data_[Li6Sb6P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.2146]
_cell_length_b [4.1230]
_cell_length_c [25.7783]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Li3Sb3P2]
_chemical_formula_sum '[Li6 Sb6 P4]'
_cell_volume [341.6594]
_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  2  0.0000  0.0000  0.0077  1
  Li  Li1  2  0.0000  0.0000  0.2908  1
  Li  Li2  2  0.0000  0.0000  0.8782  1
  Sb  Sb3  2  0.0000  0.0000  0.5701  1
  Sb  Sb4  2  0.0000  0.0000  0.7460  1
  Sb  Sb5  2  0.0000  0.5000  0.6561  1
  P  P6  2  0.0000  0.0000  0.3853  1
  P  P7  2  0.0000  0.5000  0.9429  1
]