data_[Li24Mg4Cl32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mg  1.3100  1.5000  0.8600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [10.3565]
_cell_length_b [10.3565]
_cell_length_c [10.3565]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [Li6MgCl8]
_chemical_formula_sum '[Li24 Mg4 Cl32]'
_cell_volume [1110.7954]
_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
[
  Li  Li0  24  0.0000  0.2500  0.2500  1.0
  Mg  Mg1  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  24  0.0000  0.0000  0.2417  1.0
  Cl  Cl3  8  0.2500  0.2500  0.2500  1.0
]