data_[Mg2In4Ag16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1721]
_cell_length_b [4.2531]
_cell_length_c [6.6650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.1661]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg(InAg4)2]
_chemical_formula_sum '[Mg2 In4 Ag16]'
_cell_volume [413.0713]
_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  2  0.0000  0.5000  0.0000  1
  In  In1  4  0.2228  0.0000  0.6473  1
  Ag  Ag2  4  0.0428  0.0000  0.7301  1
  Ag  Ag3  4  0.0890  0.5000  0.4517  1
  Ag  Ag4  4  0.1350  0.0000  0.1825  1
  Ag  Ag5  4  0.1782  0.5000  0.9133  1
]