data_[Li9Np3U9Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Np  1.3600  1.7500  1.0000
  U  1.3800  1.7500  0.9913
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.7276]
_cell_length_b [8.7276]
_cell_length_c [21.2406]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Li3NpU3Te8]
_chemical_formula_sum '[Li9 Np3 U9 Te24]'
_cell_volume [1401.1621]
_cell_formula_units_Z [3]
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  9  0.0000  0.5000  0.5000  1
  Np  Np1  3  -0.0000  -0.0000  0.0000  1
  U  U2  9  0.0000  0.5000  0.0000  1
  Te  Te3  18  0.0030  0.5015  0.2478  1
  Te  Te4  6  0.0000  0.0000  0.2462  1
]