data_[Mg4Zn6Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.1069]
_cell_length_b [4.1388]
_cell_length_c [6.6655]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0075]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg2Zn3Pd2]
_chemical_formula_sum '[Mg4 Zn6 Pd4]'
_cell_volume [236.0676]
_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
[
  Mg  Mg0  4  0.1372  0.0000  0.7708  1.0
  Zn  Zn1  4  0.1234  0.5000  0.4358  1.0
  Zn  Zn2  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd3  4  0.1531  0.0000  0.1961  1.0
]