data_[La8W8N24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  W  2.3600  1.3500  0.7667
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.9673]
_cell_length_b [10.1822]
_cell_length_c [6.4167]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0036]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaWN3]
_chemical_formula_sum '[La8 W8 N24]'
_cell_volume [677.5072]
_cell_formula_units_Z [8]
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
[
  La  La0  4  0.0000  0.0938  0.2500  1.0
  La  La1  4  0.0000  0.3066  0.7500  1.0
  W  W2  8  0.2087  0.4119  0.2477  1.0
  N  N3  8  0.1139  0.1109  0.6545  1.0
  N  N4  8  0.1310  0.2573  0.1458  1.0
  N  N5  8  0.1518  0.4838  0.4848  1.0
]