data_[Sm9Mg3In12Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.8998]
_cell_length_b [8.8998]
_cell_length_c [23.6475]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Sm3Mg(InTe2)4]
_chemical_formula_sum '[Sm9 Mg3 In12 Te24]'
_cell_volume [1622.0962]
_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  9  0.0000  0.5000  0.5000  1.0
  Mg  Mg1  3  -0.0000  -0.0000  0.5000  1.0
  In  In2  9  0.0000  0.5000  0.0000  1.0
  In  In3  3  0.0000  0.0000  0.0000  1.0
  Te  Te4  18  0.0083  0.5041  0.2413  1.0
  Te  Te5  6  0.0000  0.0000  0.2438  1.0
]