data_[La6Sn8Pd4]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6496]
_cell_length_b [4.7676]
_cell_length_c [9.0962]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2570]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3(Sn2Pd)2]
_chemical_formula_sum '[La6 Sn8 Pd4]'
_cell_volume [485.0059]
_cell_formula_units_Z [2]
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  0.1312  0.5000  0.6886  1.0
  La  La1  2  0.0000  0.0000  0.0000  1.0
  Sn  Sn2  4  0.0854  0.0000  0.3974  1.0
  Sn  Sn3  4  0.2079  0.5000  0.0732  1.0
  Pd  Pd4  4  0.1909  0.5000  0.3691  1.0
]