data_[Pr2Tm2Zn2Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
  Zn  1.6500  1.3500  0.8800
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.1930]
_cell_length_b [5.8562]
_cell_length_c [8.4747]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [PrTmZnIr2]
_chemical_formula_sum '[Pr2 Tm2 Zn2 Ir4]'
_cell_volume [208.0947]
_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
[
  Pr  Pr0  2  0.0000  0.5000  0.2018  1
  Tm  Tm1  2  0.0000  0.5000  0.7973  1
  Zn  Zn2  2  0.0000  0.0000  0.0040  1
  Ir  Ir3  4  0.0000  0.2317  0.4984  1
]