data_[Mg4Zn6Pd8]
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 [7.9841]
_cell_length_b [4.2223]
_cell_length_c [8.1977]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.6423]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg2Zn3Pd4]
_chemical_formula_sum '[Mg4 Zn6 Pd8]'
_cell_volume [273.8962]
_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  0.1770  0.5000  0.2203  1
  Zn  Zn1  4  0.1549  0.5000  0.5633  1
  Zn  Zn2  2  0.0000  0.0000  0.0000  1
  Pd  Pd3  4  0.0172  0.0000  0.3309  1
  Pd  Pd4  4  0.1626  0.5000  0.8908  1
]