data_[La10Pu2Bi12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pu  1.2800  1.7500  0.9675
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.1110]
_cell_length_b [14.0469]
_cell_length_c [8.1118]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4752]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La5PuBi6]
_chemical_formula_sum '[La10 Pu2 Bi12]'
_cell_volume [871.3408]
_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  0.0000  0.1683  0.5000  1
  La  La1  4  0.0000  0.3339  0.0000  1
  La  La2  2  0.0000  0.5000  0.5000  1
  Pu  Pu3  2  0.0000  0.0000  0.0000  1
  Bi  Bi4  8  0.2460  0.1640  0.2464  1
  Bi  Bi5  4  0.2451  0.0000  0.7524  1
]