data_[Al8Zn8Ga20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [13.2451]
_cell_length_b [8.2861]
_cell_length_c [6.0013]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [46]
_chemical_formula_structural [Al2Zn2Ga5]
_chemical_formula_sum '[Al8 Zn8 Ga20]'
_cell_volume [658.6466]
_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
[
  Al  Al0  8  0.1399  0.5242  0.9339  1.0
  Zn  Zn1  4  0.0000  0.0000  0.1158  1.0
  Zn  Zn2  4  0.2500  0.0363  0.8039  1.0
  Ga  Ga3  8  0.0560  0.6863  0.2746  1.0
  Ga  Ga4  8  0.1423  0.2179  0.1086  1.0
  Ga  Ga5  4  0.2500  0.6859  0.6101  1.0
]