data_[Mg8In4Ga4Ag20]
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
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.1355]
_cell_length_b [17.1840]
_cell_length_c [12.9277]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Mg2InGaAg5]
_chemical_formula_sum '[Mg8 In4 Ga4 Ag20]'
_cell_volume [696.5604]
_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  0.0000  0.1216  0.3595  1.0
  Mg  Mg1  4  0.0000  0.1232  0.7018  1.0
  In  In2  4  0.0000  0.4549  0.3811  1.0
  Ga  Ga3  4  0.0000  0.2791  0.0329  1.0
  Ag  Ag4  4  0.0000  0.1191  0.0443  1.0
  Ag  Ag5  4  0.0000  0.2881  0.3679  1.0
  Ag  Ag6  4  0.0000  0.2916  0.7005  1.0
  Ag  Ag7  4  0.0000  0.4344  0.0360  1.0
  Ag  Ag8  4  0.0000  0.4608  0.7000  1.0
]