data_[Li1Zn2Sb2]
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
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.3495]
_cell_length_b [4.4313]
_cell_length_c [6.3491]
_cell_angle_alpha [74.8221]
_cell_angle_beta [88.2680]
_cell_angle_gamma [76.4236]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li(ZnSb)2]
_chemical_formula_sum '[Li1 Zn2 Sb2]'
_cell_volume [114.7400]
_cell_formula_units_Z [1]
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  1  0.2910  0.0042  0.0563  1
  Zn  Zn1  1  0.2106  0.2601  0.4963  1
  Zn  Zn2  1  0.6491  0.7289  0.4826  1
  Sb  Sb3  1  0.1451  0.6678  0.7598  1
  Sb  Sb4  1  0.7044  0.3391  0.2050  1
]