data_[Al2In1Ag8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8916]
_cell_length_b [6.0377]
_cell_length_c [7.7671]
_cell_angle_alpha [110.1333]
_cell_angle_beta [105.5842]
_cell_angle_gamma [96.3828]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Al2InAg8]
_chemical_formula_sum '[Al2 In1 Ag8]'
_cell_volume [202.1310]
_cell_formula_units_Z [1]
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
[
  Al  Al0  2  0.1831  0.6508  0.8200  1
  In  In1  1  0.5000  0.0000  0.5000  1
  Ag  Ag2  2  0.1317  0.1334  0.7534  1
  Ag  Ag3  2  0.2260  0.3761  0.4862  1
  Ag  Ag4  2  0.3022  0.5481  0.1402  1
  Ag  Ag5  2  0.3174  0.0646  0.1281  1
]