data_[Li4Th8Ga24Fe4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Th  1.3000  1.8000  1.0800
  Ga  1.8100  1.3000  0.7600
  Fe  1.8300  1.4000  0.8525
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [9.1672]
_cell_length_b [9.1672]
_cell_length_c [9.1672]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [LiTh2Ga6Fe]
_chemical_formula_sum '[Li4 Th8 Ga24 Fe4]'
_cell_volume [770.3837]
_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  4  0.0000  0.0000  0.5000  1
  Th  Th1  8  0.2500  0.2500  0.2500  1
  Ga  Ga2  24  0.0000  0.0000  0.2539  1
  Fe  Fe3  4  0.0000  0.0000  0.0000  1
]