data_[Sm24C9S3Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  C  2.5500  0.7000  0.3000
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.6438]
_cell_length_b [7.6438]
_cell_length_c [20.8185]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Sm8C3SCl4]
_chemical_formula_sum '[Sm24 C9 S3 Cl12]'
_cell_volume [1053.4194]
_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
[
  Sm  Sm0  18  0.0226  0.5113  0.2680  1
  Sm  Sm1  6  0.0000  0.0000  0.2695  1
  C  C2  9  0.0000  0.5000  0.0000  1
  S  S3  3  -0.0000  -0.0000  0.0000  1
  Cl  Cl4  9  0.0000  0.5000  0.5000  1
  Cl  Cl5  3  -0.0000  -0.0000  0.5000  1
]