data_[Nd10Zn10Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8166]
_cell_length_b [4.3326]
_cell_length_c [11.4989]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.0986]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd5Zn5Ir2]
_chemical_formula_sum '[Nd10 Zn10 Ir4]'
_cell_volume [575.3750]
_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
[
  Nd  Nd0  4  0.1190  0.5000  0.9148  1
  Nd  Nd1  4  0.1960  0.5000  0.3175  1
  Nd  Nd2  2  0.0000  0.5000  0.5000  1
  Zn  Zn3  4  0.0574  0.0000  0.3428  1
  Zn  Zn4  4  0.2335  0.0000  0.1766  1
  Zn  Zn5  2  0.0000  0.0000  0.0000  1
  Ir  Ir6  4  0.1519  0.0000  0.7602  1
]