data_[Ce18In24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [14.3900]
_cell_length_b [14.3900]
_cell_length_c [6.6380]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Ce3In4]
_chemical_formula_sum '[Ce18 In24]'
_cell_volume [1190.3863]
_cell_formula_units_Z [6]
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  18  0.0515  0.2213  0.7321  1.0
  In  In1  18  0.0592  0.2619  0.2113  1.0
  In  In2  3  0.0000  -0.0000  0.0000  1.0
  In  In3  3  0.0000  -0.0000  0.5000  1.0
]