data_[Ce4Nd2Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Nd  1.1400  1.8500  1.2765
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.5685]
_cell_length_b [4.4329]
_cell_length_c [11.9420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2958]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ce2NdBi]
_chemical_formula_sum '[Ce4 Nd2 Bi2]'
_cell_volume [237.9532]
_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
[
  Ce  Ce0  2  0.0058  0.7500  0.8871  1.0
  Ce  Ce1  2  0.3978  0.2500  0.8901  1.0
  Nd  Nd2  2  0.3011  0.7500  0.6113  1.0
  Bi  Bi3  2  0.1762  0.7500  0.3294  1.0
]