data_[Pm8Tl12Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [11.5063]
_cell_length_b [13.0549]
_cell_length_c [5.8905]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Pm2Tl3Pd5]
_chemical_formula_sum '[Pm8 Tl12 Pd20]'
_cell_volume [884.8378]
_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
[
  Pm  Pm0  8  0.1207  0.2359  0.5000  1
  Tl  Tl1  8  0.1249  0.3649  0.0000  1
  Tl  Tl2  4  0.0000  0.0000  0.2500  1
  Pd  Pd3  8  0.1327  0.1571  0.0000  1
  Pd  Pd4  8  0.2422  0.0000  0.2500  1
  Pd  Pd5  4  0.0000  0.5000  0.2500  1
]