Fe  H  C  S  O                          
   1.00000000000000     
     6.9346600000000000    0.0000000000000000    0.0000000000000000
    -2.3080482679999998   15.7046033410000003    0.0000000000000000
    -2.3148713060000001   -7.8563973740000002   13.5968266430000000
   Fe   H    C    S    O 
     6     7    24     6    13
Direct
  0.1132282520708898  0.3408691059539635  0.1135169286573685
  0.8882232707644775  0.6604356282187567  0.8877681768645900
  0.7739378368990089  0.2749862269548160  0.1590474054556950
  0.2095064584412043  0.7343377859655291  0.8379036005335365
  0.4976847260049837  0.3878802842811595  0.2261196734153259
  0.4982754067524695  0.6170586591043161  0.7757361535112395
  0.3550733095327843  0.9975297991546412  0.0604118903305206
  0.6570289583091835  0.0059775836000924  0.9535026326657245
  0.3534737375074783  0.5574483754793178  0.5067851625178648
  0.6434115789546411  0.4406493944006371  0.4923126679302214
  0.2104741057736348  0.5595774708637151  0.0617894176383089
  0.7922712554183775  0.4475096473719731  0.9405827062290371
  0.1312444686206717  0.8193262478489274  0.7547077174277987
  0.9637793443704723  0.0912017130215119  0.0153374022833006
  0.0485463242571598  0.9129236709010939  0.9978828410660938
  0.1290815357848984  0.5763179977244945  0.5900141415813422
  0.8677889373112961  0.4200700178283370  0.4088086246846174
  0.4497512037343654  0.4932275784601785  0.0807511950272044
  0.5525249376371235  0.5136608079509060  0.9218562778729691
  0.1641951413725806  0.0871127951144572  0.0458673201015642
  0.8492857211486822  0.9170032938868218  0.9669219403314528
  0.0733689239283422  0.4545575351734001  0.4144540596096533
  0.9244309616219439  0.5412810619315920  0.5844694654609910
  0.6189952080821186  0.4620954235443619  0.0456106425626359
  0.3870152648374798  0.5471701415190466  0.9584265757119894
  0.3426680869051140  0.1703191155943600  0.0871460695286572
  0.6712687421965171  0.8319848775508802  0.9172515269524837
  0.1703619549824680  0.4169615270789961  0.3311868363283352
  0.8339983039901426  0.5747457342736269  0.6704579119344132
  0.7531559043976230  0.4161064448626846  0.0833723948803637
  0.2577059582609849  0.5968014695888826  0.9228403310164950
  0.2004221039694443  0.9989160677554381  0.0371608768182767
  0.8116397843460064  0.0052678786339584  0.9778502255778179
  0.1972745763881250  0.5317597899145881  0.5044750646674814
  0.7998577280806032  0.4660051723439551  0.4947441176256504
  0.3394298608418964  0.5348363226805191  0.0354847504250841
  0.6640894934916801  0.4728354784495110  0.9673573360421912
  0.8828812502424910  0.1892147597084914  0.0094970689404548
  0.1269240816805919  0.8105477020533627  0.9935075554526236
  0.6879726040199259  0.3192845121067123  0.3083851923756527
  0.3075968184505768  0.6782424762165675  0.6919188018656897
  0.3682906510248785  0.4928017072855155  0.1809907609042654
  0.6249342751102418  0.5099773537131327  0.8186910293315250
  0.3180504687869714  0.2588242144847470  0.1144266997624044
  0.7007097151832511  0.7431337090406771  0.8728110103624545
  0.0586050685528932  0.3575227794830340  0.2420248552403379
  0.9557314944036293  0.6079626485829408  0.7553490435422603
  0.7010128343869297  0.3872764188072537  0.1434261134015387
  0.3249617148260171  0.6404154914466460  0.8767913508802110
  0.5173755266280864  0.1566901578487787  0.0978434185365558
  0.4980958642754203  0.8456054040055818  0.9144773502279904
  0.3584277032142538  0.4433820429878494  0.3452879207235497
  0.6465342192663854  0.5656430217298052  0.6585867596252797
  0.9140705719417994  0.4029451273622158  0.0565352504803585
  0.0869583854036264  0.5984054217165919  0.9412049102345819
  0.0894414361710716  0.8163572937209622  0.8095844926924229
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  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
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
