data_[Ce4Nd2Y6Bi12]
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
  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 [7.9077]
_cell_length_b [13.6990]
_cell_length_c [7.8860]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4953]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2Nd(YBi2)3]
_chemical_formula_sum '[Ce4 Nd2 Y6 Bi12]'
_cell_volume [805.2916]
_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  4  0.0000  0.3330  0.0000  1.0
  Nd  Nd1  2  0.0000  0.0000  0.0000  1.0
  Y  Y2  4  0.0000  0.1659  0.5000  1.0
  Y  Y3  2  0.0000  0.5000  0.5000  1.0
  Bi  Bi4  8  0.2469  0.3326  0.7432  1.0
  Bi  Bi5  4  0.2495  0.0000  0.7434  1.0
]