data_[Sm12In12Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.2945]
_cell_length_b [16.8379]
_cell_length_c [5.7114]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Sm3In3Pd2]
_chemical_formula_sum '[Sm12 In12 Pd8]'
_cell_volume [797.6657]
_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  0.0350  0.6111  0.6147  1
  Sm  Sm1  4  0.1633  0.7500  0.1481  1
  In  In2  8  0.1841  0.5331  0.1059  1
  In  In3  4  0.1778  0.2500  0.1528  1
  Pd  Pd4  8  0.1025  0.1176  0.8830  1
]