data_[Pr10Ho2Se16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [8.9092]
_cell_length_b [8.9092]
_cell_length_c [9.0565]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Pr5HoSe8]
_chemical_formula_sum '[Pr10 Ho2 Se16]'
_cell_volume [718.8569]
_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  0.1171  0.7491  0.1240  1.0
  Pr  Pr1  2  0.0000  0.0000  0.5000  1.0
  Ho  Ho2  2  0.0000  0.5000  0.7500  1.0
  Se  Se3  8  0.0716  0.8149  0.7975  1.0
  Se  Se4  8  0.0767  0.6754  0.4519  1.0
]