data_[Li4Ga4Cu10]
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 [C2/m]
_cell_length_a [12.0799]
_cell_length_b [4.0420]
_cell_length_c [5.1109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2464]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Ga2Cu5]
_chemical_formula_sum '[Li4 Ga4 Cu10]'
_cell_volume [232.5894]
_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  0.0594  0.5000  0.3351  1
  Ga  Ga1  4  0.1224  0.0000  0.6895  1
  Cu  Cu2  4  0.1588  0.5000  0.9921  1
  Cu  Cu3  4  0.2202  0.0000  0.3277  1
  Cu  Cu4  2  0.0000  0.0000  0.0000  1
]