data_[Mg4Al8Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Al  1.6100  1.2500  0.6750
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.2430]
_cell_length_b [13.1016]
_cell_length_c [4.9704]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.6126]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Mg(AlGa)2]
_chemical_formula_sum '[Mg4 Al8 Ga8]'
_cell_volume [368.5482]
_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
[
  Mg  Mg0  4  0.0000  0.1527  0.7500  1.0
  Al  Al1  8  0.2407  0.0569  0.4888  1.0
  Ga  Ga2  4  0.0000  0.2621  0.2500  1.0
  Ga  Ga3  4  0.0000  0.3778  0.7500  1.0
]