Fe  H  O 
 1.0000000000000000
     2.5086653354282364    0.0000000000000000    0.0000000000000000
     0.0000000000000000   20.2222680288493777    0.0000000000000000
     0.0000000000000000    0.0000000000000000    4.2490238128479625
 Fe  H   O  
   4   4   8
Selective dynamics
Cartesian
  0.0000000000000000 14.3551632046047519  1.0622559532119911   T   T   T
  0.0000000000000000  5.8671048242446249  3.1867678596359759   T   T   T
  1.2543326677141180  4.2440291901800586  1.0622559532119911   T   T   T
  1.2543326677141180 15.9782388386693341  3.1867678596359759   T   T   T
  0.0000000000000000 11.7530879126252348  1.0622559532119911   T   T   T
  0.0000000000000000  8.4691801162241571  3.1867678596359759   T   T   T
  1.2543326677141180  1.6419538982005544  1.0622559532119911   T   T   T
  1.2543326677141180 18.5803141306488548  3.1867678596359759   T   T   T
  0.0000000000000000  4.9620720370535869  1.0622559532119911   T   T   T
  0.0000000000000000 15.2601959917957988  3.1867678596359759   T   T   T
  1.2543326677141180 15.0732060514782820  1.0622559532119911   T   T   T
  1.2543326677141180  5.1490619773711135  3.1867678596359759   T   T   T
  0.0000000000000000  2.2016146973055171  1.0622559532119911   T   T   T
  0.0000000000000000 18.0206533315438726  3.1867678596359759   T   T   T
  1.2543326677141180 12.3127487117302117  1.0622559532119911   T   T   T
  1.2543326677141180  7.9095193171191722  3.1867678596359759   T   T   T