Mg Ni  H  C  N  O                       
   1.00000000000000     
    19.0886999999999993    0.0000000000000000    0.0000000000000000
    -0.0001328190000000   19.0248999999999988    0.0000000000000000
    -0.0000678840000000    0.0004073010000000   19.4471999959999984
   Mg   Ni   H    C    N    O 
    11     1    72   120    48     1
Direct
  0.0000130195341583  0.1374045773566834  0.0040663951631217
  0.9999986821302969  0.8625941977051852  0.0040463408622387
  0.4999918915621961  0.4999956443055424  0.8663535112234868
  0.3634854052940995  0.0000014121701781  0.4987309228061036
  0.6364987587934223  0.0000061427135734  0.4987355507216975
  0.3754633061597943  0.5000105120984841  0.0000205685137260
  0.6245211255648471  0.4999894869988069  0.0000215969394119
  0.0000084966228258  0.9999991472664504  0.1380383808749954
  0.9999938252185103  0.9999996913352334  0.8737329797346121
  0.5000001125112092  0.1359925933776864  0.5021108438237079
  0.4999899857265220  0.8640153432713191  0.5020753631375356
  0.5000008422787374  0.5000022071679240  0.1424225595751381
  0.7632511756170572  0.1108458935096692  0.2650633510767761
  0.2302387469130878  0.8924425880291338  0.7341180222827148
  0.2367251875745282  0.8891443342167236  0.2650520383942236
  0.7697770997430808  0.1075774899745099  0.7341277923267384
  0.2302626225258493  0.1075816955624944  0.7341010532588967
  0.7633063584089257  0.8891264635061873  0.2650237566878602
  0.2367260587764193  0.1108695470302763  0.2650489531171658
  0.7697191722546748  0.8924142044935408  0.7341031101102686
  0.5994244347487125  0.2657366148833233  0.2638724341321890
  0.3886166558668336  0.7315824239494404  0.7305226460838625
  0.7580554439866845  0.2687917667094695  0.1068436587491988
  0.2327464758090940  0.7322239594179791  0.8897460818811425
  0.4005644930885168  0.7342689062570642  0.2638966021358158
  0.6114007367958791  0.2684388594959231  0.7305211034453336
  0.2419893947389440  0.2688296116290871  0.1068539430060582
  0.7672490874681657  0.7322339457464082  0.8897733351618271
  0.3886417225234808  0.2684446402914134  0.7305725247296451
  0.5994863682426441  0.7342226496991131  0.2639613929540445
  0.2419622273991990  0.7312020817226568  0.1068385166207690
  0.7672453319060679  0.2677789421508265  0.8897681930333974
  0.4005779970067280  0.2657371393103176  0.2639284833320872
  0.6113201403502444  0.7315698070313630  0.7306100622671892
  0.2327406247920223  0.2677610709338865  0.8897635651178106
  0.7580288005500009  0.7311610827111252  0.1068436587491988
  0.5624927725965350  0.3781216511805283  0.2293106463098695
  0.4437765954218733  0.6394446121947936  0.7861445351076028
  0.4375184356532813  0.6218695815134367  0.2293111605227125
  0.5562076649746217  0.3605390721941220  0.7861640751956429
  0.4375272173144538  0.3781484577362164  0.2293301863979025
  0.5560765441018916  0.6395528863027664  0.7863800445897340
  0.5624813718223720  0.6218559147505900  0.2293327574621173
  0.4439339115078340  0.3604323647619125  0.7864052410190467
  0.7118851283382810  0.0562659958455711  0.3561386729927492
  0.2769805138024708  0.9399929299235552  0.6346841706023838
  0.8563596493813179  0.2155436893272125  0.0561376445053554
  0.1378227361512927  0.7763072327051788  0.9391789051255017
  0.7231352090385528  0.0601302257503207  0.6345874985878837
  0.2879614387289706  0.9436483195618024  0.3562111770036225
  0.1379723839762690  0.2234507092163511  0.9393599080462707
  0.8564537123805778  0.7842410260083739  0.0562343165198556
  0.2875581738729380  0.0566192116679503  0.3563947509886063
  0.7225530282543673  0.9402935832719521  0.6349299643413815
  0.1436346109580242  0.7844339332866426  0.0561319881640827
  0.8621830438670699  0.2237119493510917  0.9391943315107980
  0.2772619948708339  0.0598390235698716  0.6348142664516843
  0.7126561516219496  0.9432320163088050  0.3565248468379068
  0.1435442161944707  0.2157807442265920  0.0562708256317137
  0.8620402072718960  0.7765269410458018  0.9393527090664691
  0.8573461149374069  0.0602374414309566  0.2177763380266100
  0.1376740810093651  0.9451065598264066  0.7910856063168126
  0.1426833467241764  0.9397763624466080  0.2177310872964213
  0.8623107385801134  0.0548879505356012  0.7911344565369092
  0.1375322048422234  0.0550745549582601  0.7908141019356663
  0.8572464128862336  0.9398646711414429  0.2175737381664362
  0.1427814757879915  0.0601281150673074  0.2175876219131965
  0.8624400398615109  0.9449283778416131  0.7908264430438976
  0.5577511424341139  0.2216989987142526  0.3651337982568492
  0.4426822152418026  0.7860213920105465  0.6423238308121100
  0.6866601368502288  0.3485306952135190  0.0451180632780250
  0.2777055555389794  0.6358413702883254  0.9366890865392818
  0.5572664466578345  0.2139080019502799  0.6424086759312218
  0.4422908929834151  0.7783957498967737  0.3650808343340088
  0.3133890391216596  0.3485038881294145  0.0451232054064619
  0.7224293964622817  0.6357415025895534  0.9366227530825242
  0.4425294576692238  0.2142896110179251  0.6422261303719239
  0.5573317312120665  0.7788903702099930  0.3648304126794244
  0.3133314260796496  0.6514815645220224  0.0451340038761643
  0.7223023022427739  0.3641868544635329  0.9366844586236951
  0.4425887649279190  0.2212327718995013  0.3649337694608832
  0.5575313106928874  0.7855725104004776  0.6421464273812489
  0.6866585776483731  0.6514621160940095  0.0451448023458667
  0.2775323599678927  0.3642551879144733  0.9365934429504676
  0.6750836282046819  0.2747670602210377  0.1820668271385202
  0.3139847884843192  0.7243674694413258  0.8134785472075095
  0.3249209576607726  0.7252319770967048  0.1820740261183289
  0.6860180019307549  0.2756423773568315  0.8134893456772190
  0.3249466363030677  0.2747765210546262  0.1820879098650892
  0.6859849772439688  0.7243643145457810  0.8135315111303498
  0.3139979063250991  0.2756365948990336  0.8135155705322106
  0.6750909534106455  0.7252035927244549  0.1820981941219486
  0.6784533819654825  0.1851084148856046  0.2723235222083034
  0.3129609421426807  0.8156455373667484  0.7248107698228665
  0.7677655864900501  0.1853405797692602  0.1816935086144440
  0.2236634032666132  0.8151915649703341  0.8151111729843095
  0.3215240806971309  0.8148872835432286  0.2723276359110471
  0.6870564098961296  0.1843733624030932  0.7248143693127673
  0.2236768286865356  0.1848119045644125  0.8151142582613673
  0.7677862048978739  0.8146127443634938  0.1816832243575774
  0.3215312239946186  0.1851220807677478  0.2723430622963363
  0.6869816978631107  0.8156266140922952  0.7248436794448239
  0.2322332340390005  0.8146521664061268  0.1816821959318915
  0.7763409704106579  0.1848203142762230  0.8151291704338135
  0.3129853627151036  0.1843796696621780  0.7248267104209987
  0.6785174850549964  0.8148578479060831  0.2723523181275169
  0.2322409046061011  0.1853763223462437  0.1816960796786589
  0.7763034468818617  0.8151894621983615  0.8151235140925408
  0.7386033210618947  0.1566589866932162  0.2416985479126481
  0.2533244033680191  0.8449722280295262  0.7558512280957359
  0.2613786385466383  0.8433322413386435  0.2416928915713683
  0.7466900262427529  0.1550458681438585  0.7558615123525954
  0.2533447486281020  0.1550453427481031  0.7558507138828929
  0.7386526276507297  0.8433007037221500  0.2416928915713683
  0.2613827666995974  0.1566868448440530  0.2417021474025489
  0.7466298667274529  0.8449559334071921  0.7558599697140664
  0.6471702533889427  0.2440302748857661  0.2416476408411796
  0.3423424047790533  0.7549554985431328  0.7540756511485611
  0.7355798408115604  0.2449446649650611  0.1528194290494937
  0.2545536101340886  0.7549415050478174  0.8430144187015145
  0.3528211356444473  0.7559698906095207  0.2416594677365680
  0.6576688689369234  0.2450589943888417  0.7540802790641479
  0.2644477052721257  0.2449714716968856  0.1528307417320391
  0.7454267446203957  0.7549430812791300  0.8430447572592570
  0.3423634789759973  0.2450631987438499  0.7541111318347333
  0.6472104863298895  0.7559388778163409  0.2416970052741192
  0.2644276801979260  0.7550519455008882  0.1528158295595929
  0.7454467710185497  0.2450676025988159  0.8430308735124896
  0.3528406239601551  0.2440350048677189  0.2416784936117651
  0.6576074570132491  0.7549444591003507  0.7541352998383601
  0.2545589682121090  0.2450555131241146  0.8430334445767045
  0.7355802466784240  0.7550146257568571  0.1528266280292954
  0.6408338398626796  0.3362560882694510  0.1511076144948618
  0.3462721701177216  0.6634907571264606  0.8462899545119669
  0.3591715735664707  0.6637458515306420  0.1511148134746634
  0.6537245671889167  0.3365145310348723  0.8462992103431475
  0.3592033464860762  0.3362571392260989  0.1511214982416220
  0.6537137457285880  0.6634886531545376  0.8463583448200964
  0.6408293081777074  0.6637253516395774  0.1511353819883894
  0.3462714667878188  0.3365066455518928  0.8463496032017659
  0.6484314303191709  0.1532861614667738  0.3341673866333821
  0.3449861825073128  0.8481589632313700  0.6642272410761905
  0.8301948572278022  0.1530419889077237  0.1509086141245888
  0.1632913766952626  0.8465986183844336  0.8493598051851876
  0.6550391205690289  0.1518651588511730  0.6642246700119756
  0.3515260413423036  0.8467189783381457  0.3341730429746548
  0.1633022693669446  0.1533860394767785  0.8493412935228406
  0.8301991611406478  0.8469084489305914  0.1508710765870376
  0.3515002615605738  0.1532651358496864  0.3341925830626948
  0.6549219034231442  0.8481106048371814  0.6642606649109908
  0.1698126501093356  0.8469520756254738  0.1508870171851768
  0.8367064302764291  0.1534102173253089  0.8493875726787152
  0.3450316294563933  0.1518882860182700  0.6642442101000157
  0.6485562216146192  0.8467205546024843  0.3342018388938683
  0.1698188235207212  0.1530908725655635  0.1508921593136066
  0.8366850598873654  0.8466080799556082  0.8493464356512703
  0.5882465849364849  0.3793921034094794  0.1796505409888596
  0.4083824330086046  0.6287046203749469  0.8285465261484504
  0.4117585075920971  0.6206059862022073  0.1796536262659174
  0.5916047483605027  0.3712872354812404  0.8285609241080607
  0.4117772603044898  0.3794052437197308  0.1796675100126848
  0.5915457714021315  0.6287550771266197  0.8287069605554933
  0.5882383097549564  0.6205923194723866  0.1796736805668004
  0.4084492691217534  0.3712330925486071  0.8287177590252028
  0.6694582266887181  0.0919936399859296  0.3687656835675597
  0.3226282034258645  0.9069758507650718  0.6264084291057657
  0.8673350819643986  0.1728620219752699  0.0916229585938595
  0.1279144708379789  0.8228847465264195  0.9083842405916300
  0.6774376926936512  0.0930924673160760  0.6263636925884200
  0.3304439606533762  0.9079726982489760  0.3688011642537319
  0.1279885573240378  0.1769691292334699  0.9084516024740736
  0.8673825908645085  0.8269979171023678  0.0916445555332714
  0.3302020189642931  0.0921329282521626  0.3688998931196039
  0.6770661705899954  0.9070836012937207  0.6265482949990826
  0.1326672888416809  0.8271240683499599  0.0916080464214062
  0.8720874230574864  0.1771299720353383  0.9084068659567279
  0.3228148002302760  0.0929747242721106  0.6264855610322257
  0.6699280526726596  0.9077945072480560  0.3689631412993037
  0.1326265907343611  0.1730128758286398  0.0916733514524779
  0.8720122889957054  0.8230140493999656  0.9084474887713299
  0.8677890194490843  0.0938017660600181  0.1737802871721925
  0.1277005373344267  0.9087706496464421  0.8329651571090864
  0.1322291279840115  0.9062007806884367  0.1737473775502352
  0.8722908665828513  0.0912315290246539  0.8330042372851594
  0.1276366992091269  0.0912982879396225  0.8328036942763575
  0.8677407131473203  0.9062176028091926  0.1736512197485780
  0.1322811005740334  0.0937765383887381  0.1736671603467173
  0.8723457976210724  0.9086991676850005  0.8328108932561662
  0.5908416349409364  0.1760386644562431  0.3732192810015249
  0.4069241402259607  0.8286189849498768  0.6301806945226431
  0.6520210615938922  0.3659506752093549  0.0859295939952105
  0.3240846561377069  0.6272538208543850  0.9054326588723143
  0.5930621541097381  0.1713561338595753  0.6302192604858732
  0.4091575004675292  0.8240194691548126  0.3731915135079973
  0.3480176459221553  0.3659412137592781  0.0859373071878622
  0.6759881379861881  0.6272038861077931  0.9054414004906519
  0.4068902316569947  0.1715742706475822  0.6301441854107850
  0.5907172729968480  0.8243006819243917  0.3730814719595799
  0.3479749824903493  0.6340535296801093  0.0859393640392341
  0.6759140734569371  0.3727583963708625  0.9054357441493792
  0.4092687649851285  0.1757621865784955  0.3731308363925123
  0.5931138733968027  0.8283498654309795  0.6301117900016706
  0.6520140212476946  0.6340403887313499  0.0859522193603084
  0.3239828263756692  0.3727925623422337  0.9054254598925127
  0.5714881705456776  0.4300367022218197  0.1344064955642779
  0.4217367234413558  0.5761252026727846  0.8731421491779088
  0.4285097898761734  0.5699627990518223  0.1344075239899638
  0.5782465841388102  0.4238657950003883  0.8731544902861401
  0.4285302950408010  0.4300451120217019  0.1344172940339803
  0.5782334998617813  0.5761625186848676  0.8733056688620096
  0.5714765712886916  0.5699580681011085  0.1344219219495670
  0.4217524282137859  0.4238247925541501  0.8733200668216128
  0.6282920981878632  0.0798105301645933  0.4238749023867427
  0.3669658608910780  0.9204924168992719  0.5740661895952286
  0.9226470507652209  0.1299600533814527  0.0809730964007116
  0.0754749123023686  0.8670470390857474  0.9250802173937771
  0.6330860422365987  0.0795544887572461  0.5740394505273869
  0.3716167676799031  0.9201797300439480  0.4238975277518406
  0.0755117130557750  0.1328103285241085  0.9250673620727028
  0.9226710585826439  0.8699134834178963  0.0809458431200270
  0.3713762268068308  0.0798115795800243  0.4239607759315405
  0.6327298996102684  0.9204861072512927  0.5741654326739436
  0.0773610068796486  0.8700317493696588  0.0809509852484567
  0.9245250048738143  0.1329664388450524  0.9251084991001477
  0.3671637952132869  0.0795345130729999  0.5741263524978635
  0.6287259476465863  0.9201592285896396  0.4239911144892829
  0.0773417139812835  0.1300951395714804  0.0809700111236538
  0.9244908230304176  0.8671721387712026  0.9250581062415293
  0.9228957272772931  0.0804270234350568  0.1323882101551632
  0.0754174928977207  0.9207297996331931  0.8780605950220206
  0.0771226496215007  0.9195757187781339  0.1323537578946770
  0.9245747556514203  0.0792746531385617  0.8781012178366225
  0.0753712994359432  0.0792704525705474  0.8778934758480190
  0.9228627990648945  0.9195525931632602  0.1322617137957707
  0.0771566248208018  0.0804448970959228  0.1322786828195888
  0.9246198999502582  0.9207219188399236  0.8778919332094901
  0.5791152120702847  0.1324273054038017  0.4266069152220595
  0.4197559229981351  0.8715323189098783  0.5764433955688091
  0.6103030241376999  0.4228273965254417  0.0762675346736330
  0.3692220501657388  0.5753336311989230  0.9211855693202509
  0.5802420381924804  0.1284561392468078  0.5764691062109648
  0.4208586333964348  0.8676222345293709  0.4265894319853913
  0.3897269765356981  0.4228258195345305  0.0762726768020627
  0.6308438474095013  0.5753110279634299  0.9212452180100499
  0.4198057604375052  0.1286590319177705  0.5764377392275364
  0.5791564762428649  0.8679023950983193  0.4265236127414767
  0.3896871886127542  0.5771735427924440  0.0762721625892198
  0.6307678856173595  0.4246689758322759  0.9211901972358376
  0.4208493249569898  0.1321539803519656  0.4265621787047138
  0.5801686259877386  0.8712716085193293  0.5764166565009674
  0.6102925729427682  0.5771667094000108  0.0762834752717652
  0.3691267055129259  0.4246821153719154  0.9212431611586780
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