data_[La10Y2Bi12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Y  1.2200  1.8000  1.0400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.1102]
_cell_length_b [14.0468]
_cell_length_c [8.1087]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4780]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La5YBi6]
_chemical_formula_sum '[La10 Y2 Bi12]'
_cell_volume [870.8956]
_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  0.1690  0.5000  1.0
  La  La1  4  0.0000  0.3342  0.0000  1.0
  La  La2  2  0.0000  0.5000  0.5000  1.0
  Y  Y3  2  0.0000  0.0000  0.0000  1.0
  Bi  Bi4  8  0.2455  0.1638  0.2457  1.0
  Bi  Bi5  4  0.2444  0.0000  0.7517  1.0
]