data_[Li8Pr16Ga24]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [7.6169]
_cell_length_b [9.1484]
_cell_length_c [15.8379]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [LiPr2Ga3]
_chemical_formula_sum '[Li8 Pr16 Ga24]'
_cell_volume [1103.6121]
_cell_formula_units_Z [8]
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  8  0.0000  0.0000  0.3315  1.0
  Pr  Pr1  8  0.2434  0.0000  0.5000  1.0
  Pr  Pr2  8  0.2500  0.2500  0.2500  1.0
  Ga  Ga3  16  0.0000  0.2461  0.0836  1.0
  Ga  Ga4  8  0.0000  0.0000  0.1652  1.0
]