data_[Li8Zn4P4]
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
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.0864]
_cell_length_b [4.0864]
_cell_length_c [16.6400]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Li2ZnP]
_chemical_formula_sum '[Li8 Zn4 P4]'
_cell_volume [240.6377]
_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  2  0.3333  0.6667  0.0432  1
  Li  Li1  2  0.3333  0.6667  0.2154  1
  Li  Li2  2  0.3333  0.6667  0.5279  1
  Li  Li3  2  0.3333  0.6667  0.7032  1
  Zn  Zn4  2  0.0000  0.0000  0.1555  1
  Zn  Zn5  2  0.0000  0.0000  0.4192  1
  P  P6  2  0.3333  0.6667  0.3678  1
  P  P7  2  0.3333  0.6667  0.8877  1
]