data_[K2Bi12Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.9761]
_cell_length_b [9.5688]
_cell_length_c [10.3206]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [K(BiPd)6]
_chemical_formula_sum '[K2 Bi12 Pd12]'
_cell_volume [590.1726]
_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  0.0000  1
  Bi  Bi1  4  0.0000  0.0000  0.3375  1
  Bi  Bi2  4  0.0000  0.3376  0.0000  1
  Bi  Bi3  4  0.0000  0.5000  0.3294  1
  Pd  Pd4  8  0.2500  0.2500  0.2500  1
  Pd  Pd5  4  0.0000  0.2515  0.5000  1
]