data_[Er12Ir2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.5012]
_cell_length_b [7.2903]
_cell_length_c [11.7696]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.5012]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Er6IrPd2]
_chemical_formula_sum '[Er12 Ir2 Pd4]'
_cell_volume [470.4681]
_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
[
  Er  Er0  4  0.0900  0.1836  0.4320  1.0
  Er  Er1  4  0.2597  0.6753  0.4316  1.0
  Er  Er2  4  0.4002  0.0411  0.2466  1.0
  Pd  Pd3  4  0.1850  0.1160  0.7437  1.0
  Ir  Ir4  2  0.5000  0.0000  0.5000  1.0
]