Fe  H  C  O                             
   1.00000000000000     
    -7.1545030870000001  -12.4443052810000001   -0.0036716660000000
    -7.1865322369999998   12.3533061340000003    0.0084142880000000
     0.0115123420000000   -0.0054558400000000  -17.3418933300000013
   Fe   H    C    O 
     6    25    48    27
Direct
  0.7365675831593137  0.2621271417311561  0.2501838236777658
  0.5059973739634245  0.2527375335315654  0.2489681300006836
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  0.2619540944526335  0.7402925177737529  0.7502748966860722
  0.4843021073689400  0.7403600357668978  0.7498201701246003
  0.2608478363922231  0.5168301966943858  0.7499360516473672
  0.6748372589063933  0.0558687321900493  0.4367223448135320
  0.3767978905450491  0.3205929989674701  0.4372345015352792
  0.9457412410908574  0.6229332649943871  0.4385397228098782
  0.3250483904783010  0.9470737379083474  0.9403526576797532
  0.6233700123712325  0.6755940058309733  0.9407972662265394
  0.0539571201771665  0.3770302583409944  0.9386872597407887
  0.6229152433121072  0.9478505812195195  0.5592075886129066
  0.0534381042899597  0.6771485081844304  0.5613684348326018
  0.3231725884760621  0.3766723721152445  0.5591761328182159
  0.3798752120347686  0.0567090467383125  0.0625215696302064
  0.9464515076112221  0.3231763942510071  0.0614825743155976
  0.6762314690933522  0.6199089239035516  0.0630279044696636
  0.3232168473431685  0.9466650180599601  0.5615366547634295
  0.6233212427533630  0.6752775955658379  0.5592228696262538
  0.0538712853178538  0.3769535635255750  0.5612422942102953
  0.6788168500380110  0.0558757952401479  0.0617122793872511
  0.3759321648945644  0.3211646083003998  0.0623370270817745
  0.9461485698387762  0.6235170825524108  0.0615407147571645
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  0.4023609651139353  0.9716945932706622  0.9674214034091548
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  0.4325036568399128  0.0320342573407757  0.0350902594610432
  0.9705379023511114  0.4004665409062085  0.0340612261044129
  0.5990796318079603  0.5675536489850828  0.0355852690245229
  0.3999882917473983  0.9711924673584207  0.5336397297348938
  0.5701503251486457  0.5977839164321637  0.5320939501172006
  0.0295349092332273  0.4299289599702476  0.5338557288754089
  0.6016075241272532  0.0315653515826284  0.0345981079833635
  0.4292183876239832  0.3984954659077573  0.0351615073079472
  0.9704125740570149  0.5704340339314271  0.0340791373898028
  0.4286088482135284  0.0307545554550259  0.4657550888736566
  0.9702650865442948  0.4000732062604584  0.4658957178494703
  0.5998746189678812  0.5669986379499434  0.4646146875240049
  0.5714704497864105  0.9715413295398605  0.9668042733791964
  0.0295574418521412  0.6000242092082857  0.9661050228273425
  0.4001615118970250  0.4293142322505048  0.9674262662631037
  0.5610447014297506  0.1271771424640065  0.3586309763300193
  0.5277261110075813  0.0610447584384772  0.4306868847612293
  0.5650616420216679  0.4343581033229285  0.3590732556165221
  0.5302217437728700  0.4668264626252139  0.4305401419023411
  0.8744470075450934  0.4371200789111995  0.3597316197359035
  0.9402733559587517  0.4699805442478677  0.4316202411989991
  0.4391913949404795  0.8762775656371460  0.8602215688806183
  0.4717750773494132  0.9414598640779772  0.9327303083997052
  0.4383911111169496  0.5624511373306547  0.8611443235141891
  0.4703296161542951  0.5292078995299931  0.9332871392086943
  0.1248528747231887  0.5624151581129269  0.8595072995447168
  0.0594350152279759  0.5299675152178693  0.9317506898642094
  0.4387296993836927  0.8762283758323619  0.6398748831992478
  0.4702222030126677  0.9414284996272428  0.5674314081167324
  0.1249257791882883  0.5626039502892652  0.6404690084627376
  0.0593429557240768  0.5298915150923875  0.5682436504932582
  0.4380192435060764  0.5620623274362302  0.6383640403774322
  0.4704060839398920  0.5287707263080392  0.5663183291620726
  0.5668749158719564  0.1291793659096854  0.1407196740630354
  0.5324203534787557  0.0623013413190918  0.0689399553421808
  0.8748564699565904  0.4376590215074287  0.1401957884316616
  0.9406227075627953  0.4705160731545774  0.0683607829188517
  0.5624981762514381  0.4344990501699471  0.1412718120274050
  0.5289385519580208  0.4675478853521327  0.0695300088588340
  0.6537073579532304  0.1532903942525294  0.3316154427323283
  0.5008560621784000  0.3399246790722756  0.3331995612023277
  0.8480748119932713  0.5030929306253213  0.3315940890611131
  0.3463126392991072  0.8494878473659853  0.8327277775417556
  0.5044126696073263  0.6548618627971550  0.8328357167599307
  0.1504633230957353  0.4957496745437666  0.8313970484715156
  0.5052990445194183  0.8506401590128192  0.6676746316926341
  0.1519308057562299  0.6558979616456782  0.6680885907152572
  0.3457480958211576  0.4966315839535085  0.6666503541253945
  0.5028403111280610  0.1596539252851983  0.1659644110170433
  0.8477284750017944  0.3447643414408930  0.1681712783688383
  0.6543377521980176  0.5024438909450950  0.1694431595217836
  0.3463226548020657  0.8497846395749846  0.6680838436213961
  0.5041605238383156  0.6544851624336587  0.6668271853333181
  0.1504380713421298  0.4959202600063932  0.6685504423836193
  0.6575663636945634  0.1510707538927392  0.1698543943685564
  0.4968406238977110  0.3409864552961182  0.1674664276932631
  0.8482254397920173  0.5037124864181237  0.1683019221651705
  0.4944621830864975  0.1528742614055858  0.3306905837182512
  0.8471444722305748  0.3438629997958103  0.3318416750264390
  0.6561630471085209  0.5030295723555227  0.3308435425685872
  0.5056033098875048  0.8510740193839794  0.8313962322951269
  0.1516505837758260  0.6555681943441769  0.8318491559594037
  0.3462469418241625  0.4968333510745992  0.8324724942694601
  0.6568669867472892  0.3281197211016931  0.2492835710257495
  0.3335340645793110  0.6681127828627353  0.7500252031412273
  0.3615983448469038  0.1816999512688966  0.2483449255174932
 
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