data_[La8Ga8Cu4]
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
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7699]
_cell_length_b [4.6142]
_cell_length_c [11.0006]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.6357]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2Ga2Cu]
_chemical_formula_sum '[La8 Ga8 Cu4]'
_cell_volume [484.3023]
_cell_formula_units_Z [4]
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  4  0.0814  0.0000  0.8874  1.0
  La  La1  4  0.1886  0.5000  0.6661  1.0
  Ga  Ga2  4  0.0827  0.0000  0.4404  1.0
  Ga  Ga3  4  0.1245  0.5000  0.1136  1.0
  Cu  Cu4  4  0.1209  0.5000  0.3508  1.0
]