data_[Tb9P9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P6mm]
_cell_length_a [10.9023]
_cell_length_b [10.9023]
_cell_length_c [17.9359]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [183]
_chemical_formula_structural [TbP]
_chemical_formula_sum '[Tb9 P9]'
_cell_volume [1846.2529]
_cell_formula_units_Z [9]
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  0.2240  0.4479  0.4300  1
  Tb  Tb1  3  0.0000  0.5000  0.5741  1
  P  P2  6  0.2518  0.7482  0.5766  1
  P  P3  3  0.0000  0.5000  0.4129  1
]