data_[La8Tb14Sc2]
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/m]
_cell_length_a [11.5738]
_cell_length_b [5.3869]
_cell_length_c [13.3200]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.8131]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La4Tb7Sc]
_chemical_formula_sum '[La8 Tb14 Sc2]'
_cell_volume [802.8599]
_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
[
  La  La0  4  0.0355  0.0000  0.7816  1
  Tb  Tb1  4  0.0892  0.5000  0.6283  1
  Tb  Tb2  4  0.1371  0.0000  0.4662  1
  La  La3  4  0.1824  0.5000  0.2603  1
  Tb  Tb4  4  0.2316  0.5000  0.9012  1
  Tb  Tb5  2  0.0000  0.5000  0.0000  1
  Sc  Sc6  2  0.0000  0.0000  0.0000  1
]