data_[Mg14Zn4Pd4]
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 [7.1960]
_cell_length_b [8.1158]
_cell_length_c [7.2944]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2917]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg7(ZnPd)2]
_chemical_formula_sum '[Mg14 Zn4 Pd4]'
_cell_volume [408.8953]
_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  8  0.2066  0.3129  0.1803  1
  Mg  Mg1  4  0.1620  0.0000  0.4216  1
  Mg  Mg2  2  0.0000  0.0000  0.0000  1
  Zn  Zn3  4  0.0000  0.3167  0.5000  1
  Pd  Pd4  4  0.1185  0.5000  0.8324  1
]