data_[La16Sn4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sn  1.9600  1.4500  0.8300
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2863]
_cell_length_b [14.6019]
_cell_length_c [6.5373]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.1085]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La4SnSb]
_chemical_formula_sum '[La16 Sn4 Sb4]'
_cell_volume [795.9888]
_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  8  0.1135  0.1895  0.5784  1.0
  La  La1  8  0.1826  0.4206  0.8054  1.0
  Sn  Sn2  4  0.0000  0.0020  0.2500  1.0
  Sb  Sb3  4  0.0000  0.3775  0.2500  1.0
]