data_[Tb2Sc4Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sc  1.3600  1.6000  0.8850
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.9473]
_cell_length_b [4.1970]
_cell_length_c [7.2868]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.8173]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb(ScTe2)2]
_chemical_formula_sum '[Tb2 Sc4 Te8]'
_cell_volume [435.2625]
_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
[
  Tb  Tb0  2  0.0000  0.0000  0.0000  1
  Sc  Sc1  4  0.2474  0.5000  0.7279  1
  Te  Te2  4  0.1262  0.0000  0.4653  1
  Te  Te3  4  0.1352  0.5000  0.9670  1
]