data_[Tb12Sm4Ho4Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.9638]
_cell_length_b [14.9103]
_cell_length_c [9.9706]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Tb3SmHoSc]
_chemical_formula_sum '[Tb12 Sm4 Ho4 Sc4]'
_cell_volume [737.9400]
_cell_formula_units_Z [4]
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  8  0.0000  0.3327  0.5007  1
  Tb  Tb1  4  0.0000  0.1692  0.7500  1
  Sm  Sm2  4  0.0000  0.4975  0.7500  1
  Ho  Ho3  4  0.0000  0.0000  0.0000  1
  Sc  Sc4  4  0.0000  0.1676  0.2500  1
]