data_[Er3Zn3Ir1Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Zn  1.6500  1.3500  0.8800
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [7.0546]
_cell_length_b [7.0546]
_cell_length_c [3.9188]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [189]
_chemical_formula_structural [Er3Zn3IrRh2]
_chemical_formula_sum '[Er3 Zn3 Ir1 Rh2]'
_cell_volume [168.8996]
_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
[
  Er  Er0  3  0.0000  0.5940  0.0000  1
  Zn  Zn1  3  0.0000  0.2478  0.5000  1
  Ir  Ir2  1  0.0000  0.0000  0.0000  1
  Rh  Rh3  2  0.3333  0.6667  0.5000  1
]