data_[Ce2Nd10Bi12]
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 [C2/m]
_cell_length_a [8.0442]
_cell_length_b [13.9314]
_cell_length_c [8.0392]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4631]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeNd5Bi6]
_chemical_formula_sum '[Ce2 Nd10 Bi12]'
_cell_volume [849.4458]
_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  0.0000  0.0000  0.0000  1.0
  Nd  Nd1  4  0.0000  0.1674  0.5000  1.0
  Nd  Nd2  4  0.0000  0.3337  0.0000  1.0
  Nd  Nd3  2  0.0000  0.5000  0.5000  1.0
  Bi  Bi4  8  0.2481  0.1654  0.2485  1.0
  Bi  Bi5  4  0.2476  0.0000  0.7513  1.0
]