data_[Li6Zn8Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.3926]
_cell_length_b [4.3997]
_cell_length_c [8.2483]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.4422]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3(Zn2Ga)2]
_chemical_formula_sum '[Li6 Zn8 Ga4]'
_cell_volume [287.6606]
_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  0.1671  0.5000  0.6667  1.0
  Li  Li1  2  0.0000  0.0000  0.0000  1.0
  Zn  Zn2  4  0.0536  0.0000  0.3879  1.0
  Zn  Zn3  4  0.2233  0.5000  0.0556  1.0
  Ga  Ga4  4  0.1102  0.5000  0.2758  1.0
]