data_[Li8Pd4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.0754]
_cell_length_b [6.9491]
_cell_length_c [7.1353]
_cell_angle_alpha [85.1220]
_cell_angle_beta [69.9677]
_cell_angle_gamma [88.6547]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li4Pd2Pb]
_chemical_formula_sum '[Li8 Pd4 Pb2]'
_cell_volume [235.5727]
_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
[
  Li  Li0  1  0.0164  0.6680  0.0072  1.0
  Li  Li1  1  0.0625  0.8700  0.3744  1.0
  Li  Li2  1  0.1301  0.9797  0.7378  1.0
  Li  Li3  1  0.2890  0.2877  0.4148  1.0
  Li  Li4  1  0.3653  0.3855  0.8400  1.0
  Li  Li5  1  0.5679  0.8739  0.3799  1.0
  Li  Li6  1  0.7790  0.5086  0.4430  1.0
  Li  Li7  1  0.8532  0.3790  0.8108  1.0
  Pd  Pd8  1  0.2216  0.6185  0.5893  1.0
  Pd  Pd9  1  0.4587  0.5980  0.1608  1.0
  Pd  Pd10  1  0.6541  0.7203  0.7290  1.0
  Pd  Pd11  1  0.7050  0.1296  0.5881  1.0
  Pb  Pb12  1  0.4993  0.9985  0.9988  1.0
  Pb  Pb13  1  0.8980  0.2328  0.1761  1.0
]