data_[Mg2Al2Ga2]
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 [P2/m]
_cell_length_a [4.9435]
_cell_length_b [3.0692]
_cell_length_c [7.3375]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.8851]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [MgAlGa]
_chemical_formula_sum '[Mg2 Al2 Ga2]'
_cell_volume [110.7406]
_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
[
  Mg  Mg0  2  0.2231  0.5000  0.3469  1.0
  Al  Al1  1  0.0000  0.0000  0.0000  1.0
  Al  Al2  1  0.5000  0.5000  0.0000  1.0
  Ga  Ga3  2  0.2834  0.0000  0.6970  1.0
]