124     -2.815990      1.429987
  C      -2.125935     -2.326304      0.139362
  C      -1.651463     -1.037302     -0.002643
  C      -1.511877     -0.178653      1.113498
  C      -1.795625     -0.640689      2.379721
  C      -2.218433     -1.978179      2.559380
  N      -2.512468     -2.547307      3.772961
  C      -1.982230     -2.050486      4.893109
  C      -0.679047     -1.468958      5.103629
  O      -0.331060     -0.803712      6.048721
  Cl      0.618810     -2.050666      3.914734
  C      -5.897753     -5.855018      4.694090
  C      -6.788051     -6.706406      5.385527
  C      -8.076923     -6.270259      5.650979
  C      -8.509429     -4.994131      5.238212
  C      -7.642250     -4.132992      4.578395
  C      -6.321417     -4.545005      4.315148
  N      -5.381118     -3.831541      3.593028
  C      -5.668958     -2.512147      3.296576
  C      -5.502822     -1.994141      2.004014
  O      -5.256105     -2.524147      0.935575
  Cl     -5.804102     -0.138174      2.015038
  C      -1.324086     -5.202585      5.670361
  C      -0.090249     -5.580488      6.252001
  C       0.176403     -5.248972      7.567641
  C      -0.767571     -4.529217      8.333447
  C      -1.992360     -4.182517      7.798637
  C      -2.313702     -4.553774      6.472425
  N      -3.493336     -4.262085      5.831346
  C      -4.598968     -3.862481      6.505197
  C      -5.040234     -4.434669      7.739285
  O      -4.619668     -5.367524      8.386449
  Cl     -6.576277     -3.561581      8.308636
  H      -2.292436     -2.942173     -0.741780
  H      -1.426734     -0.658116     -1.000801
  H      -1.210513      0.858377      0.965291
  H      -1.733388      0.019455      3.244786
  H      -2.537447     -2.175116      5.819884
  H      -6.464304     -7.691887      5.716895
  H      -8.762118     -6.926090      6.188973
  H      -9.529998     -4.672946      5.449601
  H      -7.977405     -3.149249      4.249785
  H      -6.132427     -1.886820      4.060861
  H       0.664063     -6.089731      5.654006
  H       1.140666     -5.510874      8.004920
  H      -0.520427     -4.228045      9.351939
  H      -2.706150     -3.604386      8.382297
  H      -5.273962     -3.173640      6.010087
  N      -6.960099     -6.939903      1.715227
  N      -7.786653     -6.085956      1.960860
  H      -7.614508     -5.049744      1.864185
  H      -8.754461     -6.285428      2.330270
75
Coordinates from ORCA-job orca E -7353.779105399185
  N      -3.005428     -4.034751      1.709524
  C      -3.308429     -4.904640      0.575452
  C      -3.678565     -6.272499      1.110434
  N      -2.959704     -6.492041      2.393997
  C      -3.438909     -7.764012      3.035824
  C      -4.035351     -7.457205      4.405771
  N      -4.638083     -6.145287      4.277423
  Mo     -3.426075     -4.637458      3.648598
  N      -1.671818     -5.391233      4.373508
  C      -0.823993     -6.276234      3.572671
  C      -1.481030     -6.481336      2.220419
  H      -0.693596     -7.231945      4.109600
  H       0.179858     -5.843576      3.430349
  H      -1.150272     -7.419519      1.746718
  H      -1.225028     -5.651014      1.556253
  H      -4.774243     -8.224947      4.674629
  H      -3.260356     -7.438959      5.188706
  H      -4.216285     -8.185687      2.387032
  H      -2.612089     -8.483644      3.098242
  H      -2.426529     -4.959744     -0.083912
  H      -4.139554     -4.486984     -0.012261
  H      -3.423834     -7.073858      0.395581
  H      -4.757901     -6.340856      1.328609
  C      -2.471343     -2.819952      1.427670
  C      -2.158913     -2.327556      0.134787
  C      -1.690476     -1.036328     -0.010621
  C      -1.542899     -0.178340      1.104857
  C      -1.813220     -0.642557      2.373081
  C      -2.230309     -1.981709      2.555790
  N      -2.511773     -2.551427      3.772146
  C      -1.974680     -2.053306      4.888316
  C      -0.672938     -1.466775      5.090232
  O      -0.321618     -0.800340      6.033360
  Cl      0.619706     -2.042502      3.892834
  C      -5.894692     -5.858363      4.700040
  C      -6.784353     -6.710433      5.391095
  C      -8.072877     -6.274073      5.660554
  C      -8.503799     -4.995934      5.251275
  C      -7.637121     -4.133669      4.591528
  C      -6.317541     -4.547400      4.324577
  N      -5.378736     -3.835837      3.599450
  C      -5.665261     -2.517474      3.293054
  C      -5.519648     -2.017726      1.992438
  O      -5.289118     -2.561566      0.926410
  Cl     -5.819240     -0.160919      1.982490
  C      -1.323832     -5.205656      5.677084
  C      -0.092341     -5.587911      6.261038
  C       0.169953     -5.264313      7.579783
  C      -0.775203     -4.546490      8.345971
  C      -1.997266     -4.194266      7.807941
  C      -2.314884     -4.559204      6.478850
  N      -3.492361     -4.263571      5.835602
  C      -4.598960     -3.864757      6.508333
  C      -5.043946     -4.441685      7.738915
  O      -4.627681     -5.379193      8.382253
  Cl     -6.577716     -3.566715      8.309227
  H      -2.332231     -2.942124     -0.745968
  H      -1.477712     -0.655357     -1.010664
  H      -1.246190      0.859884      0.954702
  H      -1.745544      0.017165      3.238134
  H      -2.521724     -2.182331      5.819301
  H      -6.460196     -7.697037      5.719022
  H      -8.758607     -6.928939      6.199614
  H      -9.523532     -4.673528      5.465358
  H      -7.971993     -3.149074      4.264747
  H      -6.109309     -1.881061      4.059614
  H       0.663733     -6.094651      5.663247
  H       1.131926     -5.531133      8.019597
  H      -0.531421     -4.251656      9.367218
  H      -2.711368     -3.616938      8.392040
  H      -5.270632     -3.171016      6.015461
  N      -6.968213     -6.908322      1.693294
  N      -7.735210     -5.994098      1.914982
  H      -7.485463     -4.973323      1.819427
  H      -8.728689     -6.123553      2.249458
75
Coordinates from ORCA-job orca E -7353.779222213844
  N      -3.014575     -4.042128      1.710281
  C      -3.318226     -4.916260      0.580334
  C      -3.673446     -6.288538      1.115195
  N      -2.954553     -6.496651      2.402657
  C      -3.427916     -7.768348      3.050015
  C      -4.032970     -7.459608      4.415637
  N      -4.636741     -6.147830      4.281111
  Mo     -3.425467     -4.640294      3.651729
  N      -1.669270     -5.390017      4.379551
  C      -0.817471     -6.270181      3.577271
  C      -1.475753     -6.480248      2.226282
  H      -0.681157     -7.225102      4.114063
  H       0.183665     -5.831716      3.433235
  H      -1.142195     -7.417689      1.753330
  H      -1.225779     -5.649815      1.559862
  H      -4.771961     -8.227837      4.681801
  H      -3.262829     -7.437852      5.203180
  H      -4.200204     -8.197652      2.400493
  H      -2.596000     -8.481512      3.117029
  H      -2.437917     -4.962441     -0.082110
  H      -4.156080     -4.506295     -0.003004
  H      -3.404945     -7.087058      0.402713
  H      -4.753143     -6.369098      1.330877
  C      -2.490035     -2.823892      1.424892
  C      -2.194285     -2.328471      0.129580
  C      -1.732002     -1.035055     -0.019433
  C      -1.574474     -0.178231      1.095434
  C      -1.830006     -0.645196      2.365815
  C      -2.241399     -1.985829      2.551468
  N      -2.509114     -2.556968      3.770603
  C      -1.964775     -2.057919      4.882726
  C      -0.664915     -1.465076      5.075973
  O      -0.310705     -0.797117      6.017282
  Cl      0.622194     -2.033457      3.869111
  C      -5.893145     -5.860977      4.704706
  C      -6.784180     -6.714114      5.392352
  C      -8.072418     -6.277516      5.664979
  C      -8.499645     -4.995655      5.262843
  C      -7.632363     -4.131820      4.605613
  C      -6.314680     -4.548282      4.334562
  N      -5.376823     -3.839492      3.606652
  C      -5.661181     -2.522253      3.289586
  C      -5.539047     -2.043322      1.980713
  O      -5.328673     -2.603817      0.918119
  Cl     -5.835645     -0.186420      1.947047
  C      -1.324401     -5.208151      5.684164
  C      -0.094628     -5.593608      6.269999
  C       0.163929     -5.277390      7.591586
  C      -0.782748     -4.562081      8.358270
  C      -2.002608     -4.205408      7.817387
  C      -2.316899     -4.564486      6.485879
  N      -3.492612     -4.265102      5.840792
  C      -4.600106     -3.869420      6.513360
  C      -5.047289     -4.452778      7.740139
  O      -4.633673     -5.395030      8.378650
  Cl     -6.579975     -3.578254      8.313397
  H      -2.376650     -2.941080     -0.750834
  H      -1.532839     -0.652213     -1.021569
  H      -1.282163      0.861056      0.943863
  H      -1.755268      0.014154      3.230593
  H      -2.503126     -2.192418      5.818089
  H      -6.461457     -7.703261      5.715202
  H      -8.760329     -6.931982      6.202734
  H      -9.518688     -4.672244      5.479230
  H      -7.965501     -3.145534      4.281882
  H      -6.083151     -1.872902      4.057594
  H       0.663333     -6.097038      5.671879
  H       1.123868     -5.548462      8.033659
  H      -0.542245     -4.272722      9.381928
  H      -2.716913     -3.628838      8.402096
  H      -5.269933     -3.170882      6.024290
  N      -6.971031     -6.873434      1.674751
  N      -7.669205     -5.900402      1.874723
  H      -7.338190     -4.902412      1.783199
  H      -8.681932     -5.955097      2.173021
75
Coordinates from ORCA-job orca E -7353.779342167158
  N      -3.024734     -4.049949      1.709088
  C      -3.333287     -4.929201      0.586834
  C      -3.665383     -6.308495      1.120331
  N      -2.946415     -6.502364      2.411335
  C      -3.412646     -7.773294      3.065195
  C      -4.033774     -7.462486      4.422516
  N      -4.639925     -6.151483      4.279360
  Mo     -3.426321     -4.642868      3.652743
  N      -1.669324     -5.387489      4.386106
  C      -0.809326     -6.257571      3.582038
  C      -1.468128     -6.476316      2.232488
  H      -0.664158     -7.211710      4.118244
  H       0.187287     -5.809017      3.437022
  H      -1.127796     -7.412602      1.762454
  H      -1.227424     -5.646066      1.562265
  H      -4.771468     -8.232823      4.683936
  H      -3.272877     -7.434621      5.218409
  H      -4.176208     -8.214327      2.413739
  H      -2.572761     -8.476526      3.140253
  H      -2.459619     -4.963166     -0.085873
  H      -4.183661     -4.528549      0.014446
  H      -3.375807     -7.098219      0.406528
  H      -4.743154     -6.408784      1.335035
  C      -2.507904     -2.829321      1.419159
  C      -2.232642     -2.330712      0.120665
  C      -1.773486     -1.036378     -0.032720
  C      -1.598837     -0.182240      1.081668
  C      -1.837636     -0.652722      2.354769
  C      -2.246810     -1.993310      2.543438
  N      -2.500017     -2.567139      3.765415
  C      -1.948718     -2.069037      4.874415
  C      -0.651943     -1.467585      5.061510
  O      -0.296715     -0.798348      6.002207
  Cl      0.629994     -2.024612      3.844061
  C      -5.895863     -5.863047      4.702478
  C      -6.791626     -6.715240      5.384913
  C      -8.076513     -6.273853      5.667684
  C      -8.495326     -4.984265      5.283506
  C      -7.627452     -4.121758      4.626715
  C      -6.315407     -4.546317      4.343852
  N      -5.377510     -3.842422      3.613621
  C      -5.655376     -2.524755      3.289242
  C      -5.560475     -2.066438      1.973402
  O      -5.378540     -2.646875      0.915060
  Cl     -5.846672     -0.211532      1.915593
  C      -1.328181     -5.206261      5.691190
  C      -0.097798     -5.588637      6.278568
  C       0.156459     -5.279114      7.602984
  C      -0.795629     -4.571700      8.370351
  C      -2.015146     -4.216171      7.826632
  C      -2.324654     -4.569836      6.493224
  N      -3.499568     -4.268738      5.846323
  C      -4.608779     -3.885485      6.521493
  C      -5.053428     -4.484155      7.741629
  O      -4.637545     -5.432843      8.369792
  Cl     -6.588302     -3.619322      8.326315
  H      -2.431621     -2.939253     -0.759419
  H      -1.591040     -0.652156     -1.037683
  H      -1.307491      0.857162      0.930216
  H      -1.750137      0.006657      3.218267
  H      -2.478970     -2.212068      5.813597
  H      -6.475381     -7.710346      5.699142
  H      -8.769496     -6.924402      6.204949
  H      -9.511134     -4.657084      5.509614
  H      -7.954407     -3.130503      4.311326
  H      -6.048328     -1.860317      4.059661
  H       0.664457     -6.083791      5.678897
  H       1.115410     -5.550265      8.047271
  H      -0.560197     -4.286136      9.396228
  H      -2.731882     -3.643106      8.412294
  H      -5.281098     -3.181826      6.042102
  N      -6.956000     -6.823535      1.660387
  N      -7.595923     -5.807345      1.834851
  H      -7.199841     -4.834100      1.741373
  H      -8.616643     -5.801962      2.105387
75
Coordinates from ORCA-job orca E -7353.779565813851
  N      -3.035402     -4.057965      1.709965
  C      -3.345802     -4.941894      0.590858
  C      -3.659944     -6.325707      1.125856
  N      -2.940698     -6.506518      2.420547
  C      -3.399019     -7.776949      3.081567
  C      -4.033686     -7.463011      4.432115
  N      -4.641223     -6.153305      4.280291
  Mo     -3.426424     -4.645352      3.656219
  N      -1.667301     -5.385456      4.391789
  C      -0.801931     -6.248868      3.585772
  C      -1.462564     -6.473755      2.237886
  H      -0.648411     -7.201747      4.121865
  H       0.190881     -5.792518      3.438528
  H      -1.119121     -7.409397      1.768866
  H      -1.228592     -5.643801      1.564736
  H      -4.772041     -8.234143      4.689340
  H      -3.280348     -7.430450      5.235182
  H      -4.153040     -8.230848      2.427560
  H      -2.552130     -8.470478      3.167306
  H      -2.476509     -4.966320     -0.088217
  H      -4.204920     -4.550219      0.025337
  H      -3.354934     -7.113126      0.416174
  H      -4.737757     -6.438589      1.337543
  C      -2.526879     -2.834469      1.416372
  C      -2.268222     -2.333198      0.115716
  C      -1.814085     -1.037157     -0.041194
  C      -1.628095     -0.184224      1.072244
  C      -1.851810     -0.657011      2.347260
  C      -2.256703     -1.998544      2.538951
  N      -2.496295     -2.573696      3.763494
  C      -1.938098     -2.075648      4.868850
  C      -0.643370     -1.468298      5.047830
  O      -0.284874     -0.798745      5.986943
  Cl      0.632413     -2.016993      3.820624
  C      -5.895426     -5.864538      4.706497
  C      -6.791176     -6.717825      5.386153
  C      -8.075087     -6.277528      5.671656
  C      -8.491763     -4.984882      5.293404
  C      -7.623592     -4.119826      4.639681
  C      -6.313175     -4.546271      4.352350
  N      -5.375789     -3.845083      3.620008
  C      -5.649938     -2.527585      3.286672
  C      -5.578444     -2.089135      1.963640
  O      -5.418473     -2.686941      0.910481
  Cl     -5.858103     -0.234611      1.881840
  C      -1.329007     -5.208263      5.697936
  C      -0.099480     -5.591747      6.286612
  C       0.150635     -5.289425      7.613541
  C      -0.804193     -4.586767      8.381945
  C      -2.022173     -4.228688      7.836176
  C      -2.327831     -4.576264      6.500311
  N      -3.500883     -4.271609      5.851661
  C      -4.610712     -3.891153      6.527291
  C      -5.057370     -4.497795      7.742787
  O      -4.644953     -5.452574      8.363742
  Cl     -6.588581     -3.632458      8.333854
  H      -2.476879     -2.940089     -0.763337
  H      -1.645066     -0.651270     -1.047819
  H      -1.340372      0.856192      0.919253
  H      -1.756222      0.001901      3.210379
  H      -2.459758     -2.224871      5.811916
  H      -6.475838     -7.714884      5.695042
  H      -8.768115     -6.929498      6.206864
  H      -9.507071     -4.657444      5.521534
  H      -7.949086     -3.126614      4.328090
  H      -6.019983     -1.850836      4.057811
  H       0.665226     -6.082642      5.686556
  H       1.108352     -5.562579      8.059354
  H      -0.572253     -4.306795      9.410174
  H      -2.740454     -3.658465      8.422812
  H      -5.280443     -3.181844      6.052830
  N      -6.955233     -6.771394      1.640576
  N      -7.533424     -5.712351      1.794182
  H      -7.075525     -4.766777      1.699282
  H      -8.560089     -5.642843      2.034190
75
Coordinates from ORCA-job orca E -7353.779536082062
  N      -3.044590     -4.065413      1.714373
  C      -3.354607     -4.953576      0.588848
  C      -3.654737     -6.338364      1.135137
  N      -2.935046     -6.506757      2.430303
  C      -3.382123     -7.777490      3.099779
  C      -4.036076     -7.457583      4.441233
  N      -4.644234     -6.152237      4.278321
  Mo     -3.424966     -4.646920      3.663072
  N      -1.663516     -5.384017      4.395465
  C      -0.793146     -6.241921      3.587587
  C      -1.457214     -6.470404      2.242086
  H      -0.628080     -7.192484      4.123898
  H       0.195262     -5.777225      3.436964
  H      -1.115130     -7.406907      1.772778
  H      -1.226025     -5.641723      1.566114
  H      -4.779669     -8.228387      4.691330
  H      -3.293034     -7.421405      5.255407
  H      -4.117289     -8.254012      2.437558
  H      -2.527324     -8.457261      3.211602
  H      -2.492232     -4.973153     -0.098897
  H      -4.221166     -4.571085      0.028646
  H      -3.343085     -7.133336      0.436315
  H      -4.734935     -6.449693      1.339316
  C      -2.540491     -2.840003      1.417704
  C      -2.291442     -2.337134      0.115934
  C      -1.842789     -1.039042     -0.042386
  C      -1.651450     -0.186039      1.070176
  C      -1.862623     -0.659335      2.346105
  C      -2.263513     -2.001986      2.539786
  N      -2.493102     -2.578307      3.765684
  C      -1.931948     -2.081912      4.869573
  C      -0.638662     -1.471058      5.042110
  O      -0.276469     -0.804921      5.980058
  Cl      0.632626     -2.010841      3.808112
  C      -5.892297     -5.865590      4.716397
  C      -6.779811     -6.724635      5.394800
  C      -8.063364     -6.292357      5.671661
  C      -8.490403     -5.003272      5.285144
  C      -7.622438     -4.128566      4.640334
  C      -6.307663     -4.547830      4.357674
  N      -5.370247     -3.846155      3.625334
  C      -5.639683     -2.526623      3.284817
  C      -5.587432     -2.109363      1.950209
  O      -5.450861     -2.727740      0.905380
  Cl     -5.851128     -0.251211      1.840215
  C      -1.326056     -5.213981      5.703211
  C      -0.096419     -5.596934      6.291025
  C       0.150066     -5.298621      7.618298
  C      -0.806871     -4.601518      8.389224
  C      -2.024313     -4.243302      7.845235
  C      -2.327134     -4.585769      6.506809
  N      -3.496986     -4.276413      5.856750
  C      -4.605303     -3.885104      6.531471
  C      -5.059295     -4.491951      7.744558
  O      -4.658406     -5.454205      8.358758
  Cl     -6.574816     -3.610938      8.341807
  H      -2.500565     -2.946112     -0.760947
  H      -1.681475     -0.650910     -1.048892
  H      -1.369833      0.856894      0.913921
  H      -1.763705     -0.002247      3.210861
  H      -2.447458     -2.236480      5.814439
  H      -6.460072     -7.719031      5.698832
  H      -8.749233     -6.954643      6.197973
  H      -9.508778     -4.681969      5.507030
  H      -7.951011     -3.135293      4.330552
  H      -5.994603     -1.840403      4.055489
  H       0.669186     -6.087530      5.691803
  H       1.109118     -5.568172      8.062380
  H      -0.575894     -4.326958      9.419007
  H      -2.746080     -3.679890      8.433486
  H      -5.264875     -3.168746      6.056873
  N      -6.968588     -6.706242      1.619397
  N      -7.532114     -5.624589      1.756144
  H      -7.063959     -4.685385      1.647550
  H      -8.561055     -5.530753      1.987007
75
Coordinates from ORCA-job orca E -7353.780595591761
  N      -3.057231     -4.068593      1.719895
  C      -3.366988     -4.955925      0.600537
  C      -3.647815     -6.346167      1.140818
  N      -2.930178     -6.508205      2.436338
  C      -3.373443     -7.779029      3.108623
  C      -4.037967     -7.459842      4.445309
  N      -4.645325     -6.152089      4.281945
  Mo     -3.423200     -4.648012      3.667636
  N      -1.662696     -5.386906      4.403251
  C      -0.788567     -6.237338      3.592404
  C      -1.452919     -6.465016      2.247536
  H      -0.616711     -7.188903      4.124731
  H       0.196780     -5.765717      3.442086
  H      -1.107791     -7.399343      1.776241
  H      -1.226957     -5.634064      1.572294
  H      -4.781505     -8.231896      4.689764
  H      -3.300394     -7.424741      5.263527
  H      -4.100372     -8.263013      2.444278
  H      -2.515617     -8.451805      3.227833
  H      -2.508131     -4.961843     -0.090248
  H      -4.240154     -4.581899      0.047969
  H      -3.319874     -7.129860      0.437684
  H      -4.727893     -6.477890      1.338415
  C      -2.566318     -2.838547      1.419662
  C      -2.345396     -2.328381      0.116628
  C      -1.906703     -1.026281     -0.044278
  C      -1.698097     -0.178132      1.067727
  C      -1.884067     -0.658623      2.345014
  C      -2.275652     -2.003967      2.539486
  N      -2.485830     -2.587089      3.765823
  C      -1.916783     -2.092286      4.866398
  C      -0.626518     -1.473275      5.031669
  O      -0.262936     -0.808940      5.971136
  Cl      0.642497     -2.000820      3.786563
  C      -5.894050     -5.859680      4.722536
  C      -6.797257     -6.713972      5.395197
  C      -8.081282     -6.261579      5.667799
  C      -8.487266     -4.965340      5.288583
  C      -7.609304     -4.101702      4.649636
  C      -6.299606     -4.535006      4.372462
  N      -5.362565     -3.842557      3.638356
  C      -5.624189     -2.527088      3.273449
  C      -5.633194     -2.170851      1.923682
  O      -5.571594     -2.847506      0.902896
  Cl     -5.864215     -0.315288      1.738941
  C      -1.326545     -5.222233      5.711494
  C      -0.097530     -5.609254      6.298346
  C       0.148730     -5.318079      7.627551
  C      -0.807194     -4.623179      8.401438
  C      -2.023625     -4.260555      7.857971
  C      -2.326728     -4.596384      6.517306
  N      -3.495729     -4.282428      5.867099
  C      -4.605778     -3.897382      6.541797
  C      -5.063123     -4.513796      7.749442
  O      -4.661602     -5.480077      8.357767
  Cl     -6.582203     -3.639149      8.348011
  H      -2.568751     -2.934011     -0.758739
  H      -1.767208     -0.632395     -1.051723
  H      -1.423434      0.866769      0.911286
  H      -1.772858     -0.004549      3.210296
  H      -2.422713     -2.255977      5.815085
  H      -6.493055     -7.714387      5.695376
  H      -8.788013     -6.909804      6.188178
  H      -9.502897     -4.632667      5.508875
  H      -7.924353     -3.105392      4.340598
  H      -5.934375     -1.809322      4.034942
  H       0.667857     -6.097124      5.697034
  H       1.107314     -5.591237      8.071157
  H      -0.576341     -4.353875      9.432827
  H      -2.743529     -3.697921      8.448505
  H      -5.265456     -3.177651      6.070959
  N      -6.929383     -6.682095      1.613458
  N      -7.409460     -5.572106      1.725944
  H      -6.861886     -4.670035      1.631919
  H      -8.439535     -5.411167      1.919670
75
Coordinates from ORCA-job orca E -7353.781522597745
  N      -3.065127     -4.072813      1.722732
  C      -3.372947     -4.962774      0.606921
  C      -3.639348     -6.356258      1.144840
  N      -2.924018     -6.511380      2.443332
  C      -3.364522     -7.781497      3.118737
  C      -4.040619     -7.462760      4.449829
  N      -4.646927     -6.153297      4.286167
  Mo     -3.421702     -4.650169      3.672254
  N      -1.660986     -5.390323      4.411029
  C      -0.783157     -6.234971      3.598493
  C      -1.447354     -6.463495      2.253899
  H      -0.606661     -7.187113      4.128177
  H       0.199876     -5.758255      3.448818
  H      -1.099590     -7.396382      1.781950
  H      -1.225640     -5.631450      1.578467
  H      -4.784156     -8.235658      4.688907
  H      -3.308634     -7.428733      5.272378
  H      -4.081339     -8.274213      2.451242
  H      -2.502971     -8.447104      3.247835
  H      -2.515857     -4.959972     -0.087003
  H      -4.252014     -4.595706      0.059166
  H      -3.297018     -7.133490      0.441663
  H      -4.717045     -6.504014      1.339277
  C      -2.588346     -2.837714      1.420621
  C      -2.392510     -2.320070      0.117150
  C      -1.962606     -1.014607     -0.045267
  C      -1.739233     -0.171515      1.066383
  C      -1.903911     -0.658951      2.344610
  C      -2.286615     -2.006407      2.538973
  N      -2.478619     -2.596045      3.765833
  C      -1.900531     -2.102206      4.862334
  C      -0.612980     -1.475791      5.017824
  O      -0.245651     -0.811490      5.956143
  Cl      0.647905     -1.990508      3.758482
  C      -5.895902     -5.856604      4.728035
  C      -6.810391     -6.708108      5.391232
  C      -8.092929     -6.245118      5.662679
  C      -8.485032     -4.941038      5.297008
  C      -7.598863     -4.081789      4.665448
  C      -6.293009     -4.526331      4.387589
  N      -5.354799     -3.841863      3.651940
  C      -5.608990     -2.530547      3.262927
  C      -5.685411     -2.236630      1.903709
  O      -5.694965     -2.972844      0.918269
  Cl     -5.896891     -0.393692      1.633345
  C      -1.327042     -5.228963      5.719774
  C      -0.098807     -5.618833      6.307762
  C       0.145915     -5.332758      7.638504
  C      -0.810331     -4.639146      8.413474
  C      -2.025471     -4.273487      7.868834
  C      -2.327402     -4.604888      6.526490
  N      -3.495437     -4.286911      5.876153
  C      -4.606203     -3.907384      6.551765
  C      -5.063981     -4.531034      7.756151
  O      -4.661203     -5.499909      8.360012
  Cl     -6.585624     -3.662356      8.357043
  H      -2.626909     -2.923281     -0.757034
  H      -1.841059     -0.615448     -1.053111
  H      -1.469815      0.874297      0.910834
  H      -1.781437     -0.007610      3.209956
  H      -2.395586     -2.273156      5.815724
  H      -6.518341     -7.715575      5.683315
  H      -8.809558     -6.890471      6.175393
  H      -9.498592     -4.602308      5.517971
  H      -7.902602     -3.080446      4.361023
  H      -5.872557     -1.781886      4.012259
  H       0.667124     -6.104894      5.705881
  H       1.103536     -5.609058      8.082925
  H      -0.580884     -4.373040      9.446112
  H      -2.745055     -3.710893      8.460032
  H      -5.266964     -3.185093      6.085362
  N      -6.895384     -6.619299      1.599206
  N      -7.309299     -5.483373      1.690882
  H      -6.703841     -4.618616      1.595755
  H      -8.333831     -5.264954      1.859283
75
Coordinates from ORCA-job orca E -7353.780416897323
  N      -3.051750     -4.060393      1.717699
  C      -3.341204     -4.950644      0.595376
  C      -3.629194     -6.338383      1.130568
  N      -2.921775     -6.508810      2.431426
  C      -3.363219     -7.781419      3.096350
  C      -4.032892     -7.476379      4.435936
  N      -4.648675     -6.167357      4.299405
  Mo     -3.426338     -4.657578      3.674828
  N      -1.660759     -5.406242      4.410246
  C      -0.787884     -6.245280      3.593951
  C      -1.448955     -6.461618      2.247485
  H      -0.615276     -7.202192      4.112728
  H       0.194143     -5.770939      3.450495
  H      -1.099408     -7.390723      1.770581
  H      -1.224711     -5.625486      1.580158
  H      -4.766713     -8.251436      4.673533
  H      -3.291761     -7.452866      5.245915
  H      -4.074220     -8.269914      2.428048
  H      -2.499576     -8.449687      3.224143
  H      -2.472951     -4.961099     -0.092922
  H      -4.213177     -4.572270      0.036658
  H      -3.291542     -7.112688      0.419481
  H      -4.690057     -6.488779      1.325440
  C      -2.578434     -2.824845      1.424695
  C      -2.376447     -2.301779      0.122181
  C      -1.950234     -0.998343     -0.034195
  C      -1.739884     -0.164122      1.083541
  C      -1.915985     -0.658330      2.364373
  C      -2.292492     -2.001644      2.548535
  N      -2.488354     -2.600090      3.772092
  C      -1.904483     -2.098497      4.865751
  C      -0.616054     -1.464852      5.004490
  O      -0.238175     -0.788313      5.933489
  Cl      0.616372     -1.968335      3.718471
  C      -5.906609     -5.858324      4.742570
  C      -6.839318     -6.690120      5.396942
  C      -8.115603     -6.207682      5.658673
  C      -8.500157     -4.900194      5.309004
  C      -7.597462     -4.053988      4.688200
  C      -6.294786     -4.524303      4.411584
  N      -5.346678     -3.852931      3.683501
  C      -5.585674     -2.535571      3.296471
  C      -5.734471     -2.318496      1.951229
  O      -5.818686     -3.158359      1.045751
  Cl     -5.930675     -0.540912      1.505583
  C      -1.329885     -5.241298      5.718073
  C      -0.098464     -5.629984      6.311045
  C       0.149858     -5.335812      7.638315
  C      -0.806954     -4.634524      8.410261
  C      -2.022809     -4.271656      7.864444
  C      -2.328432     -4.609857      6.525528
  N      -3.498657     -4.289757      5.882238
  C      -4.604851     -3.908649      6.557551
  C      -5.058913     -4.516384      7.775224
  O      -4.648847     -5.473597      8.394189
  Cl     -6.590141     -3.650240      8.364602
  H      -2.600667     -2.909018     -0.754550
  H      -1.818662     -0.594088     -1.041433
  H      -1.471115      0.873940      0.937318
  H      -1.799514     -0.009895      3.230518
  H      -2.389904     -2.266706      5.826427
  H      -6.569654     -7.710410      5.695009
  H      -8.832407     -6.860908      6.164288
  H      -9.511169     -4.558452      5.528886
  H      -7.877509     -3.041418      4.385160
  H      -5.798988     -1.758877      4.024041
  H       0.665725     -6.120300      5.710311
  H       1.108475     -5.611290      8.083012
  H      -0.576078     -4.359204      9.439737
  H      -2.743937     -3.701847      8.452011
  H      -5.274092     -3.195217      6.085513
  N      -6.868551     -6.604047      1.583334
  N      -7.312668     -5.477186      1.662452
  H      -6.729732     -4.613253      1.549990
  H      -8.323953     -5.290317      1.838152
75
Coordinates from ORCA-job orca E -7353.780628056536
  N      -3.063903     -4.072519      1.722575
  C      -3.356204     -4.966921      0.605480
  C      -3.621533     -6.358590      1.143557
  N      -2.912775     -6.515276      2.445049
  C      -3.347811     -7.786207      3.118511
  C      -4.041629     -7.476179      4.444300
  N      -4.652656     -6.166192      4.294780
  Mo     -3.422899     -4.660414      3.680144
  N      -1.657389     -5.406704      4.419500
  C      -0.776763     -6.237993      3.602180
  C      -1.439607     -6.461474      2.257263
  H      -0.593509     -7.193158      4.121865
  H       0.201309     -5.753859      3.456325
  H      -1.087360     -7.390540      1.782003
  H      -1.221396     -5.626192      1.586048
  H      -4.780551     -8.251276      4.672274
  H      -3.314529     -7.450624      5.268006
  H      -4.040828     -8.293610      2.443669
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  H      -4.685587     -6.526983      1.334321
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  C      -2.426975     -2.305390      0.120930
  C      -2.009813     -0.997921     -0.039488
  C      -1.784000     -0.164047      1.075529
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  N      -2.479022     -2.610270      3.770257
  C      -1.888254     -2.111132      4.860583
  C      -0.603190     -1.471649      4.993935
  O      -0.223699     -0.799810      5.924869
  Cl      0.628200     -1.963327      3.699712
  C      -5.908248     -5.856038      4.735694
  C      -6.847124     -6.689672      5.383283
  C      -8.121734     -6.201702      5.647975
  C      -8.495065     -4.888351      5.305299
  C      -7.588611     -4.043678      4.688044
  C      -6.288836     -4.517532      4.410444
  N      -5.338142     -3.847458      3.686427
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  C      -5.755360     -2.334970      1.935746
  O      -5.876786     -3.186512      1.043160
  Cl     -5.942280     -0.557657      1.475955
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  C      -0.094921     -5.631252      6.319046
  C       0.151400     -5.341210      7.647866
  C      -0.806630     -4.644647      8.421619
  C      -2.022471     -4.282155      7.875960
  C      -2.326209     -4.617107      6.535301
  N      -3.495682     -4.297609      5.889997
  C      -4.604161     -3.923275      6.567144
  C      -5.057203     -4.542924      7.778349
  O      -4.644606     -5.504643      8.388824
  Cl     -6.590176     -3.685571      8.374310
  H      -2.662758     -2.911255     -0.752941
  H      -1.897576     -0.590992     -1.047213
  H      -1.521788      0.877847      0.926348
  H      -1.808186     -0.013895      3.222151
  H      -2.365342     -2.287551      5.823570
  H      -6.583219     -7.711936      5.672639
  H      -8.847727     -6.849318      6.148159
  H      -9.504170     -4.540488      5.527081
  H      -7.863609     -3.029392      4.390383
  H      -5.752491     -1.741467      4.008149
  H       0.670769     -6.118065      5.717449
  H       1.109987     -5.616359      8.092491
  H      -0.576842     -4.372575      9.452386
  H      -2.744029     -3.715550      8.464575
  H      -5.273610     -3.206716      6.100736
  N      -6.845650     -6.530864      1.572800
  N      -7.249159     -5.389032      1.622877
  H      -6.629950     -4.545831      1.495326
  H      -8.260478     -5.161549      1.781328
75
Coordinates from ORCA-job orca E -7353.782590686248
  N      -3.075872     -4.090016      1.726164
  C      -3.376468     -4.988901      0.615733
  C      -3.617465     -6.385035      1.158633
  N      -2.906624     -6.522612      2.461053
  C      -3.335977     -7.790954      3.146340
  C      -4.060924     -7.471775      4.452345
  N      -4.659902     -6.160260      4.279964
  Mo     -3.420018     -4.662102      3.682123
  N      -1.656150     -5.403271      4.426842
  C      -0.765149     -6.228398      3.610406
  C      -1.430817     -6.464629      2.267629
  H      -0.570071     -7.179679      4.136010
  H       0.209443     -5.733526      3.460022
  H      -1.077820     -7.396221      1.797114
  H      -1.217229     -5.633108      1.588560
  H      -4.811782     -8.245110      4.666246
  H      -3.354913     -7.443984      5.297799
  H      -4.008799     -8.321653      2.462919
  H      -2.460128     -8.426342      3.322370
  H      -2.523028     -4.976114     -0.084088
  H      -4.265352     -4.637216      0.072140
  H      -3.239269     -7.157330      0.467375
  H      -4.692400     -6.569297      1.342648
  C      -2.626190     -2.846027      1.422447
  C      -2.464846     -2.318392      0.118738
  C      -2.055844     -1.006020     -0.045515
  C      -1.821906     -0.166769      1.065729
  C      -1.955582     -0.663507      2.344732
  C      -2.315452     -2.016625      2.539416
  N      -2.472727     -2.617902      3.767016
  C      -1.878495     -2.123378      4.855727
  C      -0.595335     -1.485042      4.990761
  O      -0.215178     -0.823963      5.926910
  Cl      0.644587     -1.971397      3.697151
  C      -5.908712     -5.852471      4.716151
  C      -6.839696     -6.692028      5.372969
  C      -8.111833     -6.207868      5.656037
  C      -8.482899     -4.893119      5.305879
  C      -7.585682     -4.048046      4.672928
  C      -6.288025     -4.513905      4.386727
  N      -5.334724     -3.835833      3.668673
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  C      -5.719949     -2.266053      1.909907
  O      -5.810021     -3.053070      0.960081
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  C      -0.091589     -5.624408      6.322726
  C       0.152557     -5.336705      7.653145
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  C      -2.022516     -4.285180      7.883316
  C      -2.323949     -4.619439      6.541280
  N      -3.492819     -4.304886      5.891717
  C      -4.605309     -3.938892      6.571400
  C      -5.053453     -4.572911      7.774185
  O      -4.635830     -5.538909      8.374116
  Cl     -6.587791     -3.728131      8.379662
  H      -2.706912     -2.923591     -0.752025
  H      -1.957103     -0.599672     -1.052913
  H      -1.566967      0.882752      0.911495
  H      -1.821665     -0.014279      3.209372
  H      -2.353057     -2.306258      5.817599
  H      -6.566093     -7.706968      5.659359
  H      -8.837849     -6.844565      6.167295
  H      -9.488692     -4.538559      5.537941
  H      -7.869104     -3.037697      4.378538
  H      -5.747574     -1.741604      4.015424
  H       0.675983     -6.107706      5.720555
  H       1.111029     -5.610193      8.097630
  H      -0.576682     -4.375803      9.460149
  H      -2.743996     -3.722727      8.472471
  H      -5.275507     -3.220596      6.111327
  N      -6.845508     -6.513359      1.560128
  N      -7.239414     -5.368239      1.584696
  H      -6.603846     -4.524708      1.445973
  H      -8.259645     -5.116194      1.724682
75
Coordinates from ORCA-job orca E -7353.783145348340
  N      -3.069209     -4.090336      1.729075
  C      -3.368530     -4.988158      0.614711
  C      -3.617305     -6.380529      1.163331
  N      -2.899897     -6.524275      2.460123
  C      -3.325144     -7.794794      3.141998
  C      -4.050974     -7.479735      4.449766
  N      -4.654918     -6.170012      4.280851
  Mo     -3.419951     -4.667923      3.683206
  N      -1.654614     -5.405382      4.428963
  C      -0.760798     -6.224384      3.611374
  C      -1.424873     -6.461532      2.267724
  H      -0.560350     -7.175597      4.134868
  H       0.210962     -5.724446      3.461640
  H      -1.069278     -7.392112      1.796953
  H      -1.212633     -5.628728      1.590180
  H      -4.800001     -8.255363      4.662520
  H      -3.344682     -7.451645      5.294905
  H      -3.996373     -8.326330      2.457518
  H      -2.447871     -8.429036      3.316804
  H      -2.516475     -4.980834     -0.086504
  H      -4.255663     -4.633606      0.068887
  H      -3.257546     -7.158439      0.467733
  H      -4.690576     -6.559227      1.355686
  C      -2.613944     -2.848222      1.424739
  C      -2.445066     -2.323624      0.120120
  C      -2.033716     -1.012975     -0.043859
  C      -1.803638     -0.172696      1.068144
  C      -1.944200     -0.667113      2.348002
  C      -2.307203     -2.018351      2.542277
  N      -2.469060     -2.619052      3.769900
  C      -1.877060     -2.125809      4.860039
  C      -0.593644     -1.486064      4.995878
  O      -0.214707     -0.826416      5.933426
  Cl      0.643799     -1.968660      3.702651
  C      -5.904621     -5.864664      4.719316
  C      -6.831191     -6.706165      5.375814
  C      -8.100874     -6.227104      5.660562
  C      -8.478474     -4.913973      5.311216
  C      -7.584913     -4.065956      4.677417
  C      -6.287124     -4.528757      4.386272
  N      -5.337484     -3.852767      3.666609
  C      -5.576060     -2.540516      3.250681
  C      -5.713311     -2.295052      1.888272
  O      -5.756628     -3.082180      0.936309
  Cl     -5.932932     -0.488613      1.528181
  C      -1.321927     -5.239762      5.735881
  C      -0.089536     -5.618118      6.325423
  C       0.153071     -5.326188      7.654490
  C      -0.809088     -4.637113      8.427565
  C      -2.026385     -4.282454      7.882196
  C      -2.326130     -4.620178      6.541155
  N      -3.493360     -4.307805      5.889399
  C      -4.605320     -3.936242      6.567867
  C      -5.058223     -4.565392      7.771219
  O      -4.649408     -5.534292      8.371040
  Cl     -6.583241     -3.706061      8.380088
  H      -2.684524     -2.929147     -0.751488
  H      -1.930679     -0.608069     -1.051631
  H      -1.546590      0.875632      0.913304
  H      -1.812721     -0.018214      3.213478
  H      -2.352585     -2.309187      5.822144
  H      -6.553862     -7.720917      5.660448
  H      -8.818676     -6.874691      6.168303
  H      -9.484974     -4.563753      5.544059
  H      -7.872151     -3.056324      4.384556
  H      -5.775873     -1.760915      3.987550
  H       0.679709     -6.099995      5.724236
  H       1.112324     -5.594222      8.099554
  H      -0.580777     -4.363629      9.458305
  H      -2.750003     -3.721078      8.469783
  H      -5.270670     -3.215862      6.105568
  N      -6.883331     -6.424646      1.579044
  N      -7.320439     -5.290164      1.599654
  H      -6.728956     -4.416704      1.422780
  H      -8.341601     -5.079824      1.771858
75
Coordinates from ORCA-job orca E -7353.783850172254
  N      -3.065346     -4.098694      1.730572
  C      -3.352202     -5.000990      0.613855
  C      -3.602116     -6.391171      1.168169
  N      -2.893325     -6.527821      2.468821
  C      -3.314034     -7.796491      3.154935
  C      -4.066322     -7.480907      4.448668
  N      -4.662203     -6.170164      4.276854
  Mo     -3.415995     -4.674202      3.689003
  N      -1.652080     -5.418457      4.437764
  C      -0.753705     -6.229378      3.618687
  C      -1.418317     -6.466916      2.276281
  H      -0.547266     -7.180398      4.139428
  H       0.214359     -5.723580      3.470012
  H      -1.064180     -7.398113      1.805572
  H      -1.205612     -5.634890      1.598661
  H      -4.824296     -8.252757      4.643750
  H      -3.376364     -7.461921      5.307882
  H      -3.960991     -8.347735      2.462085
  H      -2.430331     -8.415519      3.357013
  H      -2.498796     -4.995848     -0.086803
  H      -4.239755     -4.650107      0.063542
  H      -3.228862     -7.170392      0.479722
  H      -4.675251     -6.567710      1.339127
  C      -2.626582     -2.850628      1.426998
  C      -2.470959     -2.320399      0.122255
  C      -2.076790     -1.005080     -0.040285
  C      -1.849551     -0.166287      1.073609
  C      -1.975478     -0.666695      2.353419
  C      -2.322108     -2.021556      2.545380
  N      -2.462202     -2.630906      3.772231
  C      -1.858290     -2.136623      4.856772
  C      -0.576386     -1.490424      4.975135
  O      -0.182812     -0.834529      5.910220
  Cl      0.637690     -1.950789      3.651687
  C      -5.910410     -5.859209      4.712626
  C      -6.832897     -6.691726      5.382436
  C      -8.097722     -6.207416      5.669047
  C      -8.478124     -4.898011      5.306952
  C      -7.584809     -4.055585      4.664271
  C      -6.288124     -4.523597      4.371536
  N      -5.323279     -3.848095      3.670265
  C      -5.542733     -2.522380      3.269491
  C      -5.698305     -2.256476      1.920042
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  Cl     -5.881933     -0.457928      1.565522
  C      -1.319076     -5.249823      5.743846
  C      -0.084870     -5.622718      6.334819
  C       0.156429     -5.325352      7.662158
  C      -0.808957     -4.637294      8.433539
  C      -2.027311     -4.288353      7.888133
  C      -2.325209     -4.629680      6.548047
  N      -3.489833     -4.315919      5.894705
  C      -4.603776     -3.945390      6.570879
  C      -5.055907     -4.572171      7.775740
  O      -4.642646     -5.537065      8.379720
  Cl     -6.586590     -3.718430      8.380237
  H      -2.707159     -2.929107     -0.748396
  H      -1.983062     -0.595363     -1.047219
  H      -1.605052      0.884840      0.920860
  H      -1.842639     -0.020371      3.220732
  H      -2.319125     -2.326112      5.825000
  H      -6.554794     -7.703067      5.678344
  H      -8.810359     -6.849020      6.187981
  H      -9.481403     -4.543279      5.545149
  H      -7.866507     -3.042963      4.372609
  H      -5.691160     -1.742703      4.019734
  H       0.685804     -6.105088      5.735467
  H       1.116815     -5.587958      8.107539
  H      -0.580433     -4.358760      9.462660
  H      -2.754605     -3.727690      8.473012
  H      -5.272047     -3.230396      6.104341
  N      -6.888192     -6.431721      1.539620
  N      -7.357322     -5.306340      1.522404
  H      -6.782384     -4.419851      1.328859
  H      -8.382125     -5.116455      1.679226
75
Coordinates from ORCA-job orca E -7353.784237237107
  N      -3.063296     -4.097159      1.731475
  C      -3.338541     -4.999967      0.611099
  C      -3.594978     -6.389424      1.163333
  N      -2.892674     -6.526195      2.469485
  C      -3.317671     -7.794882      3.154119
  C      -4.061954     -7.480612      4.453771
  N      -4.655944     -6.169017      4.287379
  Mo     -3.412975     -4.672832      3.691075
  N      -1.651889     -5.423758      4.443453
  C      -0.755492     -6.239138      3.626503
  C      -1.416497     -6.468977      2.281165
  H      -0.558394     -7.192972      4.146079
  H       0.216954     -5.739957      3.483052
  H      -1.063920     -7.399262      1.807188
  H      -1.199502     -5.634056      1.608230
  H      -4.821623     -8.250627      4.651078
  H      -3.367751     -7.465006      5.309977
  H      -3.973381     -8.339270      2.463044
  H      -2.436222     -8.420376      3.347530
  H      -2.478388     -4.994930     -0.081143
  H      -4.221057     -4.649623      0.052240
  H      -3.221533     -7.169149      0.475622
  H      -4.668170     -6.560435      1.326563
  C      -2.637888     -2.843728      1.429537
  C      -2.492988     -2.308987      0.125396
  C      -2.110627     -0.989836     -0.035321
  C      -1.883030     -0.152937      1.080201
  C      -1.996934     -0.658401      2.359079
  C      -2.333292     -2.016090      2.548829
  N      -2.458236     -2.630464      3.774882
  C      -1.840225     -2.138616      4.853004
  C      -0.557510     -1.493376      4.954899
  O      -0.149398     -0.842190      5.886494
  Cl      0.635749     -1.944052      3.609770
  C      -5.904914     -5.859433      4.723731
  C      -6.821034     -6.688155      5.405663
  C      -8.086523     -6.202097      5.691569
  C      -8.469360     -4.897077      5.314582
  C      -7.580550     -4.058340      4.662952
  C      -6.285016     -4.526672      4.370906
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  C      -5.710772     -2.268185      1.906041
  O      -5.773740     -3.053429      0.941940
  Cl     -5.921213     -0.478248      1.545776
  C      -1.322833     -5.259981      5.750716
  C      -0.093619     -5.642556      6.345772
  C       0.144189     -5.349330      7.674304
  C      -0.819456     -4.656021      8.443479
  C      -2.033182     -4.297875      7.894531
  C      -2.328350     -4.635030      6.552760
  N      -3.487252     -4.310406      5.895897
  C      -4.601311     -3.932483      6.567299
  C      -5.060967     -4.554069      7.771738
  O      -4.659307     -5.521679      8.377743
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  H      -2.728320     -2.917413     -0.745802
  H      -2.026490     -0.576183     -1.041439
  H      -1.646964      0.900707      0.929455
  H      -1.861958     -0.014586      3.228309
  H      -2.287225     -2.330808      5.827180
  H      -6.537641     -7.694339      5.712289
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  H      -9.472161     -4.540393      5.552271
  H      -7.863972     -3.047237      4.366274
  H      -5.667622     -1.744226      4.000645
  H       0.676211     -6.129384      5.748831
  H       1.100885     -5.619386      8.122852
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  N      -6.899415     -6.433858      1.515582
  N      -7.331725     -5.298400      1.494547
  H      -6.724264     -4.427543      1.311505
  H      -8.354151     -5.080761      1.630483
75
Coordinates from ORCA-job orca E -7353.784496371371
  N      -3.063561     -4.095777      1.733182
  C      -3.329236     -5.000547      0.612120
  C      -3.588516     -6.390239      1.164092
  N      -2.890658     -6.525330      2.472216
  C      -3.318996     -7.792523      3.157478
  C      -4.054689     -7.476932      4.461488
  N      -4.647920     -6.165313      4.295931
  Mo     -3.408007     -4.669125      3.693591
  N      -1.650701     -5.428078      4.451084
  C      -0.756238     -6.247182      3.635724
  C      -1.413847     -6.470077      2.287645
  H      -0.567130     -7.203565      4.153810
  H       0.219857     -5.753725      3.496859
  H      -1.061453     -7.398916      1.810530
  H      -1.193735     -5.631995      1.619508
  H      -4.814621     -8.245409      4.663002
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  H      -4.663695     -6.557480      1.320387
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  C      -2.520109     -2.298662      0.126900
  C      -2.149300     -0.975985     -0.033295
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  C      -2.014131     -0.651606      2.361130
  C      -2.341232     -2.011488      2.549577
  N      -2.449169     -2.630761      3.775078
  C      -1.818263     -2.142135      4.847674
  C      -0.535511     -1.495911      4.936004
  O      -0.115702     -0.849370      5.866034
  Cl      0.640072     -1.935403      3.571218
  C      -5.896194     -5.856038      4.731092
  C      -6.806683     -6.684404      5.421318
  C      -8.072647     -6.203228      5.707627
  C      -8.461061     -4.902309      5.319735
  C      -7.576965     -4.062711      4.661002
  C      -6.279380     -4.526482      4.370233
  N      -5.314109     -3.855458      3.668461
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  C      -5.722838     -2.285337      1.890123
  O      -5.784285     -3.080023      0.929606
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  C      -1.326086     -5.269362      5.759550
  C      -0.102041     -5.661928      6.358918
  C       0.131895     -5.373724      7.688993
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  C      -2.038854     -4.307661      7.903178
  C      -2.330670     -4.639238      6.559247
  N      -3.483622     -4.303705      5.898150
  C      -4.598861     -3.921886      6.564729
  C      -5.066101     -4.542075      7.766804
  O      -4.673227     -5.512889      8.373247
  Cl     -6.587590     -3.666246      8.361661
  H      -2.759845     -2.905886     -0.743834
  H      -2.078880     -0.558442     -1.038850
  H      -1.688741      0.914640      0.933361
  H      -1.873560     -0.010484      3.231663
  H      -2.252148     -2.339568      5.826648
  H      -6.516915     -7.686662      5.734241
  H      -8.773815     -6.842998      6.242605
  H      -9.464842     -4.547771      5.556695
  H      -7.864958     -3.054846      4.359604
  H      -5.638468     -1.740685      3.976248
  H       0.666970     -6.152681      5.764108
  H       1.084787     -5.651245      8.140898
  H      -0.605424     -4.404595      9.487831
  H      -2.763073     -3.739769      8.484499
  H      -5.255323     -3.201700      6.091112
  N      -6.908943     -6.419479      1.495169
  N      -7.313943     -5.269793      1.465616
  H      -6.681851     -4.410354      1.286651
  H      -8.335073     -5.032462      1.586949
75
Coordinates from ORCA-job orca E -7353.784628030609
  N      -3.065359     -4.094892      1.736108
  C      -3.321322     -5.000627      0.614511
  C      -3.578799     -6.390593      1.167581
  N      -2.883337     -6.524442      2.475436
  C      -3.310904     -7.790890      3.163514
  C      -4.042498     -7.473582      4.469989
  N      -4.639599     -6.164346      4.301706
  Mo     -3.401951     -4.666517      3.696328
  N      -1.647225     -5.432135      4.458852
  C      -0.752134     -6.250264      3.644013
  C      -1.406621     -6.467039      2.293591
  H      -0.565588     -7.208738      4.159421
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  H      -1.052150     -7.393311      1.812876
  H      -1.185732     -5.625146      1.630480
  H      -4.800681     -8.242629      4.675390
  H      -3.342017     -7.455019      5.320364
  H      -3.979767     -8.328435      2.480426
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  H      -2.453383     -4.991248     -0.065986
  H      -4.196355     -4.658586      0.042231
  H      -3.205535     -7.168875      0.479298
  H      -4.654765     -6.559589      1.320743
  C      -2.663387     -2.832239      1.432617
  C      -2.549176     -2.289102      0.129298
  C      -2.190324     -0.962826     -0.030296
  C      -1.950651     -0.130362      1.086021
  C      -2.030225     -0.645998      2.363688
  C      -2.347947     -2.008047      2.550536
  N      -2.438412     -2.632924      3.774854
  C      -1.796476     -2.148426      4.843311
  C      -0.514074     -1.500781      4.921048
  O      -0.084187     -0.860393      5.851287
  Cl      0.646283     -1.927061      3.538221
  C      -5.889284     -5.856446      4.736280
  C      -6.798038     -6.680182      5.435113
  C      -8.063570     -6.191193      5.719202
  C      -8.452230     -4.894837      5.319955
  C      -7.570328     -4.061408      4.654387
  C      -6.273280     -4.526790      4.367841
  N      -5.307228     -3.858862      3.667943
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  C      -2.043998     -4.320181      7.912834
  C      -2.332059     -4.645571      6.566432
  N      -3.479307     -4.300484      5.900953
  C      -4.596144     -3.916094      6.562778
  C      -5.071242     -4.536979      7.761366
  O      -4.686264     -5.511784      8.366527
  Cl     -6.590471     -3.653835      8.353002
  H      -2.794972     -2.894891     -0.740539
  H      -2.135209     -0.541001     -1.034968
  H      -1.732221      0.927794      0.937790
  H      -1.883128     -0.008128      3.235633
  H      -2.218532     -2.352880      5.825807
  H      -6.508393     -7.679280      5.757286
  H      -8.763931     -6.827263      6.260307
  H      -9.455160     -4.537912      5.556910
  H      -7.857407     -3.055832      4.347073
  H      -5.602122     -1.736798      3.950433
  H       0.660576     -6.173342      5.778737
  H       1.071315     -5.680386      8.158328
  H      -0.617789     -4.430591      9.502743
  H      -2.767424     -3.750586      8.492880
  H      -5.247465     -3.193266      6.086178
  N      -6.916560     -6.386193      1.482478
  N      -7.323512     -5.245154      1.432539
  H      -6.693245     -4.380492      1.238333
  H      -8.346229     -5.014910      1.549158
75
Coordinates from ORCA-job orca E -7353.784814825937
  N      -3.061966     -4.089022      1.734750
  C      -3.309670     -4.995075      0.612883
  C      -3.573335     -6.384188      1.165206
  N      -2.881157     -6.520221      2.472921
  C      -3.312841     -7.786047      3.159645
  C      -4.033018     -7.468311      4.472068
  N      -4.631799     -6.159611      4.305375
  Mo     -3.397411     -4.660435      3.695000
  N      -1.646195     -5.433877      4.461874
  C      -0.753112     -6.254851      3.648002
  C      -1.404136     -6.464814      2.295136
  H      -0.573221     -7.215578      4.161221
  H       0.227092     -5.767565      3.516950
  H      -1.049443     -7.389599      1.811696
  H      -1.179819     -5.620325      1.636608
  H      -4.789649     -8.237507      4.682558
  H      -3.326551     -7.449178      5.317343
  H      -3.992141     -8.314790      2.479857
  H      -2.439418     -8.427861      3.331692
  H      -2.435647     -4.987114     -0.060439
  H      -4.179043     -4.653541      0.031753
  H      -3.204482     -7.162136      0.474352
  H      -4.650660     -6.546209      1.316280
  C      -2.663734     -2.824617      1.431877
  C      -2.553212     -2.279406      0.129340
  C      -2.199369     -0.951650     -0.028592
  C      -1.960064     -0.120926      1.088770
  C      -2.034818     -0.639273      2.366097
  C      -2.348183     -2.002161      2.550434
  N      -2.432760     -2.631004      3.773116
  C      -1.785757     -2.148709      4.840474
  C      -0.502240     -1.503907      4.914109
  O      -0.065996     -0.866640      5.844166
  Cl      0.650047     -1.927043      3.522641
  C      -5.881449     -5.852057      4.738413
  C      -6.786677     -6.675135      5.441940
  C      -8.052004     -6.189736      5.728544
  C      -8.447221     -4.896062      5.326462
  C      -7.569190     -4.062439      4.653877
  C      -6.269757     -4.524684      4.366210
  N      -5.304458     -3.856842      3.664881
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  C      -5.738535     -2.317732      1.863911
  O      -5.812437     -3.136674      0.918067
  Cl     -5.967235     -0.549535      1.455737
  C      -1.332019     -5.286937      5.773130
  C      -0.117492     -5.698395      6.380313
  C       0.109784     -5.419697      7.713100
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  C      -2.048029     -4.326414      7.917175
  C      -2.334430     -4.647475      6.569261
  N      -3.477257     -4.292404      5.901097
  C      -4.593930     -3.903517      6.558516
  C      -5.075785     -4.520260      7.757044
  O      -4.697944     -5.496126      8.364940
  Cl     -6.591939     -3.627750      8.342372
  H      -2.798835     -2.884678     -0.741094
  H      -2.148010     -0.527956     -1.032783
  H      -1.745592      0.937880      0.942337
  H      -1.886544     -0.003312      3.239153
  H      -2.202865     -2.355825      5.824292
  H      -6.493107     -7.671885      5.768211
  H      -8.748635     -6.824562      6.275864
  H      -9.449686     -4.540828      5.567716
  H      -7.859054     -3.057864      4.344606
  H      -5.594240     -1.733261      3.934678
  H       0.649555     -6.195778      5.788588
  H       1.056115     -5.710228      8.170487
  H      -0.627936     -4.450139      9.511588
  H      -2.768779     -3.752133      8.495877
  H      -5.240997     -3.179067      6.078394
  N      -6.926685     -6.408442      1.477242
  N      -7.338985     -5.266107      1.430070
  H      -6.710780     -4.392734      1.244228
  H      -8.364147     -5.044490      1.546773
75
Coordinates from ORCA-job orca E -7353.785073478202
  N      -3.058470     -4.077826      1.730641
  C      -3.285846     -4.987246      0.610556
  C      -3.560495     -6.373525      1.163343
  N      -2.872133     -6.512042      2.470311
  C      -3.311355     -7.776302      3.155931
  C      -4.007482     -7.456995      4.480142
  N      -4.611501     -6.150134      4.314629
  Mo     -3.386145     -4.646514      3.691655
  N      -1.642131     -5.437776      4.471173
  C      -0.750965     -6.261650      3.658521
  C      -1.394543     -6.458577      2.300440
  H      -0.581797     -7.227381      4.165996
  H       0.234045     -5.781503      3.535950
  H      -1.037889     -7.379774      1.811660
  H      -1.164493     -5.608799      1.650874
  H      -4.758195     -8.228222      4.702904
  H      -3.288162     -7.433689      5.313793
  H      -4.011126     -8.287723      2.483874
  H      -2.445546     -8.433484      3.307585
  H      -2.397047     -4.982329     -0.044363
  H      -4.141334     -4.650575      0.006581
  H      -3.202289     -7.152794      0.468548
  H      -4.640082     -6.526216      1.318111
  C      -2.672566     -2.808709      1.428324
  C      -2.575270     -2.258735      0.127854
  C      -2.234980     -0.926749     -0.027232
  C      -1.994836     -0.099787      1.091500
  C      -2.054248     -0.624412      2.368118
  C      -2.354920     -1.989845      2.547625
  N      -2.420489     -2.628812      3.766496
  C      -1.759240     -2.149485      4.829029
  C      -0.474090     -1.509706      4.888136
  O      -0.019088     -0.881028      5.815948
  Cl      0.654875     -1.922578      3.471446
  C      -5.863540     -5.845018      4.739191
  C      -6.768415     -6.667870      5.443357
  C      -8.034892     -6.186846      5.729562
  C      -8.436860     -4.895105      5.327825
  C      -7.561602     -4.061467      4.648472
  C      -6.259074     -4.520464      4.361002
  N      -5.294476     -3.850425      3.660091
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  C      -5.757832     -2.335592      1.849239
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  C      -1.341742     -5.305992      5.785787
  C      -0.140615     -5.744881      6.402720
  C       0.080615     -5.477664      7.738638
  C      -0.869762     -4.754713      8.498046
  C      -2.056299     -4.342803      7.929978
  C      -2.338806     -4.653188      6.578355
  N      -3.470643     -4.273639      5.904245
  C      -4.586538     -3.874555      6.551089
  C      -5.084049     -4.480280      7.750377
  O      -4.722540     -5.457957      8.365134
  Cl     -6.593412     -3.566914      8.318966
  H      -2.820702     -2.863658     -0.743270
  H      -2.194356     -0.499071     -1.030334
  H      -1.790019      0.960688      0.948538
  H      -1.900468      0.007614      3.242640
  H      -2.161845     -2.362617      5.817018
  H      -6.472948     -7.662968      5.775288
  H      -8.729887     -6.819828      6.283187
  H      -9.439106     -4.542774      5.574248
  H      -7.852762     -3.058038      4.335306
  H      -5.564374     -1.721604      3.907603
  H       0.621860     -6.252694      5.814199
  H       1.017255     -5.788924      8.202796
  H      -0.652007     -4.500337      9.535754
  H      -2.769269     -3.755704      8.505452
  H      -5.224692     -3.147065      6.062584
  N      -6.941224     -6.443197      1.477054
  N      -7.363845     -5.303543      1.435862
  H      -6.740194     -4.415935      1.259194
  H      -8.393679     -5.096883      1.554475
75
Coordinates from ORCA-job orca E -7353.785271546113
  N      -3.057645     -4.067522      1.727210
  C      -3.270016     -4.980450      0.608982
  C      -3.548952     -6.364293      1.164252
  N      -2.861697     -6.501538      2.470474
  C      -3.305018     -7.764780      3.156425
  C      -3.988045     -7.444552      4.486631
  N      -4.593746     -6.138594      4.321364
  Mo     -3.374084     -4.631407      3.689445
  N      -1.637545     -5.440303      4.481029
  C      -0.744920     -6.261393      3.667359
  C      -1.383550     -6.448600      2.305512
  H      -0.579740     -7.231285      4.168166
  H       0.241722     -5.782428      3.552014
  H      -1.025547     -7.366986      1.812188
  H      -1.150305     -5.594871      1.662128
  H      -4.735346     -8.217465      4.716188
  H      -3.261945     -7.418613      5.314234
  H      -4.015570     -8.266958      2.488478
  H      -2.443412     -8.429927      3.297539
  H      -2.372092     -4.976563     -0.033441
  H      -4.116719     -4.650821     -0.010710
  H      -3.197427     -7.146420      0.469328
  H      -4.629184     -6.509103      1.323767
  C      -2.683432     -2.793969      1.425642
  C      -2.600439     -2.238592      0.127522
  C      -2.271145     -0.902817     -0.024217
  C      -2.027382     -0.080558      1.096057
  C      -2.070424     -0.611826      2.371319
  C      -2.360550     -1.979481      2.546071
  N      -2.405581     -2.629704      3.760667
  C      -1.729370     -2.153283      4.818111
  C      -0.442851     -1.519587      4.861493
  O       0.033837     -0.902801      5.786739
  Cl      0.659626     -1.917746      3.416465
  C      -5.846779     -5.835579      4.739787
  C      -6.753275     -6.658949      5.442393
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  C      -8.425492     -4.888923      5.322693
  C      -7.550236     -4.055691      4.640947
  C      -6.245800     -4.512528      4.357052
  N      -5.281004     -3.840079      3.658046
  C      -5.535428     -2.539204      3.175068
  C      -5.782463     -2.357398      1.832668
  O      -5.888060     -3.212731      0.917692
  Cl     -6.033252     -0.605639      1.372037
  C      -1.350334     -5.324833      5.798873
  C      -0.161838     -5.788723      6.424028
  C       0.053082     -5.533704      7.762928
  C      -0.889924     -4.797799      8.519719
  C      -2.064713     -4.363198      7.944773
  C      -2.342828     -4.662038      6.589397
  N      -3.463130     -4.257796      5.910522
  C      -4.578650     -3.849350      6.546725
  C      -5.092276     -4.445138      7.746194
  O      -4.746811     -5.424710      8.366258
  Cl     -6.596087     -3.514789      8.296957
  H      -2.846876     -2.842453     -0.744039
  H      -2.241415     -0.470572     -1.025637
  H      -1.830196      0.981912      0.956772
  H      -1.908821      0.016113      3.247283
  H      -2.117518     -2.372556      5.810534
  H      -6.458814     -7.653610      5.777281
  H      -8.718524     -6.809271      6.281398
  H      -9.427932     -4.538088      5.570479
  H      -7.839900     -3.052560      4.324627
  H      -5.528151     -1.704335      3.874591
  H       0.596837     -6.304829      5.838032
  H       0.980378     -5.864284      8.232727
  H      -0.675127     -4.552042      9.560091
  H      -2.770770     -3.765582      8.517981
  H      -5.208710     -3.120089      6.050089
  N      -6.941890     -6.473552      1.479987
  N      -7.388203     -5.343355      1.441703
  H      -6.781805     -4.438775      1.267175
  H      -8.422331     -5.160338      1.566458
75
Coordinates from ORCA-job orca E -7353.785518682989
  N      -3.057368     -4.056658      1.721939
  C      -3.254060     -4.973961      0.605533
  C      -3.536192     -6.353868      1.166309
  N      -2.847247     -6.488202      2.471815
  C      -3.294091     -7.751176      3.157836
  C      -3.969006     -7.431833      4.492242
  N      -4.573025     -6.124973      4.329002
  Mo     -3.358221     -4.613750      3.686326
  N      -1.631779     -5.444162      4.493797
  C      -0.734944     -6.257830      3.677416
  C      -1.368432     -6.435389      2.311321
  H      -0.570264     -7.232369      4.169277
  H       0.251538     -5.776116      3.570528
  H      -1.009610     -7.351100      1.813427
  H      -1.132599     -5.577962      1.673561
  H      -4.714801     -8.205631      4.724988
  H      -3.238948     -7.406188      5.316572
  H      -4.012026     -8.245519      2.491789
  H      -2.435499     -8.422146      3.290812
  H      -2.347774     -4.970675     -0.025215
  H      -4.093454     -4.653755     -0.028815
  H      -3.193660     -7.142073      0.473839
  H      -4.616241     -6.488693      1.335635
  C      -2.700388     -2.777009      1.422021
  C      -2.638303     -2.213977      0.127450
  C      -2.323904     -0.873027     -0.019110
  C      -2.074208     -0.057599      1.103495
  C      -2.094435     -0.598101      2.376313
  C      -2.369987     -1.968719      2.544407
  N      -2.387017     -2.634881      3.752680
  C      -1.692335     -2.160615      4.803634
  C      -0.404329     -1.534923      4.826969
  O       0.100161     -0.933951      5.748481
  Cl      0.663432     -1.911659      3.345875
  C      -5.828387     -5.823973      4.738603
  C      -6.740672     -6.647718      5.434152
  C      -8.011008     -6.170042      5.707622
  C      -8.412687     -4.877453      5.304182
  C      -7.533344     -4.044903      4.627115
  C      -6.227785     -4.501806      4.351062
  N      -5.260961     -3.825573      3.658177
  C      -5.518106     -2.531414      3.156103
  C      -5.809115     -2.380358      1.819146
  O      -5.942167     -3.254057      0.925654
  Cl     -6.065522     -0.635810      1.327547
  C      -1.360735     -5.349206      5.815330
  C      -0.187417     -5.842137      6.449509
  C       0.020289     -5.601225      7.791648
  C      -0.913338     -4.850088      8.546032
  C      -2.074083     -4.389388      7.963708
  C      -2.347508     -4.675319      6.604271
  N      -3.453372     -4.241261      5.920479
  C      -4.567508     -3.818588      6.542233
  C      -5.102136     -4.396574      7.744332
  O      -4.776839     -5.375769      8.374594
  Cl     -6.598243     -3.443603      8.267754
  H      -2.886177     -2.815887     -0.744945
  H      -2.309632     -0.434074     -1.017709
  H      -1.886475      1.007523      0.969375
  H      -1.921939      0.024682      3.253892
  H      -2.063318     -2.385701      5.801398
  H      -6.450689     -7.643104      5.770217
  H      -8.715576     -6.794185      6.260211
  H      -9.416346     -4.527245      5.547971
  H      -7.817902     -3.041054      4.308378
  H      -5.470665     -1.679996      3.835026
  H       0.566732     -6.367737      5.866300
  H       0.936111     -5.954878      8.267484
  H      -0.701329     -4.613499      9.589074
  H      -2.771018     -3.779048      8.534582
  H      -5.187436     -3.089010      6.033285
  N      -6.932474     -6.518289      1.492558
  N      -7.407860     -5.401215      1.463463
  H      -6.823599     -4.480707      1.292258
  H      -8.445427     -5.244287      1.597882
75
Coordinates from ORCA-job orca E -7353.785760715105
  N      -3.059373     -4.047336      1.717630
  C      -3.247885     -4.967912      0.602578
  C      -3.526746     -6.344668      1.170126
  N      -2.832929     -6.474134      2.474451
  C      -3.279135     -7.737609      3.161450
  C      -3.957210     -7.420074      4.494800
  N      -4.557882     -6.111936      4.332799
  Mo     -3.343891     -4.597167      3.683911
  N      -1.627122     -5.445817      4.505329
  C      -0.723591     -6.247331      3.684450
  C      -1.354051     -6.418955      2.315297
  H      -0.553676     -7.225483      4.167323
  H       0.259976     -5.757893      3.584428
  H      -0.994028     -7.332417      1.813934
  H      -1.118773     -5.558698      1.680773
  H      -4.703537     -8.193978      4.725795
  H      -3.228828     -7.396161      5.320829
  H      -3.995657     -8.232316      2.494183
  H      -2.419424     -8.407237      3.294976
  H      -2.339767     -4.962831     -0.025288
  H      -4.087534     -4.656469     -0.035893
  H      -3.189802     -7.139251      0.482357
  H      -4.605434     -6.472680      1.350871
  C      -2.715317     -2.762792      1.419469
  C      -2.672657     -2.192410      0.128302
  C      -2.366759     -0.848187     -0.013473
  C      -2.106392     -0.040458      1.111203
  C      -2.106773     -0.589569      2.381356
  C      -2.374155     -1.961542      2.543511
  N      -2.367650     -2.642115      3.745783
  C      -1.657100     -2.170331      4.791767
  C      -0.366494     -1.555287      4.799140
  O       0.163360     -0.970775      5.717617
  Cl      0.669292     -1.912266      3.287308
  C      -5.815197     -5.812013      4.735473
  C      -6.734150     -6.636460      5.422662
  C      -8.006665     -6.158361      5.684836
  C      -8.402312     -4.863361      5.280049
  C      -7.517232     -4.030889      4.612274
  C      -6.211518     -4.489451      4.345639
  N      -5.241328     -3.810228      3.661165
  C      -5.498859     -2.523309      3.138756
  C      -5.838010     -2.402091      1.809749
  O      -5.998780     -3.291289      0.939149
  Cl     -6.105328     -0.665178      1.290721
  C      -1.369257     -5.369015      5.829652
  C      -0.207401     -5.883397      6.469794
  C      -0.005637     -5.654639      7.814475
  C      -0.932777     -4.894268      8.568285
  C      -2.082875     -4.414180      7.981196
  C      -2.352107     -4.688558      6.618465
  N      -3.445667     -4.229859      5.931286
  C      -4.558545     -3.794986      6.540209
  C      -5.111750     -4.357394      7.744559
  O      -4.803443     -5.335915      8.383079
  Cl     -6.601441     -3.387245      8.243327
  H      -2.926245     -2.790910     -0.744580
  H      -2.366940     -0.402528     -1.009060
  H      -1.922648      1.026236      0.981977
  H      -1.921095      0.028022      3.260007
  H      -2.015701     -2.398605      5.793603
  H      -6.449517     -7.633538      5.757801
  H      -8.720321     -6.778117      6.230169
  H      -9.407582     -4.512748      5.516604
  H      -7.795433     -3.025443      4.293107
  H      -5.409571     -1.655774      3.793861
  H       0.543993     -6.414696      5.888258
  H       0.901274     -6.025849      8.294124
  H      -0.723053     -4.665670      9.613456
  H      -2.773322     -3.795708      8.551104
  H      -5.169773     -3.065794      6.020560
  N      -6.913596     -6.559514      1.509083
  N      -7.429598     -5.461434      1.487887
  H      -6.879124     -4.525243      1.312986
  H      -8.469201     -5.338984      1.637268
75
Coordinates from ORCA-job orca E -7353.785986861726
  N      -3.061913     -4.040486      1.714418
  C      -3.248894     -4.962641      0.599646
  C      -3.521912     -6.336505      1.174738
  N      -2.820742     -6.461323      2.477164
  C      -3.263158     -7.726038      3.165430
  C      -3.952854     -7.411135      4.494028
  N      -4.549302     -6.101501      4.332823
  Mo     -3.332355     -4.584211      3.681656
  N      -1.624063     -5.445597      4.514245
  C      -0.712984     -6.232976      3.687932
  C      -1.342233     -6.402364      2.316874
  H      -0.533941     -7.213302      4.162858
  H       0.265719     -5.732999      3.592491
  H      -0.980910     -7.314316      1.813629
  H      -1.109651     -5.540442      1.683367
  H      -4.701869     -8.184288      4.718722
  H      -3.230496     -7.390738      5.325787
  H      -3.971436     -8.227356      2.494287
  H      -2.399319     -8.388942      3.306102
  H      -2.343677     -4.954855     -0.032433
  H      -4.094384     -4.657154     -0.034711
  H      -3.190434     -7.137560      0.492079
  H      -4.599126     -6.458923      1.367614
  C      -2.726176     -2.752436      1.417817
  C      -2.701198     -2.175746      0.129757
  C      -2.399069     -0.829620     -0.008232
  C      -2.124769     -0.029138      1.117683
  C      -2.108312     -0.585552      2.385221
  C      -2.372737     -1.957793      2.542743
  N      -2.349570     -2.649721      3.740240
  C      -1.627930     -2.180570      4.783384
  C      -0.333574     -1.576949      4.780638
  O       0.214824     -1.006207      5.697376
  Cl      0.678838     -1.920996      3.248605
  C      -5.808538     -5.801781      4.729893
  C      -6.734596     -6.627255      5.407262
  C      -8.009110     -6.147876      5.656471
  C      -8.396703     -4.849864      5.250743
  C      -7.504897     -4.016562      4.596292
  C      -6.199325     -4.477881      4.339628
  N      -5.224210     -3.796227      3.665752
  C      -5.477917     -2.515447      3.125744
  C      -5.863818     -2.417999      1.807042
  O      -6.055723     -3.316356      0.956739
  Cl     -6.132230     -0.683250      1.268653
  C      -1.375283     -5.382801      5.840465
  C      -0.220249     -5.909956      6.483517
  C      -0.022540     -5.690007      7.829946
  C      -0.946389     -4.926003      8.584399
  C      -2.090127     -4.434181      7.995029
  C      -2.356285     -4.699798      6.629974
  N      -3.441124     -4.224066      5.940483
  C      -4.552993     -3.779036      6.538997
  C      -5.121268     -4.328292      7.745374
  O      -4.825231     -5.305432      8.390872
  Cl     -6.605991     -3.345862      8.223688
  H      -2.963861     -2.770194     -0.743125
  H      -2.412755     -0.377861     -1.000843
  H      -1.941265      1.038377      0.992243
  H      -1.909272      0.027381      3.264411
  H      -1.980668     -2.408511      5.787737
  H      -6.454897     -7.626090      5.740022
  H      -8.731771     -6.765068      6.191370
  H      -9.403775     -4.498052      5.477863
  H      -7.776609     -3.008813      4.279156
  H      -5.344177     -1.634453      3.756322
  H       0.530170     -6.443507      5.902773
  H       0.879051     -6.071893      8.311239
  H      -0.738328     -4.703485      9.631129
  H      -2.777059     -3.812239      8.565182
  H      -5.157070     -3.050500      6.010492
  N      -6.893804     -6.601956      1.531501
  N      -7.447375     -5.522259      1.521775
  H      -6.930121     -4.576228      1.344018
  H      -8.486936     -5.430801      1.687905
75
Coordinates from ORCA-job orca E -7353.786222971067
  N      -3.066359     -4.036512      1.713914
  C      -3.259944     -4.959102      0.599709
  C      -3.522254     -6.330747      1.182736
  N      -2.809634     -6.450696      2.481438
  C      -3.243016     -7.716865      3.172598
  C      -3.952044     -7.404604      4.492413
  N      -4.546574     -6.094747      4.329707
  Mo     -3.324105     -4.575029      3.680889
  N      -1.621936     -5.442098      4.521476
  C      -0.702482     -6.212843      3.688671
  C      -1.332398     -6.384215      2.316870
  H      -0.510395     -7.193858      4.156822
  H       0.269365     -5.699468      3.595282
  H      -0.967812     -7.294557      1.813115
  H      -1.106289     -5.521055      1.682608
  H      -4.703507     -8.177406      4.708172
  H      -3.239444     -7.386525      5.332667
  H      -3.935804     -8.232791      2.496689
  H      -2.371456     -8.366296      3.326979
  H      -2.363496     -4.947302     -0.044709
  H      -4.117438     -4.657363     -0.021197
  H      -3.194854     -7.136797      0.504334
  H      -4.597110     -6.453589      1.389783
  C      -2.733130     -2.746721      1.417230
  C      -2.724530     -2.166022      0.131153
  C      -2.418787     -0.820321     -0.006377
  C      -2.124325     -0.025909      1.118559
  C      -2.094508     -0.586945      2.384454
  C      -2.363783     -1.957638      2.540787
  N      -2.331472     -2.655761      3.736337
  C      -1.601894     -2.190648      4.777760
  C      -0.302024     -1.599802      4.769699
  O       0.258010     -1.039324      5.686059
  Cl      0.694805     -1.940428      3.227833
  C      -5.808535     -5.795568      4.720446
  C      -6.742291     -6.623308      5.385631
  C      -8.018806     -6.142987      5.621162
  C      -8.397242     -4.841390      5.216818
  C      -7.498106     -4.005291      4.579738
  C      -6.192686     -4.469563      4.332405
  N      -5.210963     -3.785407      3.672986
  C      -5.458182     -2.509951      3.118251
  C      -5.888922     -2.428323      1.811529
  O      -6.111053     -3.329574      0.977260
  Cl     -6.157771     -0.692409      1.263837
  C      -1.377842     -5.388434      5.848639
  C      -0.224431     -5.918838      6.491887
  C      -0.029624     -5.704997      7.839604
  C      -0.954852     -4.944354      8.595630
  C      -2.096912     -4.449027      8.005977
  C      -2.360062     -4.707770      6.639241
  N      -3.440082     -4.223382      5.947887
  C      -4.552246     -3.773083      6.539505
  C      -5.130641     -4.315611      7.746206
  O      -4.840773     -5.292042      8.395282
  Cl     -6.614813     -3.329335      8.210746
  H      -3.002368     -2.756072     -0.740157
  H      -2.445163     -0.364338     -0.996842
  H      -1.934947      1.040817      0.994308
  H      -1.879970      0.022374      3.262685
  H      -1.954174     -2.414737      5.783657
  H      -6.466464     -7.624281      5.714371
  H      -8.749402     -6.761720      6.142286
  H      -9.406361     -4.488474      5.433265
  H      -7.764054     -2.994524      4.267873
  H      -5.276538     -1.619790      3.723467
  H       0.527662     -6.450008      5.911031
  H       0.870539     -6.090114      8.320851
  H      -0.748804     -4.726541      9.643668
  H      -2.784442     -3.829245      8.577507
  H      -5.151783     -3.044931      6.005460
  N      -6.882730     -6.627716      1.558961
  N      -7.469136     -5.564769      1.559257
  H      -6.982449     -4.614376      1.372525
  H      -8.506639     -5.499392      1.742808
75
Coordinates from ORCA-job orca E -7353.786570410246
  N      -3.072726     -4.031096      1.715909
  C      -3.287665     -4.951880      0.603803
  C      -3.532537     -6.323501      1.193272
  N      -2.802022     -6.439082      2.484838
  C      -3.221461     -7.706383      3.182033
  C      -3.948859     -7.395974      4.493145
  N      -4.547142     -6.088915      4.324694
  Mo     -3.320309     -4.566009      3.680939
  N      -1.620740     -5.431318      4.524257
  C      -0.694709     -6.187740      3.684569
  C      -1.326657     -6.362034      2.312531
  H      -0.491073     -7.168686      4.147620
  H       0.270967     -5.663110      3.591220
  H      -0.957180     -7.269707      1.807754
  H      -1.109875     -5.496856      1.677910
  H      -4.699819     -8.170587      4.702564
  H      -3.244699     -7.375387      5.340473
  H      -3.897416     -8.240969      2.503875
  H      -2.340649     -8.339043      3.350780
  H      -2.406869     -4.935184     -0.062196
  H      -4.163188     -4.650571      0.007012
  H      -3.210680     -7.131233      0.514492
  H      -4.602584     -6.456205      1.420817
  C      -2.734426     -2.742194      1.416909
  C      -2.737913     -2.161131      0.131043
  C      -2.418433     -0.818716     -0.010469
  C      -2.098160     -0.028159      1.110729
  C      -2.061277     -0.589449      2.376701
  C      -2.345862     -1.956568      2.536603
  N      -2.315991     -2.652842      3.734287
  C      -1.578983     -2.195005      4.773538
  C      -0.269739     -1.623240      4.762591
  O       0.297507     -1.069087      5.678454
  Cl      0.719467     -1.981544      3.222420
  C      -5.812106     -5.792518      4.709287
  C      -6.749086     -6.622919      5.367418
  C      -8.029419     -6.146082      5.590396
  C      -8.405027     -4.844361      5.183004
  C      -7.501805     -4.003625      4.559136
  C      -6.193871     -4.466334      4.320673
  N      -5.205181     -3.777040      3.678716
  C      -5.444447     -2.503911      3.117389
  C      -5.912632     -2.422874      1.822950
  O      -6.168969     -3.318646      0.996308
  Cl     -6.164408     -0.680068      1.277558
  C      -1.379424     -5.384366      5.852109
  C      -0.225605     -5.913454      6.494761
  C      -0.035727     -5.707272      7.844650
  C      -0.966335     -4.955616      8.602620
  C      -2.108514     -4.460302      8.012752
  C      -2.366371     -4.710562      6.643499
  N      -3.444411     -4.223750      5.950099
  C      -4.559111     -3.775075      6.538426
  C      -5.143819     -4.321680      7.740556
  O      -4.856106     -5.300135      8.387603
  Cl     -6.632474     -3.340660      8.198438
  H      -3.035116     -2.747428     -0.736965
  H      -2.453361     -0.361806     -1.000360
  H      -1.895221      1.035936      0.983938
  H      -1.829759      0.017787      3.252416
  H      -1.934949     -2.410232      5.780504
  H      -6.471024     -7.623326      5.696200
  H      -8.761504     -6.771726      6.101007
  H      -9.416781     -4.492611      5.389507
  H      -7.767458     -2.991741      4.251349
  H      -5.209483     -1.613077      3.699465
  H       0.530558     -6.438486      5.913562
  H       0.864625     -6.092039      8.325858
  H      -0.764786     -4.744679      9.653009
  H      -2.800345     -3.847715      8.586523
  H      -5.156337     -3.045926      6.003241
  N      -6.876885     -6.660733      1.608464
  N      -7.484574     -5.608882      1.605943
  H      -7.015400     -4.658093      1.402145
  H      -8.520329     -5.557034      1.802839
75
Coordinates from ORCA-job orca E -7353.786256686398
  N      -3.075966     -4.018452      1.726157
  C      -3.322387     -4.931892      0.615505
  C      -3.552300     -6.305912      1.204124
  N      -2.800930     -6.424673      2.485997
  C      -3.206971     -7.693365      3.186959
  C      -3.946053     -7.385754      4.493090
  N      -4.550745     -6.082093      4.321468
  Mo     -3.319605     -4.556354      3.685875
  N      -1.618895     -5.413693      4.522784
  C      -0.692153     -6.163443      3.676127
  C      -1.327755     -6.339045      2.304459
  H      -0.483398     -7.144204      4.136637
  H       0.270650     -5.634580      3.580200
  H      -0.954075     -7.243684      1.797776
  H      -1.119609     -5.471275      1.670875
  H      -4.695585     -8.162591      4.698055
  H      -3.245967     -7.363675      5.343601
  H      -3.869660     -8.243402      2.508227
  H      -2.318831     -8.312059      3.365452
  H      -2.460117     -4.911001     -0.074998
  H      -4.215944     -4.622544      0.048919
  H      -3.241028     -7.110493      0.516977
  H      -4.616697     -6.450944      1.452496
  C      -2.724662     -2.732878      1.424613
  C      -2.733105     -2.153655      0.137627
  C      -2.390508     -0.817523     -0.010242
  C      -2.041391     -0.029958      1.105892
  C      -2.005279     -0.588558      2.373095
  C      -2.315524     -1.950067      2.539174
  N      -2.300301     -2.636888      3.741912
  C      -1.557817     -2.192797      4.779932
  C      -0.235597     -1.645385      4.771009
  O       0.332081     -1.092792      5.687236
  Cl      0.752059     -2.032795      3.241418
  C      -5.816580     -5.788036      4.706889
  C      -6.752879     -6.622497      5.360509
  C      -8.037211     -6.152060      5.578267
  C      -8.416890     -4.852641      5.168659
  C      -7.513367     -4.005862      4.551236
  C      -6.199733     -4.462436      4.320336
  N      -5.208040     -3.773425      3.685280
  C      -5.449522     -2.522217      3.083771
  C      -5.969938     -2.482701      1.806935
  O      -6.284655     -3.402089      1.028286
  Cl     -6.206980     -0.753800      1.204150
  C      -1.376928     -5.370614      5.850878
  C      -0.220509     -5.894246      6.491090
  C      -0.036375     -5.697128      7.843873
  C      -0.975530     -4.960032      8.604680
  C      -2.120052     -4.467985      8.015625
  C      -2.371424     -4.707838      6.643234
  N      -3.451548     -4.226032      5.948361
  C      -4.570313     -3.786516      6.539806
  C      -5.154257     -4.350249      7.732254
  O      -4.861954     -5.333155      8.371093
  Cl     -6.650703     -3.382920      8.197161
  H      -3.052314     -2.735566     -0.726473
  H      -2.428555     -0.361806     -1.000783
  H      -1.818394      1.029535      0.974405
  H      -1.757465      0.016632      3.246110
  H      -1.922072     -2.397082      5.786553
  H      -6.467808     -7.622016      5.687306
  H      -8.762791     -6.792937      6.080216
  H      -9.431310     -4.504148      5.368322
  H      -7.785261     -2.995175      4.245425
  H      -5.148942     -1.617649      3.604197
  H       0.541457     -6.409467      5.908691
  H       0.866242     -6.077640      8.324327
  H      -0.780187     -4.758522      9.658308
  H      -2.819397     -3.867813      8.593033
  H      -5.168302     -3.054077      6.009848
  N      -6.881614     -6.662567      1.662183
  N      -7.488341     -5.608031      1.648656
  H      -7.016194     -4.661379      1.431400
  H      -8.523973     -5.549857      1.849580
75
Coordinates from ORCA-job orca E -7353.787034778836
  N      -3.076134     -4.007464      1.729030
  C      -3.335136     -4.919281      0.620620
  C      -3.556428     -6.294127      1.210087
  N      -2.793471     -6.411530      2.485879
  C      -3.192173     -7.680631      3.189956
  C      -3.937977     -7.374227      4.492846
  N      -4.546925     -6.073600      4.315328
  Mo     -3.314048     -4.543676      3.685278
  N      -1.616945     -5.404738      4.525075
  C      -0.686593     -6.146853      3.674690
  C      -1.321478     -6.319986      2.301324
  H      -0.474443     -7.128761      4.130880
  H       0.273963     -5.613597      3.581060
  H      -0.943775     -7.221447      1.792001
  H      -1.117764     -5.448974      1.670626
  H      -4.685692     -8.153679      4.694967
  H      -3.241200     -7.349373      5.345872
  H      -3.847964     -8.238568      2.510768
  H      -2.300092     -8.291848      3.373593
  H      -2.480472     -4.896048     -0.079069
  H      -4.235617     -4.609925      0.065150
  H      -3.251978     -7.098358      0.519568
  H      -4.616816     -6.444994      1.473765
  C      -2.723702     -2.721565      1.426983
  C      -2.740946     -2.140674      0.141269
  C      -2.391069     -0.806224     -0.007832
  C      -2.025491     -0.023108      1.105978
  C      -1.982249     -0.583581      2.372549
  C      -2.301631     -1.942844      2.539437
  N      -2.285887     -2.629846      3.741836
  C      -1.535182     -2.195501      4.778021
  C      -0.206425     -1.664293      4.764210
  O       0.371577     -1.120340      5.679237
  Cl      0.763871     -2.046796      3.222690
  C      -5.814814     -5.783142      4.693489
  C      -6.748917     -6.619138      5.348701
  C      -8.035901     -6.155640      5.564346
  C      -8.421061     -4.860175      5.145413
  C      -7.519493     -4.011149      4.524368
  C      -6.200919     -4.460270      4.300948
  N      -5.203244     -3.765249      3.681344
  C      -5.435831     -2.517710      3.069582
  C      -5.953808     -2.481573      1.791303
  O      -6.262160     -3.400172      1.008343
  Cl     -6.164492     -0.752135      1.176427
  C      -1.381476     -5.370425      5.853914
  C      -0.229421     -5.900721      6.496336
  C      -0.051662     -5.712364      7.851363
  C      -0.992491     -4.977569      8.612226
  C      -2.132917     -4.478857      8.020640
  C      -2.378257     -4.709315      6.645432
  N      -3.454197     -4.221076      5.948106
  C      -4.574082     -3.782118      6.537001
  C      -5.163107     -4.348717      7.725343
  O      -4.874051     -5.332678      8.364004
  Cl     -6.660087     -3.380854      8.186513
  H      -3.071571     -2.719472     -0.720737
  H      -2.435449     -0.348755     -0.997273
  H      -1.795051      1.034602      0.973923
  H      -1.722318      0.018235      3.244245
  H      -1.898268     -2.398503      5.785573
  H      -6.456275     -7.613888      5.683777
  H      -8.753106     -6.798830      6.075910
  H      -9.435269     -4.512213      5.347235
  H      -7.795492     -3.001550      4.218396
  H      -5.092591     -1.615909      3.565980
  H       0.534517     -6.413686      5.914593
  H       0.847906     -6.097767      8.333739
  H      -0.802010     -4.783571      9.668192
  H      -2.833222     -3.880496      8.598690
  H      -5.169751     -3.048565      6.005837
  N      -6.899582     -6.697862      1.714519
  N      -7.558616     -5.673092      1.706224
  H      -7.139059     -4.703485      1.471256
  H      -8.590789     -5.660160      1.933213
75
Coordinates from ORCA-job orca E -7353.787213948080
  N      -3.073516     -4.010086      1.724139
  C      -3.321153     -4.929385      0.618586
  C      -3.544245     -6.301543      1.213554
  N      -2.784692     -6.409295      2.489707
  C      -3.181236     -7.676845      3.197568
  C      -3.932417     -7.368081      4.496269
  N      -4.539391     -6.067916      4.312372
  Mo     -3.306232     -4.534537      3.681765
  N      -1.614158     -5.406583      4.529816
  C      -0.679466     -6.142824      3.680138
  C      -1.312900     -6.316253      2.306271
  H      -0.462803     -7.124929      4.134014
  H       0.278479     -5.604152      3.588726
  H      -0.933489     -7.217562      1.797550
  H      -1.109465     -5.445107      1.675139
  H      -4.681168     -8.147919      4.694494
  H      -3.240883     -7.342592      5.353571
  H      -3.832861     -8.239189      2.517580
  H      -2.287440     -8.284388      3.386568
  H      -2.460382     -4.908764     -0.072509
  H      -4.215983     -4.627953      0.051911
  H      -3.236510     -7.109413      0.528743
  H      -4.605006     -6.448646      1.476187
  C      -2.722908     -2.723713      1.419067
  C      -2.742517     -2.144585      0.133443
  C      -2.396473     -0.809168     -0.016990
  C      -2.033383     -0.025877      1.095631
  C      -1.985050     -0.585905      2.362861
  C      -2.299274     -1.945359      2.530555
  N      -2.275545     -2.635960      3.731281
  C      -1.522231     -2.200405      4.768267
  C      -0.192416     -1.677051      4.752776
  O       0.398910     -1.155323      5.672633
  Cl      0.776173     -2.073669      3.211155
  C      -5.811200     -5.781283      4.673579
  C      -6.751293     -6.619879      5.317355
  C      -8.040999     -6.159128      5.518471
  C      -8.422539     -4.861770      5.100928
  C      -7.514350     -4.009023      4.495347
  C      -6.195619     -4.457244      4.280375
  N      -5.193020     -3.753562      3.680173
  C      -5.419806     -2.487432      3.101946
  C      -6.025367     -2.408742      1.863674
  O      -6.423855     -3.299482      1.090190
  Cl     -6.255306     -0.658998      1.314718
  C      -1.384879     -5.377554      5.858770
  C      -0.238171     -5.917515      6.504395
  C      -0.060514     -5.728690      7.858806
  C      -0.995396     -4.983892      8.617781
  C      -2.130727     -4.477051      8.023972
  C      -2.377131     -4.708402      6.649180
  N      -3.447488     -4.209821      5.950643
  C      -4.564645     -3.761768      6.533749
  C      -5.162729     -4.316533      7.724916
  O      -4.886934     -5.301720      8.366944
  Cl     -6.662277     -3.344273      8.164048
  H      -3.071839     -2.725133     -0.726996
  H      -2.443404     -0.352208     -1.006340
  H      -1.805481      1.032075      0.962918
  H      -1.722111      0.016021      3.233038
  H      -1.884383     -2.404354      5.775895
  H      -6.462364     -7.614661      5.655110
  H      -8.765048     -6.800106      6.022750
  H      -9.438448     -4.515036      5.295651
  H      -7.785318     -2.996760      4.192778
  H      -5.010640     -1.605178      3.589258
  H       0.522828     -6.436135      5.923875
  H       0.835127     -6.121046      8.342784
  H      -0.803438     -4.788222      9.672972
  H      -2.824974     -3.869679      8.600057
  H      -5.156859     -3.031438      5.994304
  N      -6.885838     -6.748753      1.724304
  N      -7.568186     -5.741464      1.718467
  H      -7.171363     -4.764655      1.480479
  H      -8.597063     -5.750992      1.958003
75
Coordinates from ORCA-job orca E -7353.787721473215
  N      -3.073206     -4.003415      1.728089
  C      -3.328859     -4.921218      0.623248
  C      -3.547236     -6.292965      1.220907
  N      -2.779013     -6.401451      2.491800
  C      -3.171551     -7.669672      3.200732
  C      -3.930841     -7.362510      4.495481
  N      -4.536885     -6.062621      4.309673
  Mo     -3.299844     -4.526828      3.683537
  N      -1.610709     -5.403928      4.533528
  C      -0.673858     -6.134331      3.680839
  C      -1.307702     -6.306273      2.306104
  H      -0.453457     -7.117184      4.131167
  H       0.281954     -5.591693      3.590608
  H      -0.927194     -7.206358      1.796028
  H      -1.105824     -5.433885      1.676230
  H      -4.680867     -8.142481      4.688074
  H      -3.244272     -7.338883      5.356841
  H      -3.816076     -8.237848      2.518840
  H      -2.275073     -8.271336      3.395521
  H      -2.474144     -4.899808     -0.075191
  H      -4.229153     -4.619760      0.064389
  H      -3.246877     -7.101974      0.534243
  H      -4.605415     -6.436415      1.494386
  C      -2.725183     -2.715389      1.423033
  C      -2.756784     -2.132690      0.139621
  C      -2.409470     -0.797150     -0.010388
  C      -2.032460     -0.018693      1.100582
  C      -1.973416     -0.582509      2.366072
  C      -2.290719     -1.941085      2.533030
  N      -2.262308     -2.634782      3.732205
  C      -1.502182     -2.205033      4.767016
  C      -0.169868     -1.688353      4.745596
  O       0.427497     -1.165534      5.660913
  Cl      0.779183     -2.059249      3.185833
  C      -5.811062     -5.777128      4.662788
  C      -6.756806     -6.618095      5.295399
  C      -8.047777     -6.157850      5.487924
  C      -8.425669     -4.858512      5.073205
  C      -7.512900     -4.004028      4.477673
  C      -6.193056     -4.451983      4.270739
  N      -5.186100     -3.746993      3.680511
  C      -5.410926     -2.494219      3.076609
  C      -6.044978     -2.439408      1.849547
  O      -6.458251     -3.341595      1.100227
  Cl     -6.235165     -0.700072      1.249564
  C      -1.385424     -5.380526      5.863051
  C      -0.241333     -5.924656      6.510081
  C      -0.067538     -5.741400      7.865735
  C      -1.003637     -4.998514      8.625043
  C      -2.136574     -4.487812      8.029924
  C      -2.379151     -4.712826      6.653486
  N      -3.446765     -4.209189      5.953611
  C      -4.565679     -3.762346      6.533839
  C      -5.167618     -4.318193      7.722887
  O      -4.889040     -5.299594      8.369472
  Cl     -6.668755     -3.346965      8.158248
  H      -3.095093     -2.710410     -0.719338
  H      -2.464980     -0.337113     -0.997850
  H      -1.801783      1.038861      0.968594
  H      -1.700109      0.016132      3.235430
  H      -1.861308     -2.409086      5.775759
  H      -6.470834     -7.614674      5.629989
  H      -8.775781     -6.801555      5.982647
  H      -9.442897     -4.511884      5.261156
  H      -7.781422     -2.990388      4.177810
  H      -4.957337     -1.609747      3.517996
  H       0.520831     -6.441933      5.929914
  H       0.826080     -6.137103      8.350763
  H      -0.814567     -4.807447      9.681592
  H      -2.831615     -3.882002      8.606678
  H      -5.158580     -3.035085      5.990753
  N      -6.885344     -6.750300      1.772814
  N      -7.582777     -5.753508      1.784175
  H      -7.204640     -4.772516      1.552237
  H      -8.606505     -5.777502      2.042840
75
Coordinates from ORCA-job orca E -7353.788117644377
  N      -3.068705     -3.992273      1.738033
  C      -3.337874     -4.904570      0.632509
  C      -3.552096     -6.279754      1.225440
  N      -2.777603     -6.394786      2.491976
  C      -3.169565     -7.663599      3.199989
  C      -3.931778     -7.356762      4.493906
  N      -4.535276     -6.056271      4.307891
  Mo     -3.292934     -4.519270      3.689767
  N      -1.602531     -5.398991      4.533284
  C      -0.669842     -6.133363      3.679318
  C      -1.305968     -6.302855      2.304708
  H      -0.452197     -7.116853      4.129513
  H       0.287690     -5.594095      3.587204
  H      -0.927609     -7.203262      1.793690
  H      -1.101467     -5.430365      1.675945
  H      -4.684155     -8.135681      4.681509
  H      -3.248042     -7.337054      5.357489
  H      -3.811361     -8.233220      2.516765
  H      -2.272653     -8.263784      3.397052
  H      -2.490262     -4.881759     -0.074490
  H      -4.242969     -4.598331      0.082346
  H      -3.256455     -7.083082      0.530035
  H      -4.609068     -6.423065      1.501579
  C      -2.719255     -2.703801      1.432128
  C      -2.758841     -2.118805      0.150089
  C      -2.408407     -0.783797     -0.000452
  C      -2.020434     -0.008453      1.108741
  C      -1.954383     -0.574366      2.372976
  C      -2.274582     -1.932511      2.540218
  N      -2.248020     -2.625239      3.739535
  C      -1.486309     -2.203001      4.774717
  C      -0.149339     -1.695137      4.756328
  O       0.449270     -1.181700      5.675623
  Cl      0.808289     -2.094946      3.210184
  C      -5.811725     -5.770902      4.651942
  C      -6.761900     -6.615014      5.274265
  C      -8.054669     -6.157539      5.460562
  C      -8.433257     -4.858640      5.046265
  C      -7.516867     -4.001982      4.458167
  C      -6.194405     -4.445762      4.261028
  N      -5.182561     -3.739015      3.679496
  C      -5.406523     -2.507221      3.043042
  C      -6.064398     -2.484018      1.824578
  O      -6.508046     -3.403057      1.116620
  Cl     -6.226649     -0.765408      1.163298
  C      -1.377466     -5.375177      5.863217
  C      -0.233800     -5.919127      6.511049
  C      -0.062378     -5.738082      7.867478
  C      -1.000517     -4.997825      8.626541
  C      -2.133381     -4.487449      8.030558
  C      -2.373737     -4.710060      6.653511
  N      -3.443072     -4.208097      5.953301
  C      -4.563700     -3.763523      6.535589
  C      -5.165017     -4.324694      7.720809
  O      -4.884805     -5.306449      8.366687
  Cl     -6.680262     -3.367865      8.147184
  H      -3.104309     -2.694567     -0.707535
  H      -2.469139     -0.322227     -0.986886
  H      -1.787000      1.048714      0.976735
  H      -1.674350      0.022063      3.241894
  H      -1.849074     -2.405605      5.782520
  H      -6.476498     -7.611148      5.610046
  H      -8.781680     -6.803433      5.953626
  H      -9.451095     -4.512196      5.230727
  H      -7.785806     -2.987921      4.160631
  H      -4.905420     -1.622816      3.427477
  H       0.529551     -6.434809      5.930961
  H       0.830751     -6.133893      8.353404
  H      -0.813673     -4.808935      9.683910
  H      -2.830576     -3.884447      8.607722
  H      -5.159723     -3.040127      5.990509
  N      -6.898301     -6.745780      1.812126
  N      -7.625735     -5.770828      1.842458
  H      -7.286882     -4.776243      1.616320
  H      -8.641855     -5.826559      2.124732
75
Coordinates from ORCA-job orca E -7353.788431391675
  N      -3.062086     -3.985347      1.749651
  C      -3.341323     -4.892405      0.643049
  C      -3.554897     -6.272612      1.227943
  N      -2.780534     -6.394113      2.492175
  C      -3.174083     -7.663120      3.198416
  C      -3.935769     -7.355059      4.492892
  N      -4.535541     -6.053585      4.306302
  Mo     -3.288323     -4.515520      3.698171
  N      -1.594851     -5.399450      4.531338
  C      -0.668942     -6.142048      3.677896
  C      -1.308281     -6.307918      2.304220
  H      -0.456646     -7.126189      4.129402
  H       0.291946     -5.609208      3.582678
  H      -0.933906     -7.209315      1.792036
  H      -1.098988     -5.435715      1.676469
  H      -4.690822     -8.132535      4.676172
  H      -3.253978     -7.339410      5.357957
  H      -3.816388     -8.231255      2.514346
  H      -2.278102     -8.264687      3.395642
  H      -2.497032     -4.869372     -0.067728
  H      -4.246571     -4.580943      0.095121
  H      -3.257872     -7.066918      0.522679
  H      -4.613221     -6.417261      1.496540
  C      -2.703554     -2.699015      1.441281
  C      -2.738069     -2.115600      0.158546
  C      -2.375885     -0.783817      0.005473
  C      -1.981360     -0.010127      1.112933
  C      -1.921132     -0.574020      2.378336
  C      -2.253625     -1.929144      2.548247
  N      -2.238842     -2.616732      3.749561
  C      -1.479036     -2.199699      4.785988
  C      -0.143739     -1.685266      4.768092
  O       0.447310     -1.151667      5.680087
  Cl      0.795056     -2.023406      3.196372
  C      -5.814863     -5.769151      4.636455
  C      -6.770077     -6.617424      5.246264
  C      -8.065239     -6.163455      5.423756
  C      -8.445589     -4.864951      5.011540
  C      -7.524370     -4.004975      4.434243
  C      -6.199876     -4.443895      4.247073
  N      -5.183458     -3.731876      3.676761
  C      -5.407613     -2.511435      3.029433
  C      -6.114182     -2.491243      1.834324
  O      -6.611379     -3.410100      1.164989
  Cl     -6.261434     -0.783036      1.150915
  C      -1.368805     -5.371905      5.861351
  C      -0.224987     -5.914468      6.510148
  C      -0.054235     -5.732497      7.866615
  C      -0.993428     -4.992868      8.624849
  C      -2.126728     -4.484060      8.028010
  C      -2.366311     -4.707255      6.651159
  N      -3.438566     -4.208343      5.951439
  C      -4.558916     -3.763728      6.538524
  C      -5.154507     -4.326321      7.723586
  O      -4.863847     -5.299234      8.378817
  Cl     -6.671051     -3.369108      8.157465
  H      -3.086082     -2.690718     -0.698392
  H      -2.431341     -0.324052     -0.982060
  H      -1.738657      1.044767      0.979042
  H      -1.637017      0.021242      3.246760
  H      -1.842253     -2.406039      5.792803
  H      -6.486717     -7.613058      5.584761
  H      -8.793149     -6.810770      5.913657
  H      -9.464590     -4.519980      5.191403
  H      -7.793260     -2.990020      4.139559
  H      -4.855847     -1.637786      3.365727
  H       0.538481     -6.429990      5.929960
  H       0.838820     -6.127401      8.353445
  H      -0.807402     -4.803361      9.682246
  H      -2.825399     -3.882195      8.604808
  H      -5.159502     -3.045550      5.991492
  N      -6.911110     -6.756145      1.836637
  N      -7.667782     -5.805703      1.884903
  H      -7.368081     -4.796976      1.669134
  H      -8.675245     -5.894927      2.190224
75
Coordinates from ORCA-job orca E -7353.788895387861
  N      -3.054860     -3.981661      1.752172
  C      -3.336762     -4.888781      0.646504
  C      -3.550165     -6.269965      1.231362
  N      -2.776226     -6.390772      2.493523
  C      -3.169891     -7.658929      3.201131
  C      -3.933374     -7.348953      4.494003
  N      -4.530621     -6.047372      4.304129
  Mo     -3.280255     -4.508213      3.699857
  N      -1.588940     -5.401709      4.532169
  C      -0.664033     -6.144428      3.678630
  C      -1.304266     -6.306408      2.304568
  H      -0.452324     -7.129691      4.128208
  H       0.297483     -5.612401      3.583825
  H      -0.931720     -7.207570      1.790522
  H      -1.093565     -5.433443      1.677895
  H      -4.689465     -8.125979      4.675357
  H      -3.253738     -7.333667      5.360826
  H      -3.811103     -8.228355      2.516961
  H      -2.273607     -8.259390      3.400521
  H      -2.493587     -4.866253     -0.065353
  H      -4.241364     -4.578404      0.097544
  H      -3.252219     -7.062890      0.524900
  H      -4.609426     -6.412485      1.498182
  C      -2.696685     -2.694982      1.441843
  C      -2.734890     -2.111706      0.159680
  C      -2.375465     -0.779064      0.006091
  C      -1.981199     -0.005524      1.112939
  C      -1.917095     -0.569647      2.378340
  C      -2.245591     -1.925384      2.548324
  N      -2.228818     -2.614542      3.748955
  C      -1.468974     -2.198361      4.786658
  C      -0.132402     -1.688101      4.771506
  O       0.462494     -1.167287      5.688385
  Cl      0.818582     -2.056122      3.212828
  C      -5.812028     -5.764395      4.621038
  C      -6.772800     -6.614791      5.220734
  C      -8.069579     -6.162200      5.386918
  C      -8.447516     -4.862203      4.976190
  C      -7.521089     -4.000623      4.409056
  C      -6.196434     -4.438999      4.229729
  N      -5.177291     -3.721849      3.669433
  C      -5.401031     -2.504436      3.020027
  C      -6.169964     -2.470172      1.861174
  O      -6.713823     -3.378415      1.216681
  Cl     -6.296224     -0.762275      1.174052
  C      -1.366703     -5.375310      5.862162
  C      -0.226016     -5.922261      6.513384
  C      -0.056213     -5.740016      7.869687
  C      -0.993117     -4.995578      8.626378
  C      -2.123759     -4.483298      8.027665
  C      -2.362736     -4.706675      6.650767
  N      -3.432937     -4.203671      5.950083
  C      -4.553268     -3.756511      6.534548
  C      -5.152765     -4.315236      7.719178
  O      -4.865873     -5.286060      8.378981
  Cl     -6.678662     -3.363839      8.135787
  H      -3.082972     -2.687501     -0.696507
  H      -2.433714     -0.319258     -0.981182
  H      -1.740802      1.049730      0.979088
  H      -1.632216      0.025798      3.246093
  H      -1.833709     -2.405186      5.792726
  H      -6.493929     -7.611305      5.560552
  H      -8.803971     -6.809108      5.868152
  H      -9.468123     -4.518354      5.148735
  H      -7.786803     -2.984338      4.115261
  H      -4.806125     -1.644094      3.316805
  H       0.535988     -6.440800      5.933897
  H       0.834527     -6.138284      8.358025
  H      -0.807026     -4.804922      9.683504
  H      -2.820037     -3.877373      8.602972
  H      -5.154785     -3.044263      5.980951
  N      -6.908126     -6.781653      1.868329
  N      -7.687620     -5.852081      1.935652
  H      -7.415422     -4.835908      1.727606
  H      -8.685912     -5.966310      2.264811
75
Coordinates from ORCA-job orca E -7353.789203306007
  N      -3.037214     -3.981125      1.757284
  C      -3.324034     -4.884181      0.649678
  C      -3.541785     -6.269558      1.227184
  N      -2.775512     -6.395947      2.490846
  C      -3.175065     -7.663217      3.196376
  C      -3.936264     -7.349992      4.489901
  N      -4.529477     -6.047135      4.298918
  Mo     -3.273572     -4.510273      3.703351
  N      -1.580656     -5.409533      4.526700
  C      -0.661852     -6.161756      3.676542
  C      -1.303255     -6.319003      2.302618
  H      -0.457333     -7.147818      4.128118
  H       0.304202     -5.638074      3.580245
  H      -0.936140     -7.221670      1.787207
  H      -1.087369     -5.446788      1.676504
  H      -4.694007     -8.125018      4.672433
  H      -3.255577     -7.335587      5.355936
  H      -3.819425     -8.228868      2.512050
  H      -2.281304     -8.267564      3.395248
  H      -2.482040     -4.861538     -0.063554
  H      -4.226234     -4.568588      0.100267
  H      -3.236925     -7.056095      0.516247
  H      -4.604482     -6.412493      1.479985
  C      -2.673823     -2.696043      1.445763
  C      -2.704841     -2.114625      0.162462
  C      -2.345193     -0.782186      0.008698
  C      -1.958968     -0.006329      1.116856
  C      -1.902816     -0.568111      2.383490
  C      -2.230453     -1.924149      2.553855
  N      -2.225291     -2.609928      3.756214
  C      -1.475800     -2.191805      4.799470
  C      -0.141581     -1.673018      4.796981
  O       0.441141     -1.151664      5.720904
  Cl      0.837621     -2.068984      3.263230
  C      -5.811605     -5.762422      4.605837
  C      -6.776387     -6.613798      5.200266
  C      -8.072895     -6.160150      5.362008
  C      -8.449817     -4.858884      4.954390
  C      -7.520135     -3.997670      4.391705
  C      -6.196393     -4.437467      4.213182
  N      -5.177550     -3.717564      3.651539
  C      -5.405177     -2.504335      3.004471
  C      -6.238113     -2.442467      1.887211
  O      -6.851853     -3.328248      1.278503
  Cl     -6.347052     -0.729085      1.215952
  C      -1.357481     -5.373968      5.856192
  C      -0.215455     -5.915493      6.509290
  C      -0.043680     -5.724691      7.864097
  C      -0.980532     -4.976540      8.617312
  C      -2.113213     -4.470355      8.017114
  C      -2.354051     -4.702850      6.642102
  N      -3.427991     -4.207127      5.940567
  C      -4.547537     -3.755848      6.526576
  C      -5.144369     -4.308623      7.713354
  O      -4.861612     -5.278848      8.375992
  Cl     -6.688199     -3.372223      8.107810
  H      -3.047300     -2.691678     -0.695015
  H      -2.397407     -0.324437     -0.979868
  H      -1.719343      1.048970      0.982933
  H      -1.626289      0.029835      3.252066
  H      -1.847487     -2.400768      5.802463
  H      -6.502427     -7.611314      5.541082
  H      -8.812627     -6.806241      5.836610
  H      -9.470770     -4.515109      5.124628
  H      -7.783776     -2.980269      4.100281
  H      -4.778529     -1.656076      3.269131
  H       0.545653     -6.436682      5.930800
  H       0.848291     -6.118528      8.353753
  H      -0.792769     -4.778015      9.672674
  H      -2.809574     -3.861769      8.589314
  H      -5.151501     -3.050032      5.967740
  N      -6.917361     -6.794260      1.882954
  N      -7.727378     -5.894498      1.980646
  H      -7.496390     -4.868563      1.785599
  H      -8.711274     -6.045715      2.340837
75
Coordinates from ORCA-job orca E -7353.789207779468
  N      -3.031309     -3.972910      1.760156
  C      -3.325843     -4.872892      0.652099
  C      -3.539940     -6.258860      1.228640
  N      -2.768856     -6.387234      2.490921
  C      -3.167163     -7.654226      3.197703
  C      -3.932890     -7.341301      4.489113
  N      -4.525755     -6.038856      4.296473
  Mo     -3.264574     -4.501722      3.704271
  N      -1.576568     -5.409336      4.529702
  C      -0.656685     -6.157712      3.677253
  C      -1.297083     -6.310531      2.301529
  H      -0.452088     -7.145591      4.124612
  H       0.309264     -5.633407      3.583823
  H      -0.930207     -7.211940      1.783796
  H      -1.081598     -5.436698      1.677761
  H      -4.690816     -8.116067      4.670852
  H      -3.253472     -7.326983      5.356154
  H      -3.807475     -8.223708      2.512850
  H      -2.272047     -8.254995      3.400244
  H      -2.489955     -4.846738     -0.068371
  H      -4.233585     -4.555653      0.112060
  H      -3.237220     -7.045906      0.517517
  H      -4.601795     -6.403740      1.485621
  C      -2.669721     -2.686401      1.449656
  C      -2.710224     -2.101695      0.168353
  C      -2.348896     -0.769303      0.015474
  C      -1.951338      0.002314      1.122860
  C      -1.887866     -0.562937      2.388014
  C      -2.218319     -1.918200      2.556908
  N      -2.211632     -2.607102      3.758105
  C      -1.458547     -2.192730      4.800793
  C      -0.121328     -1.681160      4.796453
  O       0.464116     -1.161818      5.719842
  Cl      0.852343     -2.078820      3.260545
  C      -5.809265     -5.754606      4.594818
  C      -6.777433     -6.607948      5.183076
  C      -8.075938     -6.158559      5.334565
  C      -8.450579     -4.856917      4.923390
  C      -7.518251     -3.993287      4.368123
  C      -6.191682     -4.431258      4.197671
  N      -5.169740     -3.708522      3.644537
  C      -5.395623     -2.509502      2.975368
  C      -6.274793     -2.452948      1.892842
  O      -6.941738     -3.331171      1.334701
  Cl     -6.365344     -0.747691      1.189708
  C      -1.358883     -5.380383      5.859732
  C      -0.221373     -5.928835      6.514778
  C      -0.053930     -5.744358      7.871112
  C      -0.990738     -4.995955      8.624020
  C      -2.119482     -4.483282      8.021754
  C      -2.356115     -4.709036      6.644811
  N      -3.425230     -4.205627      5.940796
  C      -4.542495     -3.745797      6.523223
  C      -5.143383     -4.287792      7.713466
  O      -4.858373     -5.246892      8.390975
  Cl     -6.666059     -3.322882      8.118499
  H      -3.060814     -2.675469     -0.688438
  H      -2.408164     -0.308535     -0.971334
  H      -1.708650      1.057054      0.989973
  H      -1.603721      0.032533      3.255975
  H      -1.830111     -2.399776      5.804408
  H      -6.502745     -7.604755      5.525574
  H      -8.817461     -6.808283      5.801735
  H      -9.472776     -4.513769      5.087842
  H      -7.781545     -2.975379      4.079205
  H      -4.724072     -1.679517      3.173403
  H       0.539906     -6.450543      5.936983
  H       0.834864     -6.143558      8.362268
  H      -0.806242     -4.802666      9.680985
  H      -2.815821     -3.875004      8.594139
  H      -5.141376     -3.038640      5.960632
  N      -6.916363     -6.818971      1.905356
  N      -7.760935     -5.951145      2.024688
  H      -7.574420     -4.919757      1.823296
  H      -8.728712     -6.138179      2.411670
75
Coordinates from ORCA-job orca E -7353.789362090879
  N      -3.023474     -3.975724      1.762169
  C      -3.315831     -4.871889      0.651007
  C      -3.538846     -6.259960      1.219128
  N      -2.777136     -6.396000      2.486240
  C      -3.184890     -7.663104      3.186958
  C      -3.936056     -7.349688      4.486143
  N      -4.528488     -6.045617      4.299373
  Mo     -3.267965     -4.512644      3.706171
  N      -1.577146     -5.418406      4.524325
  C      -0.664555     -6.178702      3.675609
  C      -1.304343     -6.327344      2.300261
  H      -0.470723     -7.167438      4.126068
  H       0.307387     -5.665642      3.581862
  H      -0.942116     -7.230250      1.781893
  H      -1.083384     -5.454364      1.677535
  H      -4.693222     -8.122972      4.676661
  H      -3.246859     -7.335706      5.345396
  H      -3.838175     -8.219732      2.503835
  H      -2.295508     -8.276102      3.377944
  H      -2.476268     -4.845980     -0.065227
  H      -4.219347     -4.547929      0.108057
  H      -3.231289     -7.043524      0.506117
  H      -4.603832     -6.407294      1.463254
  C      -2.660787     -2.689978      1.454737
  C      -2.690249     -2.105629      0.172284
  C      -2.333249     -0.772187      0.022584
  C      -1.951604      0.002852      1.134022
  C      -1.898985     -0.561377      2.399644
  C      -2.223948     -1.918682      2.565678
  N      -2.225957     -2.606000      3.767292
  C      -1.484660     -2.184728      4.814503
  C      -0.153361     -1.656124      4.819924
  O       0.414566     -1.121593      5.745438
  Cl      0.840162     -2.051344      3.297004
  C      -5.809916     -5.757800      4.604721
  C      -6.775317     -6.607492      5.201989
  C      -8.070336     -6.150466      5.364713
  C      -8.444590     -4.847620      4.959666
  C      -7.516244     -3.989800      4.392773
  C      -6.193068     -4.434932      4.207305
  N      -5.176998     -3.717469      3.636297
  C      -5.412025     -2.521084      2.967087
  C      -6.267224     -2.474440      1.866501
  O      -6.913461     -3.360869      1.295569
  Cl     -6.347738     -0.772523      1.152092
  C      -1.353454     -5.381002      5.853597
  C      -0.212478     -5.924258      6.506449
  C      -0.039207     -5.731992      7.861092
  C      -0.974108     -4.980801      8.613441
  C      -2.106676     -4.473771      8.013451
  C      -2.349222     -4.708294      6.638851
  N      -3.423594     -4.213558      5.936495
  C      -4.538130     -3.750089      6.522856
  C      -5.132094     -4.286107      7.718786
  O      -4.844819     -5.242838      8.398797
  Cl     -6.644293     -3.309220      8.136329
  H      -3.030222     -2.680434     -0.688125
  H      -2.384447     -0.312276     -0.965119
  H      -1.714112      1.058970      1.003176
  H      -1.628852      0.036856      3.270197
  H      -1.859976     -2.394678      5.815947
  H      -6.502467     -7.606018      5.541127
  H      -8.812730     -6.798549      5.832992
  H      -9.464193     -4.501720      5.134200
  H      -7.778841     -2.971497      4.105979
  H      -4.763431     -1.677783      3.183389
  H       0.546628     -6.448345      5.927931
  H       0.852531     -6.126560      8.350623
  H      -0.785430     -4.781127      9.668515
  H      -2.801809     -3.863765      8.585382
  H      -5.137114     -3.041092      5.962671
  N      -6.926296     -6.807723      1.861569
  N      -7.761987     -5.933576      1.981026
  H      -7.564748     -4.902000      1.780411
  H      -8.732046     -6.113925      2.367471
75
Coordinates from ORCA-job orca E -7353.789137974837
  N      -3.020220     -3.975382      1.762639
  C      -3.322763     -4.869173      0.651275
  C      -3.546455     -6.256029      1.220525
  N      -2.779740     -6.395713      2.485107
  C      -3.188988     -7.663292      3.184063
  C      -3.935676     -7.350965      4.485625
  N      -4.529094     -6.047140      4.300333
  Mo     -3.267358     -4.514997      3.706298
  N      -1.577221     -5.420120      4.522652
  C      -0.666504     -6.182268      3.673086
  C      -1.306890     -6.329145      2.297620
  H      -0.475253     -7.171811      4.123010
  H       0.306908     -5.671959      3.579578
  H      -0.946009     -7.232084      1.778415
  H      -1.085669     -5.455751      1.675525
  H      -4.692106     -8.124138      4.679702
  H      -3.242764     -7.336653      5.341853
  H      -3.845874     -8.216579      2.501589
  H      -2.300837     -8.279482      3.371118
  H      -2.488779     -4.844758     -0.071040
  H      -4.230255     -4.540473      0.117452
  H      -3.245751     -7.042738      0.507975
  H      -4.608135     -6.400588      1.473362
  C      -2.652022     -2.691107      1.456566
  C      -2.675184     -2.106691      0.173726
  C      -2.310998     -0.775325      0.024683
  C      -1.929247     -0.001403      1.136982
  C      -1.884716     -0.564899      2.403177
  C      -2.217074     -1.920510      2.568873
  N      -2.228574     -2.605870      3.771645
  C      -1.491288     -2.183089      4.820701
  C      -0.162154     -1.648442      4.826984
  O       0.399341     -1.101901      5.749386
  Cl      0.820222     -2.003937      3.288694
  C      -5.811042     -5.759231      4.605863
  C      -6.775996     -6.608739      5.202116
  C      -8.069833     -6.150123      5.367579
  C      -8.442760     -4.844590      4.970862
  C      -7.515541     -3.987853      4.401718
  C      -6.193364     -4.436439      4.207788
  N      -5.178684     -3.720456      3.632180
  C      -5.417541     -2.528293      2.957184
  C      -6.270987     -2.488583      1.855335
  O      -6.917168     -3.374744      1.285545
  Cl     -6.348882     -0.785855      1.133917
  C      -1.351135     -5.380135      5.851906
  C      -0.208160     -5.920786      6.503236
  C      -0.031348     -5.723864      7.856778
  C      -0.964680     -4.970522      8.608593
  C      -2.099746     -4.466768      8.010395
  C      -2.346807     -4.707003      6.637560
  N      -3.424396     -4.217424      5.935255
  C      -4.541637     -3.755490      6.518517
  C      -5.143404     -4.294938      7.709383
  O      -4.886258     -5.280520      8.359635
  Cl     -6.704442     -3.373023      8.063943
  H      -3.015136     -2.679523     -0.687795
  H      -2.356829     -0.315435     -0.963254
  H      -1.685865      1.053437      1.006226
  H      -1.615583      0.033236      3.274132
  H      -1.867455     -2.393488      5.821778
  H      -6.503457     -7.609681      5.533845
  H      -8.812853     -6.802147      5.828798
  H      -9.461396     -4.497900      5.149591
  H      -7.777998     -2.968541      4.118778
  H      -4.764261     -1.684845      3.161111
  H       0.550000     -6.446061      5.924571
  H       0.862053     -6.116007      8.345170
  H      -0.773245     -4.766850      9.662382
  H      -2.792977     -3.855080      8.582488
  H      -5.141097     -3.050139      5.953834
  N      -6.920478     -6.788117      1.888852
  N      -7.753075     -5.913990      2.026058
  H      -7.557026     -4.883427      1.828219
  H      -8.717063     -6.098123      2.422857
75
Coordinates from ORCA-job orca E -7353.789479371473
  N      -3.018775     -3.975800      1.761652
  C      -3.320623     -4.870034      0.650393
  C      -3.543478     -6.257596      1.219086
  N      -2.778800     -6.396525      2.484517
  C      -3.188873     -7.663948      3.183580
  C      -3.934941     -7.350760      4.485381
  N      -4.528301     -6.047120      4.299114
  Mo     -3.266812     -4.514866      3.705208
  N      -1.576206     -5.419757      4.521749
  C      -0.665814     -6.183469      3.673417
  C      -1.305780     -6.330350      2.297852
  H      -0.475785     -7.172986      4.124063
  H       0.308214     -5.674249      3.580061
  H      -0.945028     -7.233538      1.778977
  H      -1.083769     -5.457161      1.675596
  H      -4.691162     -8.124071      4.679865
  H      -3.242106     -7.335720      5.341630
  H      -3.846630     -8.216403      2.501285
  H      -2.301264     -8.281106      3.370284
  H      -2.486323     -4.845263     -0.071473
  H      -4.227682     -4.542075      0.115504
  H      -3.240264     -7.043253      0.506369
  H      -4.605714     -6.403286      1.469208
  C      -2.652594     -2.691000      1.455166
  C      -2.676428     -2.106913      0.172218
  C      -2.315998     -0.774530      0.023177
  C      -1.937702      0.000616      1.135632
  C      -1.891973     -0.562614      2.401872
  C      -2.219637     -1.919394      2.567584
  N      -2.229366     -2.605046      3.770268
  C      -1.493013     -2.181653      4.819945
  C      -0.162834     -1.649560      4.828990
  O       0.399690     -1.111363      5.755667
  Cl      0.832901     -2.035496      3.306477
  C      -5.810824     -5.759852      4.601614
  C      -6.776304     -6.609884      5.196834
  C      -8.070975     -6.152707      5.359171
  C      -8.444837     -4.848334      4.958763
  C      -7.516939     -3.991215      4.390310
  C      -6.193935     -4.437747      4.201251
  N      -5.178633     -3.720561      3.627797
  C      -5.416880     -2.525952      2.956733
  C      -6.279281     -2.477295      1.861469
  O      -6.935275     -3.357110      1.293170
  Cl     -6.360372     -0.770303      1.152278
  C      -1.351308     -5.379799      5.851211
  C      -0.209598     -5.921399      6.503994
  C      -0.035416     -5.726636      7.858220
  C      -0.970595     -4.975217      8.609760
  C      -2.104340     -4.470324      8.010031
  C      -2.347644     -4.706923      6.636048
  N      -3.423954     -4.215945      5.933312
  C      -4.539931     -3.753295      6.517945
  C      -5.133121     -4.286422      7.715821
  O      -4.849960     -5.247184      8.391972
  Cl     -6.659647     -3.325624      8.116350
  H      -3.014096     -2.680903     -0.689352
  H      -2.362279     -0.314983     -0.964896
  H      -1.697648      1.056218      1.004941
  H      -1.625333      0.036461      3.272860
  H      -1.871040     -2.391047      5.820445
  H      -6.503612     -7.609911      5.531087
  H      -8.814400     -6.803877      5.821048
  H      -9.464122     -4.502456      5.135120
  H      -7.779733     -2.972592      4.104424
  H      -4.761949     -1.683911      3.162599
  H       0.549305     -6.446330      5.925954
  H       0.856801     -6.119946      8.347822
  H      -0.781627     -4.773938      9.664435
  H      -2.799777     -3.860685      8.582054
  H      -5.141843     -3.049724      5.953792
  N      -6.914622     -6.795756      1.880975
  N      -7.751420     -5.925456      2.018004
  H      -7.560269     -4.893972      1.820884
  H      -8.714374     -6.113638      2.415541
75
Coordinates from ORCA-job orca E -7353.789494994927
  N      -3.016295     -3.971960      1.764242
  C      -3.319452     -4.864656      0.653153
  C      -3.542375     -6.253225      1.219103
  N      -2.778956     -6.394187      2.485353
  C      -3.191639     -7.661560      3.183390
  C      -3.932454     -7.347695      4.488094
  N      -4.525164     -6.043527      4.303144
  Mo     -3.262747     -4.512303      3.706637
  N      -1.574144     -5.420946      4.523541
  C      -0.665873     -6.187146      3.675436
  C      -1.305645     -6.330792      2.299543
  H      -0.479549     -7.177791      4.125164
  H       0.310001     -5.681328      3.583160
  H      -0.946495     -7.234024      1.779692
  H      -1.081645     -5.457231      1.678509
  H      -4.688350     -8.120502      4.685600
  H      -3.236465     -7.332982      5.341743
  H      -3.853793     -8.210151      2.502292
  H      -2.305886     -8.282570      3.365972
  H      -2.485763     -4.838515     -0.069416
  H      -4.227129     -4.535459      0.119944
  H      -3.237793     -7.037418      0.505441
  H      -4.606382     -6.401488      1.466579
  C      -2.653787     -2.685939      1.458565
  C      -2.681787     -2.100190      0.176561
  C      -2.324636     -0.766695      0.028783
  C      -1.945197      0.007347      1.141591
  C      -1.895226     -0.557788      2.406931
  C      -2.219852     -1.915408      2.571113
  N      -2.225680     -2.603768      3.772362
  C      -1.486489     -2.181357      4.820890
  C      -0.155263     -1.651959      4.827405
  O       0.409259     -1.113474      5.752781
  Cl      0.837307     -2.038573      3.303042
  C      -5.807230     -5.755074      4.604303
  C      -6.773522     -6.603600      5.202035
  C      -8.067918     -6.144850      5.362778
  C      -8.439897     -4.841232      4.957084
  C      -7.511750     -3.986400      4.386334
  C      -6.189290     -4.433829      4.199911
  N      -5.174154     -3.718015      3.625643
  C      -5.413065     -2.528038      2.947004
  C      -6.288633     -2.483576      1.862122
  O      -6.954533     -3.363323      1.305700
  Cl     -6.357880     -0.782829      1.133188
  C      -1.350909     -5.383503      5.853210
  C      -0.211565     -5.929589      6.506373
  C      -0.037644     -5.736487      7.860882
  C      -0.970614     -4.982292      8.612330
  C      -2.102481     -4.473534      8.012286
  C      -2.345977     -4.708770      6.638111
  N      -3.420369     -4.213993      5.934885
  C      -4.535713     -3.747916      6.517025
  C      -5.132974     -4.277196      7.714862
  O      -4.853798     -5.237739      8.392879
  Cl     -6.657393     -3.311925      8.109915
  H      -3.019990     -2.673701     -0.685282
  H      -2.373964     -0.305697     -0.958492
  H      -1.707385      1.063562      1.012030
  H      -1.627577      0.040582      3.278092
  H      -1.862684     -2.390200      5.822091
  H      -6.500899     -7.602486      5.539937
  H      -8.812449     -6.792612      5.828061
  H      -9.458436     -4.493400      5.133904
  H      -7.773559     -2.968221      4.097690
  H      -4.746921     -1.690758      3.132819
  H       0.546038     -6.456442      5.928382
  H       0.852988     -6.133103      8.350737
  H      -0.781532     -4.782128      9.667224
  H      -2.795938     -3.861930      8.584440
  H      -5.135727     -3.045102      5.949925
  N      -6.914939     -6.814098      1.862322
  N      -7.763272     -5.955122      2.001997
  H      -7.586219     -4.922033      1.797339
  H      -8.719565     -6.150610      2.413695
75
Coordinates from ORCA-job orca E -7353.789537708476
  N      -3.014075     -3.971877      1.764157
  C      -3.321476     -4.863547      0.652632
  C      -3.544624     -6.252225      1.218122
  N      -2.780737     -6.394872      2.484246
  C      -3.195314     -7.662431      3.181275
  C      -3.931024     -7.348392      4.488698
  N      -4.524632     -6.044494      4.304564
  Mo     -3.262534     -4.513691      3.706379
  N      -1.573802     -5.421770      4.521978
  C      -0.667552     -6.191217      3.674404
  C      -1.307303     -6.333238      2.298365
  H      -0.484725     -7.182414      4.124498
  H       0.310094     -5.688785      3.582397
  H      -0.949224     -7.236591      1.778022
  H      -1.082255     -5.459489      1.677873
  H      -4.685849     -8.121437      4.689488
  H      -3.231921     -7.332710      5.339735
  H      -3.861891     -8.207069      2.501358
  H      -2.311222     -8.287164      3.359601
  H      -2.489686     -4.838082     -0.072062
  H      -4.230195     -4.532191      0.122536
  H      -3.241448     -7.036750      0.504164
  H      -4.607401     -6.399735      1.467434
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  C      -2.675433     -2.100673      0.176730
  C      -2.317820     -0.767330      0.029475
  C      -1.941442      0.007145      1.143028
  C      -1.894847     -0.557459      2.408660
  C      -2.219566     -1.915163      2.572530
  N      -2.228764     -2.602679      3.774208
  C      -1.492111     -2.178891      4.823897
  C      -0.161275     -1.648250      4.832329
  O       0.401097     -1.109529      5.758892
  Cl      0.834435     -2.035691      3.310740
  C      -5.807421     -5.756753      4.604080
  C      -6.773269     -6.605595      5.201238
  C      -8.068191     -6.148402      5.361341
  C      -8.441438     -4.844883      4.956325
  C      -7.513578     -3.989806      4.384524
  C      -6.190479     -4.436519      4.197197
  N      -5.175561     -3.720755      3.621364
  C      -5.416576     -2.530726      2.943354
  C      -6.291834     -2.486193      1.858395
  O      -6.958548     -3.364148      1.300469
  Cl     -6.364623     -0.782699      1.133585
  C      -1.350149     -5.383769      5.851801
  C      -0.210851     -5.930019      6.504734
  C      -0.036241     -5.736152      7.859089
  C      -0.968624     -4.981205      8.610382
  C      -2.100697     -4.472483      8.010592
  C      -2.344955     -4.708551      6.636783
  N      -3.419744     -4.214070      5.933724
  C      -4.534306     -3.745569      6.515365
  C      -5.131368     -4.270960      7.715107
  O      -4.852256     -5.229980      8.395333
  Cl     -6.653180     -3.302101      8.109907
  H      -3.011377     -2.674284     -0.685857
  H      -2.364492     -0.306596     -0.958043
  H      -1.703511      1.063384      1.013700
  H      -1.629824      0.041466      3.280243
  H      -1.869907     -2.386971      5.824636
  H      -6.499720     -7.604503      5.538190
  H      -8.811981     -6.797570      5.825721
  H      -9.460083     -4.497736      5.133806
  H      -7.776205     -2.972070      4.095085
  H      -4.751953     -1.692111      3.129667
  H       0.546272     -6.457573      5.926733
  H       0.854397     -6.132880      8.348823
  H      -0.779098     -4.780480      9.665079
  H      -2.793717     -3.860521      8.582914
  H      -5.133980     -3.043593      5.946915
  N      -6.906134     -6.807511      1.864540
  N      -7.754772     -5.949797      2.011782
  H      -7.581364     -4.916087      1.808447
  H      -8.708305     -6.150823      2.425677
75
Coordinates from ORCA-job orca E -7353.789569576427
  N      -3.009578     -3.970203      1.765247
  C      -3.324739     -4.859293      0.653677
  C      -3.547869     -6.248827      1.217043
  N      -2.783759     -6.395262      2.482426
  C      -3.201907     -7.663557      3.176898
  C      -3.927378     -7.349505      4.489848
  N      -4.522515     -6.046035      4.307619
  Mo     -3.260917     -4.515408      3.705793
  N      -1.572226     -5.422659      4.519267
  C      -0.670217     -6.198882      3.673157
  C      -1.309986     -6.337275      2.296911
  H      -0.494614     -7.191161      4.123947
  H       0.310989     -5.703367      3.581702
  H      -0.954056     -7.240813      1.775465
  H      -1.082500     -5.463094      1.677735
  H      -4.680078     -8.123071      4.696771
  H      -3.222236     -7.332487      5.335742
  H      -3.877201     -8.200245      2.499342
  H      -2.321022     -8.295423      3.346447
  H      -2.496659     -4.834311     -0.075093
  H      -4.235549     -4.523926      0.129696
  H      -3.246155     -7.032451      0.501426
  H      -4.609943     -6.396521      1.468418
  C      -2.645237     -2.684712      1.460834
  C      -2.666439     -2.099179      0.178401
  C      -2.308603     -0.765856      0.032227
  C      -1.936358      0.008835      1.146972
  C      -1.894022     -0.555447      2.412813
  C      -2.218574     -1.913384      2.575839
  N      -2.232979     -2.600045      3.777754
  C      -1.499715     -2.175075      4.829280
  C      -0.168616     -1.644607      4.840577
  O       0.391071     -1.105814      5.768762
  Cl      0.830706     -2.032352      3.322366
  C      -5.806370     -5.759151      4.603798
  C      -6.772166     -6.606887      5.202424
  C      -8.066909     -6.148674      5.362009
  C      -8.439698     -4.845397      4.955795
  C      -7.512307     -3.992571      4.380857
  C      -6.190176     -4.440205      4.191945
  N      -5.176164     -3.725847      3.612382
  C      -5.420075     -2.536687      2.933846
  C      -6.299959     -2.491481      1.852675
  O      -6.972751     -3.365066      1.296204
  Cl     -6.373433     -0.785211      1.129561
  C      -1.348466     -5.383487      5.849461
  C      -0.209791     -5.930356      6.502615
  C      -0.034772     -5.735501      7.856875
  C      -0.966678     -4.979696      8.607641
  C      -2.098801     -4.470925      8.007728
  C      -2.343172     -4.707447      6.634207
  N      -3.418636     -4.213849      5.931128
  C      -4.533328     -3.743383      6.510638
  C      -5.130011     -4.262501      7.713466
  O      -4.848842     -5.217327      8.398835
  Cl     -6.653232     -3.294571      8.102207
  H      -2.999139     -2.672845     -0.685287
  H      -2.351865     -0.305142     -0.955434
  H      -1.698541      1.065208      1.018291
  H      -1.632686      0.043969      3.285164
  H      -1.880393     -2.381359      5.829266
  H      -6.498269     -7.605382      5.540203
  H      -8.811083     -6.795964      5.828160
  H      -9.457593     -4.497000      5.134861
  H      -7.774837     -2.975416      4.089271
  H      -4.752464     -1.698819      3.114129
  H       0.546728     -6.459149      5.924920
  H       0.855484     -6.132757      8.346852
  H      -0.777230     -4.778623      9.662266
  H      -2.791721     -3.859087      8.580334
  H      -5.134445     -3.046140      5.937730
  N      -6.896033     -6.806066      1.861829
  N      -7.745888     -5.952983      2.023629
  H      -7.579626     -4.918979      1.819669
  H      -8.690457     -6.158301      2.454650
75
Coordinates from ORCA-job orca E -7353.789583146387
  N      -3.006989     -3.967835      1.766617
  C      -3.326497     -4.855155      0.654208
  C      -3.549956     -6.245641      1.215216
  N      -2.786425     -6.394692      2.481245
  C      -3.207456     -7.663264      3.174279
  C      -3.924367     -7.349060      4.491908
  N      -4.520449     -6.045681      4.312109
  Mo     -3.259547     -4.515224      3.706088
  N      -1.571471     -5.423137      4.518117
  C      -0.672893     -6.204488      3.672814
  C      -1.312441     -6.339547      2.296199
  H      -0.503156     -7.197730      4.123810
  H       0.311092     -5.714447      3.582000
  H      -0.958119     -7.243053      1.773632
  H      -1.082980     -5.464889      1.678353
  H      -4.675430     -8.122928      4.703749
  H      -3.214188     -7.331389      5.333482
  H      -3.889868     -8.193648      2.498994
  H      -2.329159     -8.300620      3.336725
  H      -2.500287     -4.830130     -0.076714
  H      -4.238270     -4.517075      0.133667
  H      -3.248430     -7.028160      0.498314
  H      -4.611512     -6.393382      1.466533
  C      -2.642580     -2.682207      1.462844
  C      -2.662415     -2.096345      0.180560
  C      -2.304590     -0.762921      0.035267
  C      -1.933919      0.011470      1.150780
  C      -1.893316     -0.553023      2.416558
  C      -2.217878     -1.911102      2.578823
  N      -2.234700     -2.597691      3.780626
  C      -1.502257     -2.172782      4.832915
  C      -0.169841     -1.645536      4.845331
  O       0.389679     -1.107315      5.774037
  Cl      0.830616     -2.036075      3.328980
  C      -5.804922     -5.759713      4.606110
  C      -6.769929     -6.607382      5.205823
  C      -8.065793     -6.151841      5.363968
  C      -8.440378     -4.849680      4.954969
  C      -7.513337     -3.996572      4.378426
  C      -6.190189     -4.442559      4.190098
  N      -5.176266     -3.728983      3.608089
  C      -5.422122     -2.540556      2.928483
  C      -6.306046     -2.496402      1.850931
  O      -6.981849     -3.368880      1.296682
  Cl     -6.377037     -0.790646      1.123209
  C      -1.348085     -5.384449      5.848571
  C      -0.210446     -5.933411      6.501494
  C      -0.034267     -5.738051      7.855591
  C      -0.964171     -4.979896      8.606266
  C      -2.095865     -4.469586      8.006658
  C      -2.341695     -4.706872      6.633597
  N      -3.416931     -4.211795      5.930862
  C      -4.530284     -3.736628      6.508497
  C      -5.129600     -4.249509      7.713005
  O      -4.852011     -5.203373      8.401203
  Cl     -6.649591     -3.275876      8.097192
  H      -2.993812     -2.669874     -0.683734
  H      -2.346541     -0.301867     -0.952290
  H      -1.696129      1.067928      1.022697
  H      -1.633400      0.046242      3.289449
  H      -1.884953     -2.376484      5.832616
  H      -6.493865     -7.604496      5.545996
  H      -8.807976     -6.799228      5.833173
  H      -9.458492     -4.501897      5.134011
  H      -7.777126     -2.980377      4.084606
  H      -4.752420     -1.703422      3.103727
  H       0.544814     -6.463862      5.923653
  H       0.855500     -6.136728      8.345307
  H      -0.773809     -4.778383      9.660643
  H      -2.787140     -3.856261      8.579522
  H      -5.129337     -3.039975      5.932728
  N      -6.888169     -6.807165      1.851233
  N      -7.742639     -5.959797      2.022815
  H      -7.587636     -4.924514      1.815922
  H      -8.680740     -6.174942      2.462240
75
Coordinates from ORCA-job orca E -7353.789594282665
  N      -3.006251     -3.965784      1.767498
  C      -3.326818     -4.852108      0.654843
  C      -3.550400     -6.243372      1.214161
  N      -2.787654     -6.393818      2.480221
  C      -3.209551     -7.662897      3.172210
  C      -3.921886     -7.349314      4.492478
  N      -4.518746     -6.046120      4.314533
  Mo     -3.259100     -4.514492      3.705696
  N      -1.571281     -5.422654      4.517227
  C      -0.674311     -6.206605      3.672644
  C      -1.313520     -6.339630      2.295784
  H      -0.507628     -7.200342      4.123685
  H       0.311049     -5.719259      3.582324
  H      -0.959661     -7.242826      1.772357
  H      -1.083076     -5.464469      1.679000
  H      -4.671894     -8.123615      4.706565
  H      -3.209058     -7.331655      5.331779
  H      -3.895627     -8.190074      2.498173
  H      -2.332191     -8.302556      3.330583
  H      -2.501110     -4.826671     -0.076621
  H      -4.238789     -4.513083      0.135281
  H      -3.248275     -7.024533      0.496078
  H      -4.612429     -6.391536      1.464707
  C      -2.641802     -2.680004      1.463705
  C      -2.661379     -2.093980      0.181587
  C      -2.302969     -0.760621      0.036611
  C      -1.931908      0.013252      1.152339
  C      -1.891889     -0.551450      2.418054
  C      -2.217464     -1.909333      2.580001
  N      -2.235792     -2.595908      3.781603
  C      -1.503191     -2.171691      4.834244
  C      -0.169560     -1.647811      4.846847
  O       0.391470     -1.111554      5.775832
  Cl      0.829710     -2.039303      3.329970
  C      -5.803562     -5.761160      4.607280
  C      -6.768173     -6.608177      5.208944
  C      -8.064197     -6.152273      5.366804
  C      -8.438821     -4.850812      4.955603
  C      -7.512344     -3.998648      4.377658
  C      -6.189727     -4.444723      4.189320
  N      -5.176311     -3.731780      3.605629
  C      -5.422557     -2.543449      2.925785
  C      -6.308788     -2.499004      1.850115
  O      -6.987138     -3.370616      1.297872
  Cl     -6.378500     -0.793493      1.121104
  C      -1.348810     -5.384462      5.847920
  C      -0.212070     -5.934803      6.501146
  C      -0.035881     -5.739734      7.855309
  C      -0.965178     -4.980864      8.605914
  C      -2.096384     -4.469584      8.006104
  C      -2.342112     -4.706330      6.632952
  N      -3.416943     -4.210013      5.930355
  C      -4.529809     -3.732825      6.506670
  C      -5.130095     -4.241942      7.712489
  O      -4.853510     -5.194346      8.403102
  Cl     -6.650232     -3.267442      8.092414
  H      -2.992800     -2.667365     -0.682794
  H      -2.344589     -0.299331     -0.950844
  H      -1.693417      1.069583      1.024492
  H      -1.631709      0.047303      3.291224
  H      -1.887270     -2.373304      5.833813
  H      -6.491583     -7.604262      5.551822
  H      -8.806083     -6.797776      5.839043
  H      -9.456861     -4.502624      5.134261
  H      -7.776277     -2.982830      4.082683
  H      -4.750762     -1.707578      3.098588
  H       0.542765     -6.465893      5.923333
  H       0.853427     -6.139345      8.345105
  H      -0.774929     -4.779703      9.660375
  H      -2.787307     -3.856020      8.579093
  H      -5.128217     -3.037219      5.928893
  N      -6.888144     -6.813172      1.843660
  N      -7.742032     -5.967180      2.021615
  H      -7.589633     -4.932071      1.812836
  H      -8.675134     -6.181385      2.472420
75
Coordinates from ORCA-job orca E -7353.789603869860
  N      -3.006049     -3.963474      1.767750
  C      -3.325416     -4.849256      0.654331
  C      -3.550053     -6.241188      1.212064
  N      -2.788699     -6.392681      2.478558
  C      -3.211117     -7.662118      3.169748
  C      -3.919511     -7.349543      4.492377
  N      -4.516818     -6.046374      4.317015
  Mo     -3.259259     -4.512797      3.704849
  N      -1.571701     -5.421503      4.516312
  C      -0.675875     -6.207639      3.672583
  C      -1.314354     -6.338945      2.295250
  H      -0.511666     -7.201714      4.123747
  H       0.310541     -5.722334      3.582790
  H      -0.960465     -7.241675      1.771003
  H      -1.082966     -5.463224      1.679631
  H      -4.668872     -8.124115      4.707815
  H      -3.204414     -7.332780      5.329763
  H      -3.900200     -8.186724      2.496791
  H      -2.334275     -8.303286      3.324678
  H      -2.498835     -4.823471     -0.076125
  H      -4.236538     -4.509906      0.133537
  H      -3.247096     -7.021063      0.492992
  H      -4.612722     -6.388767      1.460845
  C      -2.640957     -2.677592      1.463711
  C      -2.660230     -2.091562      0.181744
  C      -2.300577     -0.758432      0.036894
  C      -1.928408      0.014812      1.152661
  C      -1.888965     -0.550021      2.418353
  C      -2.216314     -1.907513      2.580153
  N      -2.236093     -2.594058      3.781569
  C      -1.502707     -2.171324      4.834544
  C      -0.167048     -1.653241      4.847489
  O       0.396234     -1.118781      5.776192
  Cl      0.830635     -2.047646      3.329917
  C      -5.801811     -5.762749      4.609218
  C      -6.765408     -6.609702      5.212771
  C      -8.061958     -6.154823      5.370710
  C      -8.437882     -4.854229      4.957932
  C      -7.512267     -4.001799      4.379073
  C      -6.189653     -4.447121      4.190429
  N      -5.176918     -3.734549      3.604674
  C      -5.423151     -2.545773      2.925488
  C      -6.311611     -2.500118      1.851560
  O      -6.992095     -3.371595      1.301654
  Cl     -6.378842     -0.795742      1.121135
  C      -1.350545     -5.383415      5.847233
  C      -0.214866     -5.935150      6.501179
  C      -0.038808     -5.740096      7.855349
  C      -0.967507     -4.980207      8.605616
  C      -2.098056     -4.468021      8.005299
  C      -2.343579     -4.704460      6.632005
  N      -3.418117     -4.207205      5.929441
  C      -4.531305     -3.729504      6.504079
  C      -5.133140     -4.236538      7.710179
  O      -4.857018     -5.187154      8.403365
  Cl     -6.654222     -3.262084      8.085814
  H      -2.992268     -2.664722     -0.682549
  H      -2.341994     -0.297004     -0.950498
  H      -1.688554      1.070843      1.024888
  H      -1.627881      0.047979      3.291765
  H      -1.888826     -2.369829      5.833934
  H      -6.487757     -7.604522      5.558586
  H      -8.802500     -6.799820      5.845751
  H      -9.456296     -4.506680      5.135700
  H      -7.777114     -2.986405      4.083511
  H      -4.749394     -1.711379      3.097390
  H       0.539547     -6.467063      5.923584
  H       0.849974     -6.140573      8.345405
  H      -0.777454     -4.779135      9.660125
  H      -2.788589     -3.853904      8.578083
  H      -5.129420     -3.035270      5.924186
  N      -6.891251     -6.818866      1.837433
  N      -7.742556     -5.972076      2.022782
  H      -7.591295     -4.936840      1.813296
  H      -8.671501     -6.185230      2.482999
75
Coordinates from ORCA-job orca E -7353.789609637335
  N      -3.006836     -3.961368      1.767397
  C      -3.324107     -4.846957      0.653117
  C      -3.549763     -6.239151      1.209946
  N      -2.789503     -6.391081      2.476923
  C      -3.211577     -7.660906      3.167554
  C      -3.917168     -7.349667      4.491979
  N      -4.515189     -6.046642      4.319080
  Mo     -3.260249     -4.510816      3.703954
  N      -1.572961     -5.420214      4.515645
  C      -0.677393     -6.206878      3.672257
  C      -1.315044     -6.336749      2.294458
  H      -0.514375     -7.201338      4.122993
  H       0.309492     -5.722373      3.583239
  H      -0.960618     -7.238747      1.769297
  H      -1.083454     -5.460241      1.680050
  H      -4.665999     -8.124505      4.708260
  H      -3.200262     -7.333840      5.327870
  H      -3.902463     -8.184183      2.495421
  H      -2.334704     -8.302600      3.320038
  H      -2.496296     -4.820654     -0.075913
  H      -4.234342     -4.507750      0.130702
  H      -3.246040     -7.018541      0.490705
  H      -4.612934     -6.386327      1.457003
  C      -2.640888     -2.675442      1.463279
  C      -2.659587     -2.089403      0.181410
  C      -2.298190     -0.756668      0.036656
  C      -1.924599      0.015900      1.152414
  C      -1.886033     -0.549028      2.418116
  C      -2.215765     -1.905953      2.579803
  N      -2.236874     -2.592517      3.781114
  C      -1.502678     -2.170822      4.834218
  C      -0.165462     -1.657433      4.846912
  O       0.400563     -1.125653      5.775505
  Cl      0.830008     -2.055026      3.328316
  C      -5.800389     -5.764612      4.611292
  C      -6.762634     -6.612175      5.216135
  C      -8.059850     -6.158984      5.373823
  C      -8.437632     -4.859242      4.960064
  C      -7.513266     -4.005861      4.380561
  C      -6.190194     -4.449916      4.191910
  N      -5.178298     -3.736934      3.604940
  C      -5.424763     -2.548138      2.925663
  C      -6.313225     -2.502664      1.851671
  O      -6.993801     -3.375039      1.303115
  Cl     -6.380645     -0.799076      1.121039
  C      -1.353341     -5.383513      5.846824
  C      -0.218850     -5.937275      6.501206
  C      -0.043086     -5.743268      7.855548
  C      -0.971131     -4.982641      8.605840
  C      -2.100706     -4.468730      8.005179
  C      -2.345945     -4.703992      6.631602
  N      -3.419349     -4.204151      5.929125
  C      -4.531015     -3.723053      6.503243
  C      -5.133725     -4.226234      7.710738
  O      -4.860577     -5.176862      8.404943
  Cl     -6.651880     -3.246946      8.085040
  H      -2.992450     -2.662101     -0.682880
  H      -2.339192     -0.295134     -0.950706
  H      -1.682863      1.071498      1.024636
  H      -1.623820      0.048249      3.291692
  H      -1.890227     -2.366592      5.833609
  H      -6.483683     -7.605995      5.563845
  H      -8.799065     -6.804950      5.849634
  H      -9.456666     -4.513034      5.136916
  H      -7.779535     -2.990941      4.084725
  H      -4.751136     -1.713822      3.098221
  H       0.535150     -6.469735      5.923580
  H       0.845038     -6.145103      8.345686
  H      -0.781364     -4.782409      9.660559
  H      -2.790816     -3.854124      8.577955
  H      -5.126876     -3.027145      5.923086
  N      -6.893440     -6.824683      1.832416
  N      -7.741308     -5.975791      2.024292
  H      -7.589262     -4.940707      1.814606
  H      -8.667569     -6.187064      2.491018
75
Coordinates from ORCA-job orca E -7353.789612120517
  N      -3.006699     -3.960420      1.766789
  C      -3.322705     -4.845808      0.651809
  C      -3.549578     -6.237930      1.208218
  N      -2.790187     -6.390461      2.475623
  C      -3.212537     -7.660426      3.165642
  C      -3.916219     -7.350013      4.491256
  N      -4.514365     -6.046903      4.320020
  Mo     -3.261021     -4.509952      3.703243
  N      -1.573913     -5.419678      4.515189
  C      -0.678578     -6.206885      3.672150
  C      -1.315563     -6.336022      2.293977
  H      -0.516382     -7.201569      4.122733
  H       0.308688     -5.723043      3.583637
  H      -0.960882     -7.237690      1.768425
  H      -1.083599     -5.459116      1.680281
  H      -4.665047     -8.124705      4.708028
  H      -3.198084     -7.335157      5.326118
  H      -3.904617     -8.182622      2.493892
  H      -2.335962     -8.302929      3.316605
  H      -2.493974     -4.819396     -0.076131
  H      -4.232207     -4.506360      0.128266
  H      -3.245745     -7.017498      0.489177
  H      -4.613000     -6.384576      1.453947
  C      -2.639924     -2.674538      1.462957
  C      -2.657512     -2.088394      0.181122
  C      -2.295041     -0.755909      0.036689
  C      -1.921404      0.016316      1.152657
  C      -1.884018     -0.548715      2.418346
  C      -2.215005     -1.905386      2.579725
  N      -2.237139     -2.592090      3.780967
  C      -1.502689     -2.171063      4.834261
  C      -0.164571     -1.660202      4.847116
  O       0.402412     -1.129077      5.775473
  Cl      0.830259     -2.060395      3.328566
  C      -5.799571     -5.765391      4.612910
  C      -6.760871     -6.613399      5.218446
  C      -8.058311     -6.161164      5.376376
  C      -8.437310     -4.861717      4.962825
  C      -7.513755     -4.007663      4.382751
  C      -6.190442     -4.451180      4.193395
  N      -5.179305     -3.738095      3.605134
  C      -5.426056     -2.549501      2.925677
  C      -6.314790     -2.503930      1.851837
  O      -6.995808     -3.376598      1.304150
  Cl     -6.382469     -0.800791      1.121323
  C      -1.354821     -5.382804      5.846453
  C      -0.220753     -5.937120      6.501183
  C      -0.044835     -5.742640      7.855413
  C      -0.972371     -4.980987      8.605280
  C      -2.101634     -4.466732      8.004366
  C      -2.347226     -4.702604      6.630929
  N      -3.420610     -4.202765      5.928223
  C      -4.532615     -3.721625      6.501609
  C      -5.136780     -4.225114      7.708334
  O      -4.864544     -5.175751      8.402799
  Cl     -6.653466     -3.243563      8.082886
  H      -2.990363     -2.660633     -0.683460
  H      -2.335212     -0.294291     -0.950673
  H      -1.678601      1.071689      1.025022
  H      -1.621793      0.048244      3.292133
  H      -1.891087     -2.365470      5.833603
  H      -6.481233     -7.606945      5.566334
  H      -8.796772     -6.808419      5.851606
  H      -9.456567     -4.516301      5.139957
  H      -7.780998     -2.993001      4.086925
  H      -4.752683     -1.714916      3.098378
  H       0.532929     -6.470255      5.923769
  H       0.843078     -6.144762      8.345693
  H      -0.782455     -4.780266      9.659877
  H      -2.791229     -3.851292      8.576795
  H      -5.127943     -3.025609      5.920986
  N      -6.895395     -6.826902      1.831025
  N      -7.740496     -5.976183      2.028032
  H      -7.587486     -4.941176      1.818745
  H      -8.665218     -6.186235      2.498292
75
Coordinates from ORCA-job orca E -7353.789613623613
  N      -3.006182     -3.960024      1.766144
  C      -3.321726     -4.845355      0.650855
  C      -3.549380     -6.237282      1.207217
  N      -2.790599     -6.390158      2.474975
  C      -3.213445     -7.660071      3.164625
  C      -3.915633     -7.349853      4.491078
  N      -4.513751     -6.046648      4.320566
  Mo     -3.261290     -4.509462      3.702868
  N      -1.574225     -5.419339      4.514977
  C      -0.679236     -6.207129      3.672184
  C      -1.315844     -6.335890      2.293824
  H      -0.517775     -7.201980      4.122725
  H       0.308417     -5.724003      3.583982
  H      -0.961174     -7.237501      1.768181
  H      -1.083507     -5.458840      1.680473
  H      -4.664538     -8.124309      4.708404
  H      -3.196631     -7.335464      5.325182
  H      -3.906509     -8.181373      2.493195
  H      -2.337382     -8.303575      3.314534
  H      -2.492496     -4.819059     -0.076498
  H      -4.230801     -4.505609      0.126757
  H      -3.245612     -7.017241      0.488512
  H      -4.612906     -6.383758      1.451959
  C      -2.639239     -2.674154      1.462596
  C      -2.656097     -2.087944      0.180741
  C      -2.293632     -0.755449      0.036552
  C      -1.920730      0.016835      1.152704
  C      -1.883952     -0.548243      2.418387
  C      -2.214832     -1.904972      2.579524
  N      -2.237151     -2.591801      3.780768
  C      -1.502705     -2.170679      4.834006
  C      -0.164441     -1.660058      4.846757
  O       0.402424     -1.128135      5.774685
  Cl      0.830493     -2.061663      3.328570
  C      -5.798951     -5.765136      4.613992
  C      -6.759720     -6.613451      5.219742
  C      -8.057279     -6.161837      5.377637
  C      -8.437082     -4.862571      4.964236
  C      -7.513939     -4.008143      4.383733
  C      -6.190383     -4.451275      4.194066
  N      -5.179719     -3.738062      3.605104
  C      -5.426962     -2.550025      2.925032
  C      -6.316172     -2.504983      1.851525
  O      -6.997284     -3.378018      1.304421
  Cl     -6.383808     -0.802602      1.119677
  C      -1.355469     -5.382631      5.846328
  C      -0.221957     -5.937712      6.501415
  C      -0.046591     -5.743733      7.855796
  C      -0.974239     -4.981992      8.605456
  C      -2.102958     -4.467007      8.004172
  C      -2.347847     -4.702090      6.630516
  N      -3.420728     -4.201718      5.927489
  C      -4.532521     -3.720301      6.501121
  C      -5.135840     -4.223538      7.708334
  O      -4.863273     -5.174255      8.402512
  Cl     -6.652699     -3.242255      8.083306
  H      -2.988423     -2.659999     -0.684155
  H      -2.333241     -0.293828     -0.950836
  H      -1.677960      1.072228      1.025193
  H      -1.622288      0.048797      3.292282
  H      -1.891087     -2.364773      5.833405
  H      -6.479683     -7.607000      5.567229
  H      -8.795463     -6.810067      5.851988
  H      -9.456386     -4.517620      5.141973
  H      -7.781808     -2.993724      4.087627
  H      -4.753910     -1.714942      3.096959
  H       0.531675     -6.471155      5.924221
  H       0.840849     -6.146497      8.346395
  H      -0.784837     -4.781816      9.660250
  H      -2.792749     -3.851617      8.576507
  H      -5.127994     -3.024154      5.920785
  N      -6.895429     -6.828169      1.830541
  N      -7.739240     -5.976640      2.030477
  H      -7.586061     -4.941584      1.821291
  H      -8.663135     -6.186386      2.502359
75
Coordinates from ORCA-job orca E -7353.789614473077
  N      -3.005927     -3.959944      1.765864
  C      -3.321426     -4.845184      0.650494
  C      -3.549326     -6.236965      1.206885
  N      -2.790888     -6.390059      2.474828
  C      -3.214103     -7.659978      3.164154
  C      -3.915582     -7.349834      4.491017
  N      -4.513636     -6.046555      4.320715
  Mo     -3.261449     -4.509469      3.702817
  N      -1.574524     -5.419496      4.515123
  C      -0.679707     -6.207496      3.672375
  C      -1.316082     -6.335945      2.293926
  H      -0.518704     -7.202504      4.122770
  H       0.308186     -5.724809      3.584448
  H      -0.961480     -7.237557      1.768248
  H      -1.083521     -5.458804      1.680786
  H      -4.664543     -8.124158      4.708603
  H      -3.196227     -7.335616      5.324798
  H      -3.907687     -8.180728      2.492844
  H      -2.338434     -8.304191      3.313495
  H      -2.492078     -4.818937     -0.076726
  H      -4.230420     -4.505201      0.126412
  H      -3.245620     -7.017233      0.488454
  H      -4.612955     -6.383618      1.451140
  C      -2.639102     -2.674042      1.462693
  C      -2.655685     -2.087584      0.180910
  C      -2.293439     -0.755007      0.037033
  C      -1.920982      0.017189      1.153380
  C      -1.884344     -0.548138      2.418966
  C      -2.214961     -1.904948      2.579778
  N      -2.237095     -2.592039      3.780954
  C      -1.502601     -2.170691      4.834009
  C      -0.164647     -1.659072      4.846264
  O       0.402265     -1.127085      5.774096
  Cl      0.829982     -2.060405      3.327855
  C      -5.798850     -5.764885      4.614456
  C      -6.759544     -6.613274      5.220210
  C      -8.057083     -6.161611      5.377923
  C      -8.436867     -4.862343      4.964477
  C      -7.513793     -4.007989      4.383846
  C      -6.190260     -4.451115      4.194185
  N      -5.179731     -3.737806      3.605250
  C      -5.427128     -2.550261      2.924441
  C      -6.316280     -2.506013      1.850868
  O      -6.997233     -3.379265      1.303930
  Cl     -6.384934     -0.803838      1.118446
  C      -1.355767     -5.383043      5.846479
  C      -0.222455     -5.938546      6.501533
  C      -0.047018     -5.744516      7.855902
  C      -0.974283     -4.982181      8.605428
  C      -2.102787     -4.466749      8.004132
  C      -2.347936     -4.702124      6.630599
  N      -3.420564     -4.201474      5.927376
  C      -4.532089     -3.719448      6.501187
  C      -5.136037     -4.223228      7.707871
  O      -4.864547     -5.174980      8.401048
  Cl     -6.651525     -3.240273      8.084082
  H      -2.987640     -2.659430     -0.684269
  H      -2.332817     -0.293228     -0.950294
  H      -1.678447      1.072662      1.026100
  H      -1.622972      0.048888      3.292964
  H      -1.890330     -2.365337      5.833555
  H      -6.479446     -7.606954      5.567235
  H      -8.795515     -6.809966      5.851727
  H      -9.456069     -4.517352      5.142686
  H      -7.781743     -2.993658      4.087502
  H      -4.754471     -1.714704      3.095705
  H       0.530986     -6.472327      5.924397
  H       0.840246     -6.147605      8.346542
  H      -0.784718     -4.781857      9.660164
  H      -2.792176     -3.850815      8.576362
  H      -5.126888     -3.022353      5.921356
  N      -6.894777     -6.829543      1.829879
  N      -7.738108     -5.977871      2.031198
  H      -7.585018     -4.942964      1.821556
  H      -8.661319     -6.186990      2.504666
