data_[Tb13Al2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.6826]
_cell_length_b [8.4689]
_cell_length_c [9.1080]
_cell_angle_alpha [63.6139]
_cell_angle_beta [89.3166]
_cell_angle_gamma [80.2226]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb13Al2]
_chemical_formula_sum '[Tb13 Al2]'
_cell_volume [453.8769]
_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  0.0363  0.4979  0.7038  1.0
  Tb  Tb1  2  0.2295  0.0123  0.5690  1.0
  Tb  Tb2  2  0.2488  0.2079  0.1521  1.0
  Tb  Tb3  2  0.2824  0.6516  0.9566  1.0
  Tb  Tb4  2  0.4455  0.1692  0.8145  1.0
  Tb  Tb5  2  0.4713  0.3994  0.3788  1.0
  Tb  Tb6  1  0.0000  0.0000  0.0000  1.0
  Al  Al7  2  0.1626  0.7788  0.3627  1.0
]