data_[Tb1Y1B2Pd2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Y  1.2200  1.8000  1.0400
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.7073]
_cell_length_b [3.7073]
_cell_length_c [7.6331]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [TbYB2(PdN)2]
_chemical_formula_sum '[Tb1 Y1 B2 Pd2 N2]'
_cell_volume [104.9073]
_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  0.0000  0.0000  0.8375  1
  Y  Y1  1  0.5000  0.5000  0.1619  1
  B  B2  1  0.0000  0.0000  0.3266  1
  B  B3  1  0.5000  0.5000  0.6737  1
  Pd  Pd4  2  0.0000  0.5000  0.4999  1
  N  N5  1  0.0000  0.0000  0.1396  1
  N  N6  1  0.5000  0.5000  0.8608  1
]