data_[Tb2Tm10Sc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [I4]
_cell_length_a [9.7419]
_cell_length_b [9.7419]
_cell_length_c [6.0943]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [79]
_chemical_formula_structural [TbTm5Sc4]
_chemical_formula_sum '[Tb2 Tm10 Sc8]'
_cell_volume [578.3741]
_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  0.2236  1
  Tm  Tm1  8  0.1460  0.7567  0.9500  1
  Tm  Tm2  2  0.0000  0.0000  0.6804  1
  Sc  Sc3  8  0.0555  0.6429  0.4515  1
]