data_[La4Ag4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ag  1.9300  1.6000  1.0867
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.5698]
_cell_length_b [4.8328]
_cell_length_c [6.5971]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4194]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LaAgPb]
_chemical_formula_sum '[La4 Ag4 Pb4]'
_cell_volume [336.9848]
_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  2  0.2237  0.0000  0.8865  1
  La  La1  2  0.3429  0.5000  0.4455  1
  Ag  Ag2  2  0.0347  0.5000  0.1713  1
  Ag  Ag3  2  0.1440  0.0000  0.3672  1
  Pb  Pb4  2  0.0383  0.5000  0.6413  1
  Pb  Pb5  2  0.4205  0.5000  0.9718  1
]