data_[Sm2Pd10Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [8.1909]
_cell_length_b [9.7182]
_cell_length_c [4.7606]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [SmPd5Au4]
_chemical_formula_sum '[Sm2 Pd10 Au8]'
_cell_volume [378.9440]
_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
[
  Sm  Sm0  2  0.0000  0.0000  0.5689  1.0
  Pd  Pd1  8  0.1683  0.2577  0.2546  1.0
  Pd  Pd2  2  0.0000  0.5000  0.3244  1.0
  Au  Au3  4  0.0000  0.3059  0.7571  1.0
  Au  Au4  4  0.2455  0.0000  0.0708  1.0
]