data_[Li8Pr6Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pr  1.1300  1.8500  1.0600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.8669]
_cell_length_b [4.1844]
_cell_length_c [27.8749]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li4Pr3Pt4]
_chemical_formula_sum '[Li8 Pr6 Pt8]'
_cell_volume [451.0297]
_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
[
  Li  Li0  4  0.0000  0.0000  0.0959  1
  Li  Li1  4  0.0000  0.5000  0.2489  1
  Pr  Pr2  4  0.0000  0.0000  0.3539  1
  Pr  Pr3  2  0.0000  0.5000  0.5000  1
  Pt  Pt4  4  0.0000  0.0000  0.1856  1
  Pt  Pt5  4  0.0000  0.5000  0.0495  1
]