data_[Bi8Sb4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.8984]
_cell_length_b [13.0024]
_cell_length_c [7.2917]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1142]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Bi2SbPd3]
_chemical_formula_sum '[Bi8 Sb4 Pd12]'
_cell_volume [528.3944]
_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
[
  Bi  Bi0  4  0.0000  0.1807  0.2500  1.0
  Bi  Bi1  4  0.0000  0.4705  0.2500  1.0
  Sb  Sb2  4  0.0000  0.1552  0.7500  1.0
  Pd  Pd3  8  0.0748  0.3356  0.9549  1.0
  Pd  Pd4  4  0.0000  0.0000  0.0000  1.0
]