data_[Li16Zn4Ga4]
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 [Cmc2_1]
_cell_length_a [4.4031]
_cell_length_b [13.6572]
_cell_length_c [6.1687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Li4ZnGa]
_chemical_formula_sum '[Li16 Zn4 Ga4]'
_cell_volume [370.9478]
_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
[
  Li  Li0  4  0.0000  0.0093  0.7942  1.0
  Li  Li1  4  0.0000  0.1759  0.5519  1.0
  Li  Li2  4  0.0000  0.3251  0.8137  1.0
  Li  Li3  4  0.0000  0.4843  0.5542  1.0
  Zn  Zn4  4  0.0000  0.3330  0.2965  1.0
  Ga  Ga5  4  0.0000  0.1621  0.0561  1.0
]