data_[Al6Zn4Ga4]
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 [C2/m]
_cell_length_a [12.7953]
_cell_length_b [3.0732]
_cell_length_c [6.4068]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9680]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Al3(ZnGa)2]
_chemical_formula_sum '[Al6 Zn4 Ga4]'
_cell_volume [238.2545]
_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  4  0.2132  0.5000  0.1433  1.0
  Al  Al1  2  0.0000  0.0000  0.0000  1.0
  Zn  Zn2  4  0.0723  0.5000  0.7206  1.0
  Ga  Ga3  4  0.1393  0.0000  0.4316  1.0
]