data_[Sm6As8Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.2733]
_cell_length_b [7.1347]
_cell_length_c [14.2073]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sm3(AsPd)4]
_chemical_formula_sum '[Sm6 As8 Pd8]'
_cell_volume [433.1667]
_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  4  0.0000  0.0000  0.1292  1
  Sm  Sm1  2  0.0000  0.5000  0.0000  1
  As  As2  4  0.0000  0.3041  0.5000  1
  As  As3  4  0.0000  0.5000  0.2154  1
  Pd  Pd4  8  0.0000  0.1988  0.3286  1
]