data_[Sm6Ho8Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.3626]
_cell_length_b [12.3688]
_cell_length_c [8.7401]
_cell_angle_alpha [90.0000]
_cell_angle_beta [134.9353]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm3(HoTe2)4]
_chemical_formula_sum '[Sm6 Ho8 Te16]'
_cell_volume [946.0851]
_cell_formula_units_Z [2]
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  4  0.2500  0.2500  0.5000  1.0
  Sm  Sm1  2  0.0000  0.5000  0.5000  1.0
  Ho  Ho2  4  0.2500  0.2500  0.0000  1.0
  Ho  Ho3  2  0.0000  0.0000  0.0000  1.0
  Ho  Ho4  2  0.0000  0.0000  0.5000  1.0
  Te  Te5  4  0.0000  0.2471  0.5000  1.0
  Te  Te6  4  0.0000  0.2533  0.0000  1.0
  Te  Te7  4  0.2495  0.5000  0.0058  1.0
  Te  Te8  4  0.2499  0.5000  0.4938  1.0
]