data_[Li10Ni2]
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
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.6254]
_cell_length_b [2.8277]
_cell_length_c [6.6389]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9712]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li5Ni]
_chemical_formula_sum '[Li10 Ni2]'
_cell_volume [189.7397]
_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  0.0419  0.0000  0.5461  1.0
  Li  Li1  2  0.1950  0.5000  0.3377  1.0
  Li  Li2  2  0.2157  0.5000  0.9469  1.0
  Li  Li3  2  0.3553  0.0000  0.6698  1.0
  Li  Li4  2  0.4860  0.5000  0.0614  1.0
  Ni  Ni5  2  0.3732  0.0000  0.2714  1.0
]