data_[Li4Sm4Zn2Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sm  1.1700  1.8500  1.2290
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.5342]
_cell_length_b [9.5342]
_cell_length_c [3.7467]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2Sm2ZnPd5]
_chemical_formula_sum '[Li4 Sm4 Zn2 Pd10]'
_cell_volume [340.5748]
_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  0.1192  0.3808  0.0000  1.0
  Sm  Sm1  4  0.1803  0.6803  0.0000  1.0
  Zn  Zn2  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd3  8  0.0643  0.2042  0.5000  1.0
  Pd  Pd4  2  0.0000  0.5000  0.5000  1.0
]