data_[La2Pd6Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.8461]
_cell_length_b [4.8461]
_cell_length_c [13.1689]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [194]
_chemical_formula_structural [LaPd3Pb2]
_chemical_formula_sum '[La2 Pd6 Pb4]'
_cell_volume [267.8357]
_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  2  0.0000  0.0000  0.2500  1.0
  Pd  Pd1  4  0.3333  0.6667  0.8607  1.0
  Pd  Pd2  2  0.0000  0.0000  0.0000  1.0
  Pb  Pb3  4  0.3333  0.6667  0.0841  1.0
]