data_[La6Fe2Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Fe  1.8300  1.4000  0.8525
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2112]
_cell_length_b [6.9109]
_cell_length_c [7.2616]
_cell_angle_alpha [105.0164]
_cell_angle_beta [100.7548]
_cell_angle_gamma [92.3804]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La3FePb]
_chemical_formula_sum '[La6 Fe2 Pb2]'
_cell_volume [294.4449]
_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
[
  La  La0  2  0.1676  0.8751  0.6461  1
  La  La1  2  0.2972  0.8051  0.1507  1
  La  La2  2  0.3173  0.3541  0.2747  1
  Fe  Fe3  2  0.4532  0.1768  0.5167  1
  Pb  Pb4  2  0.1937  0.3984  0.7615  1
]