data_[Tb4Ce2Nd6P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ce  1.1200  1.8500  1.0800
  Nd  1.1400  1.8500  1.2765
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0833]
_cell_length_b [12.2665]
_cell_length_c [7.0926]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4389]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb2Ce(NdP2)3]
_chemical_formula_sum '[Tb4 Ce2 Nd6 P12]'
_cell_volume [581.1222]
_cell_formula_units_Z [2]
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  4  0.0000  0.3335  0.0000  1.0
  Ce  Ce1  2  0.0000  0.0000  0.0000  1.0
  Nd  Nd2  4  0.0000  0.1669  0.5000  1.0
  Nd  Nd3  2  0.0000  0.5000  0.5000  1.0
  P  P4  8  0.2463  0.1659  0.2411  1.0
  P  P5  4  0.2484  0.5000  0.2404  1.0
]