data_[Mg12In10Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8180]
_cell_length_b [9.8218]
_cell_length_c [5.9336]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg6In5Ga]
_chemical_formula_sum '[Mg12 In10 Ga2]'
_cell_volume [561.1151]
_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  8  0.2459  0.1630  0.2482  1.0
  Mg  Mg1  4  0.2462  0.0000  0.7604  1.0
  In  In2  4  0.0000  0.1654  0.5000  1.0
  In  In3  4  0.0000  0.3302  0.0000  1.0
  In  In4  2  0.0000  0.5000  0.5000  1.0
  Ga  Ga5  2  0.0000  0.0000  0.0000  1.0
]