data_[Sc20Co4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Co  1.8800  1.3500  0.7683
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.1485]
_cell_length_b [6.3286]
_cell_length_c [10.5291]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6217]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Sc5CoPb]
_chemical_formula_sum '[Sc20 Co4 Pb4]'
_cell_volume [640.8349]
_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
[
  Sc  Sc0  8  0.1223  0.3180  0.0453  1
  Sc  Sc1  8  0.2152  0.1941  0.6381  1
  Sc  Sc2  4  0.0000  0.0225  0.2500  1
  Co  Co3  4  0.0000  0.0000  0.0000  1
  Pb  Pb4  4  0.0000  0.4677  0.7500  1
]