data_[Rb4Pd2Au2I12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.9628]
_cell_length_b [8.1059]
_cell_length_c [8.1650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3931]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb2PdAuI6]
_chemical_formula_sum '[Rb4 Pd2 Au2 I12]'
_cell_volume [753.3446]
_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
[
  Rb  Rb0  4  0.2496  0.0000  0.2501  1.0
  Pd  Pd1  2  0.0000  0.5000  0.0000  1.0
  Au  Au2  2  0.0000  0.0000  0.5000  1.0
  I  I3  8  0.0142  0.2580  0.7735  1.0
  I  I4  4  0.2494  0.5000  0.2774  1.0
]