H1 Ir20 O41                             
   1.00000000000000     
     6.2927695945796778    0.0000000000000000    0.3302847473392688
     0.0000000000000016   10.0578580399999993    0.0000000000000006
     0.0000000000000000    0.0000000000000000   30.0559119800000012
   H    Ir   O 
     1    20    41
Selective dynamics
Direct
  0.1294217569679105  0.6250845385787401  0.7289553535976481   T   T   T
  0.2698098280457113  0.4914429185837226  0.6668357108813837   T   T   T
  0.7746367675684510  0.4632796649921991  0.6573467845487043   T   T   T
  0.3169275433122152 -0.0051718467560946  0.6666290066923912   T   T   T
  0.8149555055815914 -0.0071784078310353  0.6676753990339767   T   T   T
  0.0132888695274561  0.4891875617335658  0.5778008124852068   T   T   T
  0.5137579629494874  0.4874464176868399  0.5704507011598555   T   T   T
  0.0842057532576895 -0.0010151234314027  0.5724225815580422   T   T   T
  0.5838785603149309 -0.0047886416566518  0.5768785720216227   T   T   T
  0.3181818199999995  0.5000000000000000  0.4930069929605452   F   F   F
  0.8181818199999995  0.5000000000000000  0.4820179819613486   F   F   F
  0.3181818199999995  0.0000000000000000  0.4930069929605452   F   F   F
  0.8181818199999995  0.0000000000000000  0.4820179819613486   F   F   F
  0.0454545449999983  0.5000000000000000  0.4080919090100608   F   F   F
  0.5454545449999983  0.5000000000000000  0.3971028980108571   F   F   F
  0.0454545449999983  0.0000000000000000  0.4080919090100608   F   F   F
  0.5454545449999983  0.0000000000000000  0.3971028980108571   F   F   F
  0.2727272750000012  0.5000000000000000  0.3121878139504872   F   F   F
  0.7727272750000012  0.5000000000000000  0.3011988029512835   F   F   F
  0.2727272750000012  0.0000000000000000  0.3121878139504872   F   F   F
  0.7727272750000012  0.0000000000000000  0.3011988029512835   F   F   F
  0.0180983816000107  0.5846953138300647  0.6374981220485573   T   T   T
  0.5243144786414642  0.5696382273280896  0.6303999999596772   T   T   T
  0.0750121121953653  0.9110078616002935  0.6330664711213565   T   T   T
  0.5765048510164272  0.9026562740331751  0.6364846962176388   T   T   T
  0.0028522845346225  0.4072466060493927  0.6928851962624539   T   T   T
  0.5198422471358676  0.3959031203278351  0.6870845977085415   T   T   T
  0.0590954450785268  0.0487689665449131  0.6976504572609136   T   T   T
  0.5563973646305076  0.0476627544388555  0.7000084033105461   T   T   T
  0.2621434795199717  0.5990115215095962  0.5520560140549307   T   T   T
  0.7798921919902182  0.5803983087359239  0.5435821805572235   T   T   T
  0.3477770431477697  0.8945566769811326  0.5495144454145425   T   T   T
  0.8327597640917586  0.9111108504329692  0.5430250101153592   T   T   T
  0.2620900371441796  0.4030323535333952  0.6059643063519546   T   T   T
  0.7470213178737246  0.3799854011280775  0.5969300460619152   T   T   T
  0.3262224952473524  0.0859627041096387  0.6064387451695883   T   T   T
  0.8306231978159370  0.0842080938758958  0.6057776001117584   T   T   T
  0.0606060599999978  0.5897138999999996  0.4683649686800848   F   F   F
  0.5606060599999978  0.5897138999999996  0.4573759576808811   F   F   F
  0.0606060599999978  0.9102861000000004  0.4683649686800848   F   F   F
  0.5606060599999978  0.9102861000000004  0.4573759576808811   F   F   F
  0.0494335619466309  0.4030917201423024  0.5179455158170102   T   T   T
  0.5668277290596787  0.3920080501051235  0.5101285942868740   T   T   T
  0.0574478345225546  0.1061880448726007  0.5148335813136947   T   T   T
  0.5762817660548812  0.0897040843640183  0.5167190616212474   T   T   T
  0.2878787900000006  0.5897138999999996  0.3724608736205042   F   F   F
  0.7878787900000006  0.5897138999999996  0.3614718626213005   F   F   F
  0.2878787900000006  0.9102861000000004  0.3724608736205042   F   F   F
  0.7878787900000006  0.9102861000000004  0.3614718626213005   F   F   F
  0.3030303050000001  0.4102861000000004  0.4327339332905282   F   F   F
  0.8030303050000001  0.4102861000000004  0.4217449222913245   F   F   F
  0.3030303050000001  0.0897138999999996  0.4327339332905282   F   F   F
  0.8030303050000001  0.0897138999999996  0.4217449222913245   F   F   F
  0.0151515149999994  0.5897138999999996  0.2875457896700198   F   F   F
  0.5151515149999994  0.5897138999999996  0.2765567786708161   F   F   F
  0.0151515149999994  0.9102861000000004  0.2875457896700198   F   F   F
  0.5151515149999994  0.9102861000000004  0.2765567786708161   F   F   F
  0.0303030299999989  0.4102861000000004  0.3478188493400438   F   F   F
  0.5303030299999989  0.4102861000000004  0.3368298383408401   F   F   F
  0.0303030299999989  0.0897138999999996  0.3478188493400438   F   F   F
  0.5303030299999989  0.0897138999999996  0.3368298383408401   F   F   F
  0.2702295416652637  0.6239396774072609  0.7134250635904101   T   T   T
 
  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
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  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
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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
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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
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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
