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
  0.2102819978155099  0.9495931305859219  0.5306882794945255
  0.7897180021844900  0.4495931305859221  0.5306882794945255
  0.7420563995631018  0.8533486714928533  0.4879419141754728
  0.2579436004368981  0.3533486714928533  0.4879419141754728
  0.7460281997815508  0.4326761254866905  0.4210814045702503
  0.2539718002184491  0.9326761254866905  0.4210814045702503
  0.2539718002184490  0.3562790541102345  0.3746838007876438
  0.7460281997815510  0.8562790541102345  0.3746838007876438
  0.2500000000000000  0.9367390541102348  0.3096489104141984
  0.7500000000000000  0.4367390541102347  0.3096489104141984
  0.7500000000000000  0.8562790541102347  0.2626427668876661
  0.2500000000000000  0.3562790541102347  0.2626427668876661
  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
  0.8987281997815508  0.7873977835749905  0.5432290550443605
  0.1012718002184492  0.2873977835749905  0.5432290550443605
  0.4406281997815505  0.6402707735400850  0.5120526293543934
  0.5593718002184493  0.1402707735400848  0.5120526293543934
  0.9066718002184490  0.4864382275339231  0.4760096783695631
  0.0933281997815511  0.9864382275339232  0.4760096783695631
  0.3907845993446529  0.3028944673983908  0.4324051006322343
  0.6092154006553471  0.8028944673983908  0.4324051006322343
  0.9446000000000000  0.1468865694456222  0.3987945159665644
  0.0554000000000000  0.6468865694456221  0.3987945159665644
  0.4026999999999999  0.0015573960219348  0.3645780805417825
  0.5972999999999999  0.5015573960219347  0.3645780805417825
  0.9026999999999999  0.7992090541102346  0.3203640667322565
  0.0973000000000000  0.2992090541102346  0.3203640667322565
  0.4445999999999999  0.6465090541102348  0.2861449423226610
  0.5554000000000000  0.1465090541102347  0.2861449423226610
  0.9026999999999999  0.4938090541102348  0.2519276105696078
  0.0973000000000000  0.9938090541102351  0.2519276105696078
  0.4027000000000000  0.2992090541102346  0.2083230328322789
  0.5973000000000001  0.7992090541102346  0.2083230328322789
  0.9446000000000000  0.1465090541102347  0.1741039084226833
  0.0554000000000000  0.6465090541102347  0.1741039084226833
  0.4027000000000000  0.9938090541102349  0.1398874729979014
  0.5973000000000001  0.4938090541102349  0.1398874729979014
  0.9026980140998908  0.4938098807034847  0.0278464823148949
  0.0972980140998909  0.9938098807034847  0.0278464823148949
  0.4445980140998909  0.6465098807034846  0.0620629177396769
  0.5553980140998908  0.1465098807034847  0.0620629177396769
  0.9026980140998908  0.7992098807034845  0.0962820421492725
  0.0972980140998909  0.2992098807034845  0.0962820421492725
