data_[Al2Ag4Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.9608]
_cell_length_b [3.2163]
_cell_length_c [5.7340]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.3462]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AlAg2Sb]
_chemical_formula_sum '[Al2 Ag4 Sb2]'
_cell_volume [162.0251]
_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
[
  Al  Al0  2  0.0000  0.5000  0.0000  1
  Ag  Ag1  4  0.2393  0.0000  0.2077  1
  Sb  Sb2  2  0.0000  0.0000  0.5000  1
]