data_[Li8In12Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.9803]
_cell_length_b [9.7021]
_cell_length_c [4.8961]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.4637]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li2In3Pd4]
_chemical_formula_sum '[Li8 In12 Pd16]'
_cell_volume [609.8748]
_cell_formula_units_Z [4]
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  8  0.2214  0.3749  0.8762  1.0
  In  In1  8  0.1616  0.1291  0.5639  1.0
  In  In2  4  0.0000  0.3723  0.7500  1.0
  Pd  Pd3  8  0.0624  0.1258  0.0264  1.0
  Pd  Pd4  8  0.1182  0.3859  0.3052  1.0
]