data_[Tb2P2Pb1N6]
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
  Pb  2.3300  1.8000  1.1225
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.8985]
_cell_length_b [6.0316]
_cell_length_c [6.3973]
_cell_angle_alpha [101.4016]
_cell_angle_beta [112.7796]
_cell_angle_gamma [110.7481]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb2P2PbN6]
_chemical_formula_sum '[Tb2 P2 Pb1 N6]'
_cell_volume [180.8350]
_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  0.3750  0.7962  0.1736  1.0
  P  P1  2  0.2954  0.2465  0.2347  1.0
  Pb  Pb2  1  0.0000  0.5000  0.5000  1.0
  N  N3  2  0.1045  0.3752  0.1425  1.0
  N  N4  2  0.2998  0.1186  0.4287  1.0
  N  N5  2  0.4920  0.2288  0.1248  1.0
]