data_[La6Bi2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Bi  2.0200  1.6000  1.0350
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3161]
_cell_length_b [4.7104]
_cell_length_c [8.7559]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.1028]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La3BiRu]
_chemical_formula_sum '[La6 Bi2 Ru2]'
_cell_volume [310.5928]
_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  0.0367  0.7500  0.2529  1.0
  La  La1  2  0.3356  0.7500  0.9063  1.0
  La  La2  2  0.3403  0.2500  0.5896  1.0
  Bi  Bi3  2  0.3038  0.2500  0.1843  1.0
  Ru  Ru4  2  0.1007  0.7500  0.6149  1.0
]