data_[Tl4In4Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.7227]
_cell_length_b [3.0602]
_cell_length_c [17.9192]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [TlInPd4]
_chemical_formula_sum '[Tl4 In4 Pd16]'
_cell_volume [423.4808]
_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
[
  Tl  Tl0  4  0.2362  0.7500  0.5573  1
  In  In1  4  0.2493  0.2500  0.8092  1
  Pd  Pd2  4  0.0434  0.2500  0.9319  1
  Pd  Pd3  4  0.0658  0.2500  0.2014  1
  Pd  Pd4  4  0.0994  0.2500  0.6742  1
  Pd  Pd5  4  0.1263  0.2500  0.4303  1
]