data_[Li4Ga10Cu2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.3805]
_cell_length_b [8.4436]
_cell_length_c [5.5037]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9939]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li2Ga5Cu]
_chemical_formula_sum '[Li4 Ga10 Cu2]'
_cell_volume [270.8856]
_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
[
  Li  Li0  4  0.4574  0.2847  0.4894  1.0
  Ga  Ga1  4  0.4859  0.2205  0.0084  1.0
  Ga  Ga2  2  0.1178  0.5000  0.3626  1.0
  Ga  Ga3  2  0.2703  0.5000  0.8811  1.0
  Ga  Ga4  2  0.3112  0.0000  0.6373  1.0
  Cu  Cu5  2  0.1910  0.0000  0.1222  1.0
]