data_[Ce24Bi8As8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Bi  2.0200  1.6000  1.0350
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.1354]
_cell_length_b [6.5158]
_cell_length_c [12.3238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3076]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ce3BiAs]
_chemical_formula_sum '[Ce24 Bi8 As8]'
_cell_volume [1153.8505]
_cell_formula_units_Z [8]
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  8  0.0999  0.1390  0.5852  1
  Ce  Ce1  8  0.1337  0.4083  0.8754  1
  Ce  Ce2  8  0.2029  0.0209  0.8035  1
  Bi  Bi3  8  0.0737  0.3509  0.1256  1
  As  As4  4  0.0000  0.1005  0.7500  1
  As  As5  4  0.2500  0.2500  0.5000  1
]