data_[Mg2In3Ga4]
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 [P-1]
_cell_length_a [5.4194]
_cell_length_b [5.5326]
_cell_length_c [7.5207]
_cell_angle_alpha [90.4676]
_cell_angle_beta [91.9047]
_cell_angle_gamma [117.6635]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Mg2In3Ga4]
_chemical_formula_sum '[Mg2 In3 Ga4]'
_cell_volume [199.5359]
_cell_formula_units_Z [1]
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  0.0233  0.3149  0.6682  1.0
  In  In1  2  0.3546  0.9579  0.6862  1.0
  In  In2  1  0.0000  0.0000  0.0000  1.0
  Ga  Ga3  2  0.3250  0.6333  0.0154  1.0
  Ga  Ga4  2  0.3271  0.3719  0.3404  1.0
]