data_[Li2N12O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0329]
_cell_length_b [13.6156]
_cell_length_c [12.4045]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3693]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li(NO)6]
_chemical_formula_sum '[Li2 N12 O12]'
_cell_volume [1145.3371]
_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  0.0000  1
  N  N1  8  0.0792  0.1846  1.0000  1
  N  N2  4  0.2499  0.5000  0.4943  1
  O  O3  8  0.1775  0.9188  0.5042  1
  O  O4  4  0.2353  0.5000  0.0000  1
]