data_[Li5Zn2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.0254]
_cell_length_b [2.8109]
_cell_length_c [8.5540]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8078]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li5(ZnPd2)2]
_chemical_formula_sum '[Li5 Zn2 Pd4]'
_cell_volume [168.5522]
_cell_formula_units_Z [1]
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  2  0.1410  0.0000  0.1315  1
  Li  Li1  2  0.4528  0.0000  0.6655  1
  Li  Li2  1  0.5000  0.0000  0.0000  1
  Zn  Zn3  2  0.0807  0.0000  0.6394  1
  Pd  Pd4  2  0.2111  0.5000  0.8732  1
  Pd  Pd5  2  0.2410  0.5000  0.4176  1
]