data_[Li8Sm16In24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sm  1.1700  1.8500  1.2290
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [7.3357]
_cell_length_b [9.8472]
_cell_length_c [17.0858]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [LiSm2In3]
_chemical_formula_sum '[Li8 Sm16 In24]'
_cell_volume [1234.2121]
_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  0.3319  1
  Sm  Sm1  8  0.2491  0.0000  0.5000  1
  Sm  Sm2  8  0.2500  0.2500  0.2500  1
  In  In3  16  0.0000  0.2432  0.4136  1
  In  In4  8  0.0000  0.0000  0.1716  1
]