data_[P4Pd8Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.9693]
_cell_length_b [6.4933]
_cell_length_c [5.8427]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.7795]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [PPd2Pb]
_chemical_formula_sum '[P4 Pd8 Pb4]'
_cell_volume [302.3158]
_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
[
  P  P0  4  0.3833  0.0538  0.6994  1.0
  Pd  Pd1  4  0.2079  0.2131  0.9782  1.0
  Pd  Pd2  4  0.4260  0.7044  0.5083  1.0
  Pb  Pb3  4  0.1129  0.6154  0.7791  1.0
]