data_[Li2Ni2Mo2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ni  1.9100  1.3500  0.7400
  Mo  2.1600  1.4500  0.7750
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.2175]
_cell_length_b [3.0666]
_cell_length_c [7.2630]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.7104]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiNiMoN3]
_chemical_formula_sum '[Li2 Ni2 Mo2 N6]'
_cell_volume [136.8853]
_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  0.3705  0.7500  0.3488  1
  Ni  Ni1  2  0.1116  0.7500  0.5953  1
  Mo  Mo2  2  0.3075  0.2500  0.8891  1
  N  N3  2  0.1180  0.7500  0.8672  1
  N  N4  2  0.2642  0.2500  0.5615  1
  N  N5  2  0.4372  0.2500  0.1440  1
]