data_[Al2Zn2Ga2]
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 [Pm]
_cell_length_a [6.1537]
_cell_length_b [2.7877]
_cell_length_c [6.2518]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5692]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [AlZnGa]
_chemical_formula_sum '[Al2 Zn2 Ga2]'
_cell_volume [103.3141]
_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  1  0.1989  0.5000  0.9577  1.0
  Al  Al1  1  0.8581  0.0000  0.6465  1.0
  Zn  Zn2  1  0.5263  0.0000  0.2672  1.0
  Zn  Zn3  1  0.6863  0.5000  0.9566  1.0
  Ga  Ga4  1  0.0133  0.0000  0.2701  1.0
  Ga  Ga5  1  0.3688  0.0000  0.6321  1.0
]