data_[La10Ga2Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [7.3454]
_cell_length_b [7.3454]
_cell_length_c [9.2446]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [121]
_chemical_formula_structural [La5GaBi2]
_chemical_formula_sum '[La10 Ga2 Bi4]'
_cell_volume [498.7928]
_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
[
  La  La0  8  0.2298  0.2298  0.7531  1
  La  La1  2  0.0000  0.0000  0.5000  1
  Ga  Ga2  2  0.0000  0.0000  0.0000  1
  Bi  Bi3  4  0.0000  0.5000  0.0000  1
]