data_[Li4Ag4P8Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  P  2.1900  1.0000  0.5500
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.6305]
_cell_length_b [13.1828]
_cell_length_c [6.4305]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.8013]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiAg(PSe3)2]
_chemical_formula_sum '[Li4 Ag4 P8 Se24]'
_cell_volume [1048.9017]
_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  0.2280  0.7500  1.0
  Ag  Ag1  4  0.0000  0.2218  0.2500  1.0
  P  P2  8  0.2260  0.4159  0.2563  1.0
  Se  Se3  8  0.0986  0.0757  0.6071  1.0
  Se  Se4  8  0.1460  0.4491  0.5070  1.0
  Se  Se5  8  0.1597  0.2632  0.1425  1.0
]