data_[Tb3Ho4Tm5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.0769]
_cell_length_b [7.0249]
_cell_length_c [8.5916]
_cell_angle_alpha [89.9780]
_cell_angle_beta [89.8930]
_cell_angle_gamma [89.8943]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb3Ho4Tm5]
_chemical_formula_sum '[Tb3 Ho4 Tm5]'
_cell_volume [366.7671]
_cell_formula_units_Z [1]
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  0.3333  0.2500  0.1669  1
  Tb  Tb1  1  0.5000  0.5000  0.5000  1
  Ho  Ho2  2  0.1672  0.0001  0.8325  1
  Ho  Ho3  2  0.3326  0.7501  0.1671  1
  Tm  Tm4  2  0.0002  0.7500  0.5001  1
  Tm  Tm5  2  0.1660  0.5000  0.8325  1
  Tm  Tm6  1  0.5000  0.0000  0.5000  1
]