Fe2O3(1-102)-(1x1) -- originally from COD 2101167
  1.000000
    5.0354999999999999    0.0000000000000000    0.0000000000000000
    0.0000000000000000    5.4267997742000000    0.0000000000000000
    0.0000000000000000   -3.3665839532883419   32.8655608768952447
   Fe    O
   20   30
Direct
  0.2163836465141485  0.9511793689894886  0.5304039104370065
  0.7836163534858515  0.4511793689894886  0.5304039104370065
  0.7379527499054387  0.8625070197469951  0.4880900129901128
  0.2620472500945614  0.3625070197469951  0.4880900129901128
  0.7522962356757885  0.4394446636052552  0.4213773084721346
  0.2477037643242114  0.9394446636052552  0.4213773084721346
  0.2537680749735426  0.3598499785216804  0.3749010065007536
  0.7462319250264573  0.8598499785216803  0.3749010065007536
  0.2521327003591412  0.9379199427288800  0.3096251258004090
  0.7478672996408586  0.4379199427288800  0.3096251258004090
  0.7517090153721711  0.8618421231813055  0.2626376211744482
  0.2482909846278289  0.3618421231813054  0.2626376211744482
  0.7500000000000000  0.4367390541102348  0.1976078765142206
  0.2500000000000000  0.9367390541102349  0.1976078765142206
  0.2500000000000000  0.3562790541102347  0.1506017329876884
  0.7500000000000000  0.8562790541102349  0.1506017329876884
  0.7499980140998906  0.8562798807034847  0.0385607423046820
  0.2499980140998908  0.3562798807034847  0.0385607423046820
  0.2499980140998908  0.9367398807034848  0.0855668858312142
  0.7499980140998906  0.4367398807034849  0.0855668858312142
  0.9016538435821987  0.7880231503077861  0.5437643105610519
  0.0983461564178011  0.2880231503077861  0.5437643105610519
  0.4437273595975038  0.6498453097830157  0.5134914570219078
  0.5562726404024961  0.1498453097830157  0.5134914570219078
  0.9066950759063100  0.4894604502690245  0.4744281374070010
  0.0933049240936898  0.9894604502690244  0.4744281374070010
  0.3999832404686499  0.3056220884702871  0.4328579737785432
  0.6000167595313501  0.8056220884702872  0.4328579737785432
  0.9405522348732146  0.1466486938538971  0.3983851092544266
  0.0594477651267852  0.6466486938538972  0.3983851092544266
  0.4018169165933906  0.9910233714304579  0.3642736829796712
  0.5981830834066093  0.4910233714304580  0.3642736829796712
  0.8995894245370524  0.8015742484976021  0.3206259614091356
  0.1004105754629476  0.3015742484976020  0.3206259614091356
  0.4384206340634119  0.6464323462266643  0.2868032449019777
  0.5615793659365880  0.1464323462266646  0.2868032449019777
  0.9032631509275137  0.4964304506236425  0.2522603455593030
  0.0967368490724861  0.9964304506236422  0.2522603455593030
  0.4026999999999999  0.2992090541102346  0.2083230328322789
  0.5972999999999999  0.7992090541102346  0.2083230328322789
  0.9446000000000000  0.1465090541102347  0.1741039084226833
  0.0554000000000000  0.6465090541102347  0.1741039084226833
  0.4026999999999999  0.9938090541102349  0.1398874729979014
  0.5972999999999999  0.4938090541102349  0.1398874729979014
  0.9026980140998907  0.4938098807034847  0.0278464823148949
  0.0972980140998907  0.9938098807034847  0.0278464823148949
  0.4445980140998909  0.6465098807034846  0.0620629177396769
  0.5553980140998908  0.1465098807034847  0.0620629177396769
  0.9026980140998907  0.7992098807034845  0.0962820421492725
  0.0972980140998907  0.2992098807034845  0.0962820421492725
