data_[Tb6P6]
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 [P2/m]
_cell_length_a [19.1615]
_cell_length_b [3.8157]
_cell_length_c [19.1615]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [TbP]
_chemical_formula_sum '[Tb6 P6]'
_cell_volume [1213.2952]
_cell_formula_units_Z [6]
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  0.0781  0.0000  0.5829  1
  Tb  Tb1  2  0.0860  0.0000  0.4081  1
  Tb  Tb2  2  0.2487  0.0000  0.6526  1
  P  P3  2  0.0391  0.5000  0.6646  1
  P  P4  2  0.1724  0.5000  0.7037  1
  P  P5  2  0.1768  0.5000  0.5270  1
]