data_[Tb8Tm6Zr1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [9.7033]
_cell_length_b [9.7033]
_cell_length_c [5.7485]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Tb8Tm6Zr]
_chemical_formula_sum '[Tb8 Tm6 Zr1]'
_cell_volume [468.7319]
_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  6  0.0514  0.7802  0.2359  1
  Tb  Tb1  2  0.3333  0.6667  0.2367  1
  Tm  Tm2  6  0.0933  0.6194  0.7482  1
  Zr  Zr3  1  0.0000  0.0000  0.5000  1
]