Mn  H  C  N Cl                          
   1.00000000000000     
    16.5712659799999997   -0.0002231170000000   -0.0003494790000000
    -2.7625300010000000   14.6420179810000004    0.0000150190000000
    -2.7625017629999999   -7.3207973480000001   12.6804739360000003
   Mn   H    C    N    Cl
    12    12    36    36    12
Direct
  0.2499988539298386  0.2885094791369838  0.2114899687315273
  0.2500004146824608  0.7114925723569527  0.7885112760337449
  0.3942685442549916  0.2885203107636656  0.0770833535263264
  0.1057329715105340  0.7114823181358219  0.9229163140720829
  0.1057308303228481  0.4229163025255289  0.2114803131538778
  0.3942684501535965  0.5770845660825685  0.7885185657709499
  0.7499993881618536  0.2885097724689700  0.2114903425095349
  0.7499997419946993  0.7114928656539163  0.7885116497784850
  0.8942685583702783  0.2885203154103877  0.0770845159043958
  0.6057312704534681  0.7114808511764181  0.9229158991765090
  0.6057307610949749  0.4229165958400074  0.2114806869152588
  0.8942706809098624  0.5770841764982180  0.7885189395965213
  0.1509466371412600  0.0000174367349857  0.0809080762750725
  0.3490516454781414  0.9999826432533609  0.9190892253950764
  0.1395062132651788  0.5808828025471868  0.0808826259483340
  0.3604957274097629  0.4191215865911460  0.9191178302737555
  0.1509481489435416  0.5809108880568559  0.5000171176967498
  0.3490528808880526  0.4190880373305319  0.4999833385067021
  0.6509458082216710  0.0000172583123046  0.0809116044722984
  0.8490508165585524  0.9999824648306870  0.9190927535923024
  0.6395082654709725  0.5808841731841881  0.0808837883809588
  0.8604959505877758  0.4191208026531470  0.9191174154304065
  0.6509486035029326  0.5809070835931465  0.5000174914774220
  0.8490526941342225  0.4190920341395952  0.4999829236463995
  0.0651705136098499  0.0922355667834722  0.0694241709641972
  0.4348265725442673  0.9077634641147085  0.9305778623585539
  0.2804589058415345  0.4305819594640141  0.0228139381104810
  0.2195420898072626  0.5694203807502021  0.9771865180879900
  0.0190559229829148  0.4771983832444988  0.4077702078565579
  0.4809452853991516  0.5227987819215443  0.5922294597398476
  0.0651735453958722  0.5694218449840136  0.5922360838042735
  0.4348279740401892  0.4305763974520147  0.4077643724134887
  0.2195410722063329  0.4771874893375312  0.0694185061661159
  0.2804578020088044  0.5228137735541694  0.9305811613611041
  0.4809434340502037  0.0922292663717528  0.0228001489454002
  0.0190539631579085  0.9077708417964132  0.9772026729987147
  0.0866975592193029  0.0000110821975809  0.0478326206000759
  0.4132995879593224  0.9999898919738328  0.9521678354939453
  0.1872125695956157  0.5478126586048404  0.0478118721999863
  0.3127877087378721  0.4521889986230008  0.9521885839795203
  0.0866996315226984  0.5478320015611118  0.5000106544765117
  0.4133011059030096  0.4521680010787463  0.4999905903316701
  0.5651702353192434  0.0922366486826718  0.0694261219469965
  0.9348265866595611  0.9077634687614378  0.9305790247366303
  0.7804600435334450  0.4305822528135153  0.0228143119051225
  0.7195438309590543  0.5694206741172110  0.9771868918992581
  0.5190546773475191  0.4771996481605711  0.4077697929703064
  0.9809468821832681  0.5227974206830694  0.5922306221631572
  0.5651723831036435  0.5694228212323367  0.5922364575347174
  0.9348280833627882  0.4305749305451485  0.4077639575678162
  0.7195430105567056  0.4771881770056652  0.0694196685964101
  0.7804587425021268  0.5228136726025454  0.9305807465367195
  0.9809428447056021  0.0922292710009671  0.0228013113068428
  0.5190537800746213  0.9077704521420245  0.9772030467577650
  0.5866964497579801  0.0000107981415383  0.0478345715615802
  0.9132990819578879  0.9999896079353050  0.9521697864720835
  0.6872139044861001  0.5478133462554595  0.0478130346136538
  0.8127879319158922  0.4521882146850018  0.9521881691361784
  0.5866986477809348  0.5478312175880973  0.5000102395999022
  0.9133019325409109  0.4521672171582622  0.4999901755049549
  0.1139938745686493  0.1961889503653893  0.1346406215193880
  0.3860038760698714  0.8038120238235393  0.8653598345912670
  0.2966704739539381  0.3653620196612621  0.0615535504956526
  0.2033327451197948  0.6346432637301902  0.9384500602168373
  0.0159037204827541  0.4384579904516741  0.3038229479639654
  0.4840971121502662  0.5615405406345957  0.6961767196204676
  0.3860046657668477  0.3653589137190636  0.3038119420964094
  0.1139964779201605  0.6346406946371985  0.6961885141093731
  0.2033296953537373  0.4384509332773661  0.1346412194828872
  0.2966697823212883  0.5615503296318423  0.8653584480609666
  0.4840963681422110  0.1961771804327128  0.0615399896776836
  0.0159023922175052  0.8038233994901134  0.9384596778472059
  0.0634613448703192  0.2538442232237017  0.1269257264392607
  0.4365372182908231  0.7461559623980136  0.8730731524666027
  0.2500006008230216  0.3730826022870986  0.1269228401679143
  0.2500023071967092  0.6269216038343686  0.8730799819232189
  0.4365370665323525  0.3730736503336516  0.2461553860761256
  0.0634640771546628  0.6269259580226034  0.7538450701296640
  0.6139934824226287  0.1961893492957216  0.1346425724998568
  0.8860038901851581  0.8038120284702686  0.8653609969693363
  0.7966708943305321  0.3653616300243812  0.0615539242713297
  0.7033330821532289  0.6346431627610585  0.9384496453758189
  0.5159029644518256  0.4384585724163941  0.3038225330920170
  0.9840993123942710  0.5615391794136286  0.6961778820604039
  0.8860048889448677  0.3653581297810646  0.3038115272530675
  0.6139952017725108  0.6346409879166472  0.6961888878374936
  0.7033310302442217  0.4384516209279852  0.1346423818965548
  0.7966701193547223  0.5615502286627105  0.8653580332199482
  0.9840950614823072  0.1961765020755522  0.0615411520201619
  0.5159022091342180  0.8038230098357246  0.9384600516062562
  0.5634613894978600  0.2538451995070474  0.1269261002029722
  0.9365373462615239  0.7461566500136101  0.8730743148470026
  0.7500010211996155  0.3730822126502176  0.1269232139435985
  0.7500019269148410  0.6269208198788618  0.8730795670632432
  0.9365374869089464  0.3730732606967777  0.2461557598518027
  0.5634627176638531  0.6269265399698085  0.7538446552410818
  0.2124912403553481  0.4249585212398301  0.3499212964096685
  0.2875108446872687  0.5750475225040006  0.6500783712003795
  0.2875085363324104  0.1500794295828243  0.0750412191969687
  0.2124894196983007  0.8499251424848282  0.9249568710729150
  0.9999999497232537  0.4249395014245749  0.0750613188134750
  0.0000015801575586  0.5750631321216275  0.9249395111630037
  0.7124905676675866  0.4249588145367937  0.3499216701544157
  0.7875159447047579  0.5750498648651714  0.6500787451017942
  0.7875075525906468  0.1500786456098027  0.0750408043203592
  0.7124847318540475  0.8499246470744879  0.9249556674798214
  0.5000002161497079  0.4249396024112215  0.0750617336711201
  0.5000005964158021  0.5750623481486130  0.9249390962863941
 
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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