data_[Al4Zn2Ga8]
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 [P2_1/m]
_cell_length_a [6.2716]
_cell_length_b [5.2930]
_cell_length_c [8.0804]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6794]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Al2ZnGa4]
_chemical_formula_sum '[Al4 Zn2 Ga8]'
_cell_volume [255.5617]
_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  0.2418  0.7500  0.9896  1.0
  Al  Al1  2  0.3598  0.7500  0.4472  1.0
  Zn  Zn2  2  0.1938  0.2500  0.1845  1.0
  Ga  Ga3  4  0.4135  0.0005  0.7642  1.0
  Ga  Ga4  2  0.0484  0.2500  0.8196  1.0
  Ga  Ga5  2  0.0782  0.2500  0.4698  1.0
]