data_[Sm20In8Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [16.2938]
_cell_length_b [8.0684]
_cell_length_c [7.8116]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Sm5(InGa)2]
_chemical_formula_sum '[Sm20 In8 Ga8]'
_cell_volume [1026.9429]
_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
[
  Sm  Sm0  16  0.1310  0.1911  0.6798  1.0
  Sm  Sm1  4  0.0000  0.0000  0.0000  1.0
  In  In2  8  0.2209  0.0000  0.0000  1.0
  Ga  Ga3  8  0.0000  0.1157  0.3836  1.0
]