data_[Ce3Sm9Zn24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Sm  1.1700  1.8500  1.2290
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.5398]
_cell_length_b [5.5398]
_cell_length_c [27.1369]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [CeSm3Zn8]
_chemical_formula_sum '[Ce3 Sm9 Zn24]'
_cell_volume [721.2302]
_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
[
  Ce  Ce0  3  0.0000  0.0000  0.1254  1.0
  Sm  Sm1  3  0.0000  0.0000  0.0017  1.0
  Sm  Sm2  3  0.0000  0.0000  0.4984  1.0
  Sm  Sm3  3  0.0000  0.0000  0.6245  1.0
  Zn  Zn4  9  0.0014  0.5007  0.5627  1.0
  Zn  Zn5  9  0.1668  0.3336  0.3956  1.0
  Zn  Zn6  3  0.0000  0.0000  0.3126  1.0
  Zn  Zn7  3  0.0000  0.0000  0.8126  1.0
]