data_[Sr12Bi8Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [12.0330]
_cell_length_b [13.6196]
_cell_length_c [6.3682]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Sr3Bi2Pd5]
_chemical_formula_sum '[Sr12 Bi8 Pd20]'
_cell_volume [1043.6440]
_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
[
  Sr  Sr0  8  0.1877  0.3910  0.5000  1
  Sr  Sr1  4  0.0000  0.0000  0.2500  1
  Bi  Bi2  8  0.1758  0.1442  0.5000  1
  Pd  Pd3  8  0.0000  0.2197  0.2500  1
  Pd  Pd4  8  0.0989  0.3608  0.0000  1
  Pd  Pd5  4  0.0000  0.5000  0.2500  1
]