data_[Mg2Ir1Pd1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [5.5437]
_cell_length_b [5.5437]
_cell_length_c [4.3853]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [Mg2IrPdO6]
_chemical_formula_sum '[Mg2 Ir1 Pd1 O6]'
_cell_volume [134.7732]
_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
[
  Mg  Mg0  2  0.0000  0.5000  0.9134  1
  Ir  Ir1  1  0.0000  0.0000  0.6155  1
  Pd  Pd2  1  0.5000  0.5000  0.6322  1
  O  O3  4  0.2379  0.2379  0.7501  1
  O  O4  1  0.0000  0.0000  0.2044  1
  O  O5  1  0.5000  0.5000  0.1675  1
]