data_[Li12Np9Tc3N24]
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
  Tc  1.9000  1.3500  0.7417
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.5868]
_cell_length_b [6.5868]
_cell_length_c [15.3178]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Li4Np3TcN8]
_chemical_formula_sum '[Li12 Np9 Tc3 N24]'
_cell_volume [575.5333]
_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
  Li  Li1  3  -0.0000  -0.0000  0.5000  1
  Np  Np2  9  0.0000  0.5000  0.0000  1
  Tc  Tc3  3  -0.0000  -0.0000  0.0000  1
  N  N4  18  0.0031  0.5015  0.2620  1
  N  N5  6  0.0000  0.0000  0.2615  1
]