data_[Tb2Sb1N3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sb  2.0500  1.4500  0.8300
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.9336]
_cell_length_b [3.6939]
_cell_length_c [18.3333]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Tb2SbN3]
_chemical_formula_sum '[Tb2 Sb1 N3]'
_cell_volume [401.8396]
_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  1  0.2647  0.5000  0.4280  1
  Tb  Tb1  1  0.8585  0.0000  0.5108  1
  Sb  Sb2  1  0.3901  0.5000  0.5959  1
  N  N3  1  0.0742  0.0000  0.4141  1
  N  N4  1  0.0945  0.5000  0.5447  1
  N  N5  1  0.5905  0.5000  0.5065  1
]