data_[Sm24Sn4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.5761]
_cell_length_b [10.0911]
_cell_length_c [10.6880]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sm6SnPd2]
_chemical_formula_sum '[Sm24 Sn4 Pd8]'
_cell_volume [1032.8263]
_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
[
  Sm  Sm0  8  0.0000  0.1988  0.2356  1.0
  Sm  Sm1  8  0.1981  0.5000  0.1741  1.0
  Sm  Sm2  8  0.2106  0.3173  0.5000  1.0
  Sn  Sn3  2  0.0000  0.0000  0.0000  1.0
  Sn  Sn4  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd5  4  0.0000  0.3491  0.0000  1.0
  Pd  Pd6  4  0.0000  0.5000  0.3701  1.0
]