data_[Bi4Pd8Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.9425]
_cell_length_b [7.2366]
_cell_length_c [7.5256]
_cell_angle_alpha [64.3750]
_cell_angle_beta [83.3997]
_cell_angle_gamma [61.7878]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Bi2Pd4Pb]
_chemical_formula_sum '[Bi4 Pd8 Pb2]'
_cell_volume [298.4912]
_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
[
  Bi  Bi0  1  0.2277  0.0881  0.2945  1.0
  Bi  Bi1  1  0.6094  0.3865  0.2677  1.0
  Bi  Bi2  1  0.6146  0.9135  0.8324  1.0
  Bi  Bi3  1  0.7759  0.7091  0.4742  1.0
  Pd  Pd4  1  0.1230  0.2514  0.5980  1.0
  Pd  Pd5  1  0.2199  0.6565  0.3778  1.0
  Pd  Pd6  1  0.3945  0.7553  0.7002  1.0
  Pd  Pd7  1  0.6254  0.0974  0.0982  1.0
  Pd  Pd8  1  0.6494  0.3399  0.6577  1.0
  Pd  Pd9  1  0.8424  0.3948  0.9322  1.0
  Pd  Pd10  1  0.9354  0.5707  0.1718  1.0
  Pd  Pd11  1  0.9355  0.9613  0.5663  1.0
  Pb  Pb12  1  0.0719  0.9279  0.9588  1.0
  Pb  Pb13  1  0.2248  0.4476  0.8203  1.0
]