data_[La12Co4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Co  1.8800  1.3500  0.7683
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [12.4483]
_cell_length_b [7.3650]
_cell_length_c [8.6489]
_cell_angle_alpha [90.0000]
_cell_angle_beta [130.7156]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [La3CoPb]
_chemical_formula_sum '[La12 Co4 Pb4]'
_cell_volume [601.0221]
_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
[
  La  La0  4  0.1324  0.2452  0.2341  1.0
  La  La1  4  0.2174  0.2499  0.8579  1.0
  La  La2  2  0.3947  0.0000  0.6975  1.0
  La  La3  2  0.4393  0.5000  0.3833  1.0
  Co  Co4  2  0.1707  0.5000  0.0548  1.0
  Co  Co5  2  0.4391  0.0000  0.0624  1.0
  Pb  Pb6  2  0.4150  0.5000  0.7478  1.0
  Pb  Pb7  2  0.4416  0.0000  0.3698  1.0
]