data_[Li10Sb4Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7575]
_cell_length_b [8.3306]
_cell_length_c [5.7054]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.1237]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li5(SbPd6)2]
_chemical_formula_sum '[Li10 Sb4 Pd24]'
_cell_volume [603.9368]
_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  0.1639  0.5000  0.9037  1.0
  Li  Li1  4  0.2361  0.0000  0.4976  1.0
  Li  Li2  2  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  4  0.0000  0.2318  0.0000  1.0
  Pd  Pd4  8  0.1009  0.2681  0.6078  1.0
  Pd  Pd5  8  0.1981  0.2599  0.2027  1.0
  Pd  Pd6  4  0.0463  0.5000  0.2739  1.0
  Pd  Pd7  4  0.1402  0.0000  0.9025  1.0
]