data_[Ba4Mg2In12Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  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 [13.9820]
_cell_length_b [6.2281]
_cell_length_c [9.7332]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.2915]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2MgIn6Ga]
_chemical_formula_sum '[Ba4 Mg2 In12 Ga2]'
_cell_volume [626.9813]
_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
[
  Ba  Ba0  4  0.0151  0.5000  0.2622  1
  Mg  Mg1  2  0.0000  0.0000  0.5000  1
  In  In2  8  0.2490  0.2443  0.2684  1
  In  In3  4  0.1643  0.0000  0.9140  1
  Ga  Ga4  2  0.0000  0.0000  0.0000  1
]