data_[Tb1Dy1P2Ir2Se2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Dy  1.2200  1.7500  1.1310
  P  2.1900  1.0000  0.5500
  Ir  2.2000  1.3500  0.7650
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [4.0104]
_cell_length_b [4.0104]
_cell_length_c [9.3602]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [TbDyP2(IrSe)2]
_chemical_formula_sum '[Tb1 Dy1 P2 Ir2 Se2]'
_cell_volume [150.5447]
_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  0.5000  0.5000  0.2371  1
  Dy  Dy1  1  0.0000  0.0000  0.7623  1
  P  P2  1  0.0000  0.0000  0.3521  1
  P  P3  1  0.5000  0.5000  0.6490  1
  Ir  Ir4  2  0.0000  0.5000  0.5010  1
  Se  Se5  2  0.0000  0.5000  0.9987  1
]