data_[Mg24Ag18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [12.6166]
_cell_length_b [12.6166]
_cell_length_c [5.8154]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Mg4Ag3]
_chemical_formula_sum '[Mg24 Ag18]'
_cell_volume [801.6619]
_cell_formula_units_Z [6]
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  18  0.0508  0.8028  0.1761  1.0
  Mg  Mg1  3  0.0000  0.0000  0.0000  1.0
  Mg  Mg2  3  0.0000  0.0000  0.5000  1.0
  Ag  Ag3  18  0.0494  0.8166  0.6820  1.0
]