data_[La12Pb4C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.8394]
_cell_length_b [9.5681]
_cell_length_c [10.1232]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.7434]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La6Pb2C]
_chemical_formula_sum '[La12 Pb4 C2]'
_cell_volume [575.1883]
_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  4  0.1375  0.1202  0.4753  1.0
  La  La1  4  0.3223  0.7444  0.9436  1.0
  La  La2  4  0.3388  0.0445  0.2118  1.0
  Pb  Pb3  4  0.1835  0.0916  0.8192  1.0
  C  C4  2  0.5000  0.0000  0.5000  1.0
]