data_[Sm4Ag12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [5.2707]
_cell_length_b [5.2707]
_cell_length_c [18.5342]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [SmAg3Pd]
_chemical_formula_sum '[Sm4 Ag12 Pd4]'
_cell_volume [514.8927]
_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  4  0.0000  0.0000  0.3107  1
  Ag  Ag1  8  0.0000  0.2480  0.1236  1
  Ag  Ag2  4  0.0000  0.5000  0.5695  1
  Pd  Pd3  2  0.0000  0.0000  0.0000  1
  Pd  Pd4  2  0.0000  0.5000  0.2500  1
]