Na Mg Mn  H  C  N Cl  O                 
   1.00000000000000     
    18.9087999999999994    0.0000000000000000    0.0000000000000000
     0.0095363400000000   18.9062975950000016    0.0000000000000000
    -0.0239261230000000    0.0062493640000000   18.9084838300000015
   Na   Mg   Mn   H    C    N    Cl   O 
     3    11     1    24    72    96     3     1
Direct
  0.9795769110065677  0.9754924564393832  0.3647278154083509
  0.3621794676087120  0.9907485334426980  0.9766409705838370
  0.9785659032527647  0.3641806440172104  0.9796782315570809
  0.8635065156757520  0.0000240469547919  0.5033089953463517
  0.1382614583135364  0.0008238412549773  0.5047252908167223
  0.5030942396378961  0.1387771052063940  0.0030002405539236
  0.0009134002815046  0.5029995170115882  0.8659187139067370
  0.0019928344212090  0.5033584365059056  0.1401106521188495
  0.9999050766670621  0.8638262757993331  0.5045888441283850
  0.0017011435752607  0.1373638011947236  0.5039066106867196
  0.8648132475883941  0.5019008966413452  0.0019657842656358
  0.1385216068558890  0.5028385788287864  0.0038702204078334
  0.5027834020410467  0.0017311275117393  0.1361399477157335
  0.5022877916243473  0.0009048666095808  0.8692600711815004
  0.5025730156135282  0.8557158628337476  0.0017986635155793
  0.8864485764121355  0.7278279531285605  0.2733270444349500
  0.1039290735461975  0.2661067941163324  0.7385965012087397
  0.1045342095931048  0.2652918513941600  0.2677565290542887
  0.8919183655438800  0.7345364855758447  0.7352123060202018
  0.1135275468787711  0.7280111975021413  0.7302579161895721
  0.9018850944286854  0.2628344477657549  0.2646208995383006
  0.8890106544727985  0.2721542896798539  0.7280752980393785
  0.1047659089931301  0.7404767752412127  0.2649429771863439
  0.2734422039217179  0.8906190809170980  0.7329725706516399
  0.7381160881500790  0.1038694211572206  0.2662371052729711
  0.2653166106728975  0.1032600530028844  0.2663804271820354
  0.7301291683658135  0.8955262413518099  0.7383754364191120
  0.7272083298343546  0.1114856030667539  0.7280758269025114
  0.2647727738569756  0.9033644685793476  0.2612298291290358
  0.7271512038794583  0.8915692409973133  0.2682838055979673
  0.2660982384759265  0.1057810525253728  0.7379856642900364
  0.7282848275375500  0.2720266889000484  0.8900851147725248
  0.2651678986971220  0.7384558007778139  0.1031896590727328
  0.2654248396253109  0.2658583154625305  0.1061819666796637
  0.7327000242005965  0.7324716011413841  0.8983200426176126
  0.7274873857580459  0.7275620804468872  0.1095772679939913
  0.2640950638387807  0.2651019491250466  0.9014768266589215
  0.2744577045945391  0.7265100413551835  0.8920831596892782
  0.7382719623577501  0.2653186080414613  0.1052009255678144
  0.8397537068442062  0.7514518880303243  0.2491416044963799
  0.1510514539217809  0.2427401074888138  0.7622038937428641
  0.1512613402507839  0.2415822615318461  0.2438439824923790
  0.8448844392116470  0.7575277684594468  0.7592089418202690
  0.1607395698729235  0.7511877479321925  0.7538187687679851
  0.8541194395108036  0.2401374098280584  0.2417311742757562
  0.8416680250147337  0.2491426023271259  0.7514071528811712
  0.1513264839857271  0.7641864046183144  0.2407310940911103
  0.2506171618643194  0.8427672520107947  0.7555217080564844
  0.7620186447093289  0.1506537066201048  0.2426149045711199
  0.2417298513850454  0.1504171253763076  0.2430750154968919
  0.7539124543225313  0.8481260880902823  0.7610023167045199
  0.7505528059989572  0.1587447021139781  0.7513436893052017
  0.2414013342147427  0.8557555182516623  0.2386648258301918
  0.7501828714298213  0.8435538944867176  0.2462704065469197
  0.2423291925199464  0.1525089075808808  0.7618707099690312
  0.7512572761665268  0.2490580001248759  0.8425387325198344
  0.2415682037991260  0.7629751215115164  0.1496624491652838
  0.2417779944442771  0.2418672645053519  0.1528985626765618
  0.7553816230165680  0.7563893022395476  0.8510872762028328
  0.7503786836642306  0.7512020458170738  0.1569068163621239
  0.2412124778831384  0.2421978314176840  0.8538024595280334
  0.2511535969994867  0.7504255514119791  0.8450783332848530
  0.7621024825533453  0.2415153003832486  0.1519926201296045
  0.8427719110310150  0.8453200332147475  0.3404968932403278
  0.1513027395363409  0.1518308073696630  0.6675194115762153
  0.1501503160294959  0.1492144819990813  0.3370899569370707
  0.8462531276538883  0.8498943228480158  0.6664690893939351
  0.1576334064358136  0.8443850511327682  0.6616574926092298
  0.8562175898671214  0.1469004469205615  0.3338633629621910
  0.8431967023999860  0.1567840242516851  0.6583996957094982
  0.1486448608005233  0.8571869090895916  0.3327062104270269
  0.3424048447843688  0.8442935805337157  0.8503759552888468
  0.6667960051220874  0.1513568562049628  0.1523728727222888
  0.3353029908132186  0.1497752607613876  0.1511110052867721
  0.6618552955159842  0.8479420364671739  0.8553694809913281
  0.6584491227645159  0.1565065753190353  0.8449038084509368
  0.3350052007958197  0.8545702533603503  0.1456906870359020
  0.6587796326639648  0.8449361604824688  0.1512955785202195
  0.3339326787815367  0.1497607974296074  0.8557343965531459
  0.8447552421814990  0.3410238630885729  0.8451031898521109
  0.1506383718840567  0.6684897195128059  0.1511231691388346
  0.1504059642416706  0.3360470953990813  0.1525928797856437
  0.8486136725527160  0.6642045770827565  0.8513829106942197
  0.8425818561931848  0.6575853635324052  0.1576837163046108
  0.1477135457297791  0.3337716328217013  0.8567561601262454
  0.1585497051946732  0.6575451703702058  0.8457383544749320
  0.8565323765810291  0.3325431617776786  0.1488183836048975
  0.8099155750331235  0.8128536074537820  0.2780757065068187
  0.1820528961506440  0.1829522675865434  0.7312717468156720
  0.1814178937780397  0.1807286509502930  0.2736824404603766
  0.8141380377300536  0.8181887836468391  0.7295730384322425
  0.1904966196532172  0.8123051969852071  0.7242669546181162
  0.8234601133595945  0.1798517242569204  0.2719921938870726
  0.8110106609317285  0.1889055443520959  0.7209631466258060
  0.1811242083111821  0.8255473680274932  0.2697524585185107
  0.2808344379219463  0.8118152365199762  0.8160104289017411
  0.7311225824685792  0.1816536411246545  0.1827708678850755
  0.2719720750286214  0.1810617853347836  0.1827391360970907
  0.7245287774011615  0.8171226700973406  0.8217840277255064
  0.7206533847843914  0.1887780896677924  0.8121238137367897
  0.2715983891822304  0.8243107612355089  0.1784881342334472
  0.7204444458576944  0.8126752607471701  0.1855664384065037
  0.2717922549332172  0.1821528740009626  0.8230527703817501
  0.8117394645176077  0.2791987442889123  0.8121550166616416
  0.1815376076389654  0.7328319985574296  0.1808421040387529
  0.1814755411069342  0.2721888422630059  0.1834980546930538
  0.8156660666656492  0.7267475864091182  0.8199002172454968
  0.8100619899072328  0.7206446054022493  0.1885999973378105
  0.1805950843371420  0.2722206102567313  0.8234647547624121
  0.1909195183326062  0.7202754769324002  0.8140800784660271
  0.8235525548094529  0.2706667417408681  0.1814635182201201
  0.8640472870876224  0.9162974474756425  0.4252868750503112
  0.1339190973612006  0.0832479834096276  0.5806753253573760
  0.1328004005036902  0.0811584719651606  0.4246474795224202
  0.8666998004018041  0.9189643173947530  0.5804008453913170
  0.1362805987940519  0.9152390974559594  0.5772192047827431
  0.8808818444640565  0.0732980291741185  0.4153458347379271
  0.8627006936060724  0.0877815301310676  0.5722611129101836
  0.1319661310827129  0.9225967909468125  0.4225246229062662
  0.4265006029999014  0.8632534306294986  0.9222923507135548
  0.5788838897503581  0.1346069418134874  0.0849846034429476
  0.4224138293453805  0.1320434839412670  0.0826639520150252
  0.5764388493050348  0.8645678313182472  0.9254205761456831
  0.5750804257853659  0.1363677405514920  0.9170396820758739
  0.4216367506898564  0.8707057723023226  0.0764159629608940
  0.5746287291347372  0.8642246371976441  0.0802994049470556
  0.4211949383445983  0.1327220878508300  0.9243676096477387
  0.9170524698328535  0.4244946863406298  0.8668294162218899
  0.0831101014867244  0.5805210729940384  0.1353471818792542
  0.0830204029497779  0.4241932251860163  0.1354772822099903
  0.9193786634076204  0.5792562797812906  0.8702310638938187
  0.9147603285352375  0.5738475302438886  0.1388651794404581
  0.0743266718532993  0.4150975101119059  0.8821606295865578
  0.0887950878073624  0.5719081271131472  0.8648482949254017
  0.9246581976584807  0.4201903381763685  0.1322406398355866
  0.9164885078109393  0.8677527223709731  0.5806658058209848
  0.0822756992967015  0.1314978028354332  0.4245882468515205
  0.0832757108505149  0.1335085729126462  0.5804093072014425
  0.9157461548924459  0.8664525905988043  0.4239583708600279
  0.9241981887844446  0.1297808570244570  0.4215620920040735
  0.0874855121193576  0.8630791688621358  0.5758002649967082
  0.0759710169397039  0.8784897654102224  0.4162121125499070
  0.9151209120145793  0.1361740321772231  0.5749741807828457
  0.8816448690748118  0.4139857980849229  0.0754158827762552
  0.1376428086644381  0.5735797447987281  0.9169973730252252
  0.1304521521980391  0.4201955296974660  0.9262170440240922
  0.8630489012261293  0.5709626623892561  0.0896073960891428
  0.1333461996291518  0.5799919493687682  0.0847450284436704
  0.8666624338447804  0.4240393460360039  0.9178424963118772
  0.8692267639355791  0.5786735839246546  0.9208956231791134
  0.1331532379386786  0.4238672174028935  0.0848481567546173
  0.4237368533217278  0.9211096683474338  0.1274517841656078
  0.5732418788184575  0.0867530930692624  0.8657209190949686
  0.4160641058178172  0.0768125237314550  0.8800203204870058
  0.5754204683573718  0.9169084670692698  0.1289177927704870
  0.5759671360828946  0.9172753897840025  0.8766498757399290
  0.4223273632548938  0.0812945888706977  0.1328631117432124
  0.5788525576930823  0.0840796020383223  0.1353773270778404
  0.4233740016948531  0.9183387060871269  0.8761099064810622
  0.8182622145412140  0.9040498484456450  0.3735619451832051
  0.1770701587312047  0.0936832330674733  0.6347711486500529
  0.1757540902931183  0.0910721139523147  0.3701994333831280
  0.8223097987764163  0.9088099173695241  0.6335436573181852
  0.1805464242868950  0.9045298556774739  0.6303625455727513
  0.8379339577479712  0.0830114525447030  0.3601605533911254
  0.8171841099018948  0.0996731375923972  0.6240632567947131
  0.1776813393568375  0.9103046229509886  0.3712211969562205
  0.3765531712211114  0.8168992211038741  0.9073276395001173
  0.6334692107642610  0.1772630990661597  0.0945850558976318
  0.3682386704790375  0.1753584581459720  0.0929381761012422
  0.6294407259386077  0.8209604982195984  0.9131340278381259
  0.6279014155332874  0.1804898190767688  0.9050149210191876
  0.3662848125308642  0.8290178820760090  0.0866023957670237
  0.6261651448560528  0.8189132333976445  0.0932422724027546
  0.3705785037699130  0.1786976774439637  0.9102575412573444
  0.9043255007562294  0.3728476524949755  0.8210954479262469
  0.0929104792936215  0.6355136890844406  0.1774690149760119
  0.0926348062674123  0.3695469940649687  0.1783469277769143
  0.9075328265191018  0.6323489257204145  0.8261683030986831
  0.9029229163173298  0.6275714645854436  0.1819590629758068
  0.0841521688966509  0.3607586960700715  0.8382824420248625
  0.1008811675620791  0.6240829048685015  0.8197436737581114
  0.9100467646384800  0.3700726860705288  0.1785246257896276
  0.9047259545747224  0.8240332356949551  0.6340513659259344
  0.0919339827515557  0.1745348036491734  0.3701275079970259
  0.0931168998158114  0.1769894886133443  0.6343136820399451
  0.9033752189350182  0.8218383776636244  0.3710868657204216
  0.9098952275144399  0.1761951918548803  0.3714406751564496
  0.0998528987859757  0.8182476638260283  0.6282497373561213
  0.0854053352170965  0.8372555168962847  0.3597221258538070
  0.9039203987933035  0.1798143173636291  0.6283845974550601
  0.8386421548469372  0.3588597929569275  0.0848021456620387
  0.1817228966437199  0.6266408234452356  0.9060292805084202
  0.1767154958734451  0.3701091651884454  0.9114495987592903
  0.8174147087108494  0.6229401923411473  0.1003845690149134
  0.1761236848029810  0.6345771881753777  0.0935828602604545
  0.8212224064991318  0.3721079082495393  0.9052359858088082
  0.8244466082703568  0.6313447665302121  0.9101660479353200
  0.1757709930802562  0.3690262603364758  0.0943618756554727
  0.3701636588689752  0.9116930680590514  0.1711438119044573
  0.6249922583936751  0.0983352241295208  0.8200816173001400
  0.3612045691464019  0.0864707114849850  0.8367244112348260
  0.6274979856294465  0.9054704478033813  0.1738177439052748
  0.6288703137007730  0.9074774005422341  0.8324374466781350
  0.3682017799709030  0.0912563288068426  0.1761283469336732
  0.6334405001919379  0.0935427382113403  0.1781226898084967
  0.3708858524329912  0.9071151115873803  0.8307641237250891
  0.0005615154477994  0.9994411643482479  0.5069184862295728
  0.5038265175402330  0.0010153101157186  0.0022794001035464
  0.0011950397662019  0.5059215804940038  0.0025665727848079
  0.4986675301460792  0.7690018062523691  0.0036803585430576
 
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