data_[Mg4Ga8Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [7.4476]
_cell_length_b [11.7238]
_cell_length_c [5.6575]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.5680]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Mg(GaPd2)2]
_chemical_formula_sum '[Mg4 Ga8 Pd16]'
_cell_volume [441.8186]
_cell_formula_units_Z [4]
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  0.1792  0.1161  0.6013  1.0
  Ga  Ga1  4  0.0509  0.4931  0.5634  1.0
  Ga  Ga2  4  0.4336  0.3179  0.3594  1.0
  Pd  Pd3  4  0.0641  0.3108  0.2849  1.0
  Pd  Pd4  4  0.2153  0.3152  0.8620  1.0
  Pd  Pd5  4  0.2941  0.1105  0.1792  1.0
  Pd  Pd6  4  0.4088  0.4730  0.6513  1.0
]