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
  0.2165675067847768  0.9506878755918421  0.5303784684083109
  0.7834324932152231  0.4506878755918420  0.5303784684083109
  0.7386177517269360  0.8630554779525301  0.4879692950000326
  0.2613822482730639  0.3630554779525300  0.4879692950000326
  0.7519553495103718  0.4388792639787099  0.4213402973724975
  0.2480446504896282  0.9388792639787098  0.4213402973724975
  0.2532104201560316  0.3592867347987239  0.3747994856940982
  0.7467895798439683  0.8592867347987240  0.3747994856940982
  0.2512517171425753  0.9380605955324621  0.3096028955046884
  0.7487482828574247  0.4380605955324621  0.3096028955046884
  0.7502721360387558  0.8613524943634442  0.2625573358073858
  0.2497278639612443  0.3613524943634441  0.2625573358073858
  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
  0.9014991907075618  0.7876490047735248  0.5436304803092608
  0.0985008092924381  0.2876490047735249  0.5436304803092608
  0.4453158837103672  0.6502743447099694  0.5134822671422511
  0.5546841162896328  0.1502743447099696  0.5134822671422511
  0.9061796644568270  0.4881426078840987  0.4742838457477999
  0.0938203355431729  0.9881426078840986  0.4742838457477999
  0.4005186333024320  0.3038504050653785  0.4327996055482432
  0.5994813666975679  0.8038504050653785  0.4327996055482432
  0.9421925170400236  0.1461584763822059  0.3983441216309053
  0.0578074829599763  0.6461584763822061  0.3983441216309053
  0.4000661332992995  0.9910266580859357  0.3643073570679075
  0.5999338667007005  0.4910266580859356  0.3643073570679075
  0.8992474350599777  0.8023826043471407  0.3205390870294859
  0.1007525649400223  0.3023826043471406  0.3205390870294859
  0.4385811375230187  0.6450123678502451  0.2868135463818788
  0.5614188624769813  0.1450123678502451  0.2868135463818788
  0.9007978546392867  0.4938940445265362  0.2522253840440546
  0.0992021453607131  0.9938940445265363  0.2522253840440546
  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
