data_[La8Tb8Sc24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tb  1.1000  1.7500  0.9815
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.5966]
_cell_length_b [12.6624]
_cell_length_c [6.3354]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9098]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaTbSc3]
_chemical_formula_sum '[La8 Tb8 Sc24]'
_cell_volume [1136.6121]
_cell_formula_units_Z [8]
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
[
  La  La0  8  0.1050  0.4243  0.4513  1.0
  Tb  Tb1  4  0.0000  0.0801  0.7500  1.0
  Tb  Tb2  4  0.0000  0.1835  0.2500  1.0
  Sc  Sc3  8  0.1066  0.3081  0.9466  1.0
  Sc  Sc4  8  0.1980  0.0803  0.1416  1.0
  Sc  Sc5  8  0.2032  0.1843  0.6569  1.0
]