data_[Mg60Al48Ag38]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Pm-3]
_cell_length_a [14.1067]
_cell_length_b [14.1067]
_cell_length_c [14.1067]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [200]
_chemical_formula_structural [Mg30Al24Ag19]
_chemical_formula_sum '[Mg60 Al48 Ag38]'
_cell_volume [2807.2122]
_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  24  0.1198  0.1861  0.3083  1
  Mg  Mg1  12  0.0000  0.1788  0.1070  1
  Mg  Mg2  12  0.3252  0.3914  0.5000  1
  Mg  Mg3  6  0.0000  0.0000  0.3820  1
  Mg  Mg4  6  0.1200  0.5000  0.5000  1
  Al  Al5  24  0.1948  0.3969  0.3251  1
  Al  Al6  12  0.0000  0.3343  0.4051  1
  Al  Al7  12  0.0952  0.5000  0.1673  1
  Ag  Ag8  12  0.0000  0.3360  0.2150  1
  Ag  Ag9  12  0.1691  0.2849  0.5000  1
  Ag  Ag10  6  0.0000  0.1671  0.5000  1
  Ag  Ag11  6  0.0000  0.5000  0.3359  1
  Ag  Ag12  1  0.0000  0.0000  0.0000  1
  Ag  Ag13  1  0.5000  0.5000  0.5000  1
]