data_[K2Pd4Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pd  2.2000  1.4000  0.8462
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.1553]
_cell_length_b [5.7753]
_cell_length_c [10.1763]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.6196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K(PdBr3)2]
_chemical_formula_sum '[K2 Pd4 Br12]'
_cell_volume [614.7696]
_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
[
  K  K0  2  0.0000  0.0000  0.5000  1
  Pd  Pd1  4  0.1750  0.0000  0.0701  1
  Br  Br2  4  0.0336  0.0000  0.1829  1
  Br  Br3  4  0.1360  0.5000  0.6676  1
  Br  Br4  4  0.1941  0.5000  0.0546  1
]