data_[Cs4Rb4Tl12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.0419]
_cell_length_b [18.6674]
_cell_length_c [6.9833]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.9371]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsRbTl3Pd]
_chemical_formula_sum '[Cs4 Rb4 Tl12 Pd4]'
_cell_volume [934.6016]
_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
[
  Cs  Cs0  4  0.0000  0.2450  0.2500  1.0
  Rb  Rb1  4  0.0000  0.3909  0.7500  1.0
  Tl  Tl2  8  0.2497  0.4346  0.3957  1.0
  Tl  Tl3  4  0.0000  0.1601  0.7500  1.0
  Pd  Pd4  4  0.0000  0.0086  0.7500  1.0
]