data_[Pr24In8Sn4]
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
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [10.3020]
_cell_length_b [10.4498]
_cell_length_c [11.1529]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Pr6In2Sn]
_chemical_formula_sum '[Pr24 In8 Sn4]'
_cell_volume [1200.6477]
_cell_formula_units_Z [4]
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  0.0000  0.2814  0.3289  1.0
  Pr  Pr1  8  0.1808  0.2714  0.0000  1.0
  Pr  Pr2  8  0.1986  0.0000  0.2553  1.0
  In  In3  4  0.0000  0.5000  0.1294  1.0
  In  In4  4  0.1485  0.5000  0.5000  1.0
  Sn  Sn5  2  0.0000  0.0000  0.0000  1.0
  Sn  Sn6  2  0.0000  0.0000  0.5000  1.0
]