data_[La12In4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8052]
_cell_length_b [7.7009]
_cell_length_c [9.7942]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9945]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3InSb]
_chemical_formula_sum '[La12 In4 Sb4]'
_cell_volume [646.8559]
_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
[
  La  La0  4  0.0661  0.0000  0.2985  1.0
  La  La1  4  0.1885  0.5000  0.8702  1.0
  La  La2  4  0.2035  0.5000  0.3119  1.0
  In  In3  4  0.0000  0.3100  0.5000  1.0
  Sb  Sb4  4  0.0000  0.2533  0.0000  1.0
]