# generated using pymatgen
data_Pr6YAlI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.04317437
_cell_length_b   10.04317486
_cell_length_c   10.04317508
_cell_angle_alpha   107.59417737
_cell_angle_beta   107.59417839
_cell_angle_gamma   107.59417202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr6YAlI12
_chemical_formula_sum   'Pr6 Y1 Al1 I12'
_cell_volume   829.58919177
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Pr  Pr0  1  0.96811202  0.89544575  0.68214214  1.0
  Pr  Pr1  1  0.03188798  0.10455425  0.31785786  1.0
  Pr  Pr2  1  0.10455425  0.31785786  0.03188798  1.0
  Pr  Pr3  1  0.31785786  0.03188798  0.10455425  1.0
  Pr  Pr4  1  0.89544575  0.68214214  0.96811202  1.0
  Pr  Pr5  1  0.68214214  0.96811202  0.89544575  1.0
  Y  Y6  1  0.50000000  0.50000000  0.50000000  1.0
  Al  Al7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.52611272  0.60509257  0.83146488  1.0
  I  I9  1  0.47388728  0.39490743  0.16853512  1.0
  I  I10  1  0.31394539  0.92306392  0.76672994  1.0
  I  I11  1  0.39490743  0.16853512  0.47388728  1.0
  I  I12  1  0.92306392  0.76672994  0.31394539  1.0
  I  I13  1  0.68605461  0.07693608  0.23327006  1.0
  I  I14  1  0.07693608  0.23327006  0.68605461  1.0
  I  I15  1  0.76672994  0.31394539  0.92306392  1.0
  I  I16  1  0.23327006  0.68605461  0.07693608  1.0
  I  I17  1  0.83146488  0.52611272  0.60509257  1.0
  I  I18  1  0.16853512  0.47388728  0.39490743  1.0
  I  I19  1  0.60509257  0.83146488  0.52611272  1.0