data_[Pr10In2Bi8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [I4/m]
_cell_length_a [10.3410]
_cell_length_b [10.3410]
_cell_length_c [6.5473]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [87]
_chemical_formula_structural [Pr5InBi4]
_chemical_formula_sum '[Pr10 In2 Bi8]'
_cell_volume [700.1511]
_cell_formula_units_Z [2]
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  8  0.1030  0.3042  0.5000  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  In  In2  2  0.0000  0.0000  0.5000  1.0
  Bi  Bi3  8  0.0996  0.2997  0.0000  1.0
]