data_[Li10P4Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8435]
_cell_length_b [7.5433]
_cell_length_c [6.4178]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5692]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li5(PPd6)2]
_chemical_formula_sum '[Li10 P4 Pd24]'
_cell_volume [569.5923]
_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  4  0.1879  0.5000  0.9583  1.0
  Li  Li1  4  0.2441  0.0000  0.5814  1.0
  Li  Li2  2  0.0000  0.0000  0.5000  1.0
  P  P3  4  0.0000  0.2495  0.0000  1.0
  Pd  Pd4  8  0.1124  0.2960  0.6077  1.0
  Pd  Pd5  8  0.1637  0.1884  0.2271  1.0
  Pd  Pd6  4  0.0393  0.5000  0.2241  1.0
  Pd  Pd7  4  0.0896  0.0000  0.8629  1.0
]