# generated using pymatgen
data_Li2(NiO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.75331319
_cell_length_b   5.85285151
_cell_length_c   6.56716798
_cell_angle_alpha   104.86016806
_cell_angle_beta   76.70126353
_cell_angle_gamma   87.48056686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2(NiO2)3
_chemical_formula_sum   'Li4 Ni6 O12'
_cell_volume   206.76072787
_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  1  0.17582400  0.80752500  0.31001900  1
  Li  Li1  1  0.67582200  0.80752500  0.31002000  1
  Li  Li2  1  0.82417900  0.19245100  0.68994300  1
  Li  Li3  1  0.32418100  0.19245100  0.68994200  1
  Ni  Ni4  1  0.50000000  0.99999500  0.00000300  1
  Ni  Ni5  1  0.16392700  0.33208900  0.33097600  1
  Ni  Ni6  1  0.83607500  0.66791800  0.66903300  1
  Ni  Ni7  1  0.00000000  0.99999500  0.00000300  1
  Ni  Ni8  1  0.66392500  0.33208900  0.33097700  1
  Ni  Ni9  1  0.33607500  0.66791800  0.66903200  1
  O  O10  1  0.23689200  0.21519000  0.01730100  1
  O  O11  1  0.73689800  0.21518700  0.01730300  1
  O  O12  1  0.76310600  0.78481400  0.98270500  1
  O  O13  1  0.26310000  0.78481700  0.98270300  1
  O  O14  1  0.90455300  0.08434800  0.30610100  1
  O  O15  1  0.40454600  0.08434700  0.30611000  1
  O  O16  1  0.09544200  0.91565800  0.69391100  1
  O  O17  1  0.59545000  0.91566000  0.69390200  1
  O  O18  1  0.07770900  0.42363600  0.64019900  1
  O  O19  1  0.57772000  0.42364200  0.64018800  1
  O  O20  1  0.92229300  0.57637500  0.35980900  1
  O  O21  1  0.42228200  0.57636800  0.35982000  1
