data_[Tb8Dy2Er2Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Dy  1.2200  1.7500  1.1310
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.0015]
_cell_length_b [7.0117]
_cell_length_c [11.1760]
_cell_angle_alpha [89.9742]
_cell_angle_beta [89.9553]
_cell_angle_gamma [60.0438]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb4DyErSc2]
_chemical_formula_sum '[Tb8 Dy2 Er2 Sc4]'
_cell_volume [475.3631]
_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  0.1685  0.6676  0.7450  1.0
  Tb  Tb1  2  0.1699  0.1640  0.7471  1.0
  Tb  Tb2  2  0.3337  0.8337  0.2557  1.0
  Tb  Tb3  2  0.3359  0.3307  0.2529  1.0
  Dy  Dy4  1  0.0000  0.0000  0.0000  1.0
  Dy  Dy5  1  0.0000  0.5000  0.0000  1.0
  Er  Er6  1  0.0000  0.5000  0.5000  1.0
  Er  Er7  1  0.5000  0.5000  0.0000  1.0
  Sc  Sc8  1  0.0000  0.0000  0.5000  1.0
  Sc  Sc9  1  0.5000  0.0000  0.0000  1.0
  Sc  Sc10  1  0.5000  0.0000  0.5000  1.0
  Sc  Sc11  1  0.5000  0.5000  0.5000  1.0
]