data_[La12Ce3Sm9Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ce  1.1200  1.8500  1.0800
  Sm  1.1700  1.8500  1.2290
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [9.0662]
_cell_length_b [9.0662]
_cell_length_c [22.2210]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [La4CeSm3Te8]
_chemical_formula_sum '[La12 Ce3 Sm9 Te24]'
_cell_volume [1581.7745]
_cell_formula_units_Z [3]
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
[
  La  La0  9  0.0000  0.5000  0.5000  1.0
  La  La1  3  -0.0000  -0.0000  0.5000  1.0
  Ce  Ce2  3  0.0000  0.0000  0.0000  1.0
  Sm  Sm3  9  0.0000  0.5000  0.0000  1.0
  Te  Te4  18  0.0013  0.5007  0.2528  1.0
  Te  Te5  6  0.0000  0.0000  0.2531  1.0
]