# generated using pymatgen
data_Li5NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15795100
_cell_length_b   9.42174600
_cell_length_c   15.68748800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5NiO4
_chemical_formula_sum   'Li40 Ni8 O32'
_cell_volume   762.36335151
_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
  Li  Li0  1  0.91809700  0.93105200  0.43388400  1
  Li  Li1  1  0.58190300  0.93105200  0.93388400  1
  Li  Li2  1  0.09670700  0.92160100  0.25267000  1
  Li  Li3  1  0.40329300  0.92160100  0.75267000  1
  Li  Li4  1  0.09338700  0.82908900  0.00255900  1
  Li  Li5  1  0.40661300  0.82908900  0.50255900  1
  Li  Li6  1  0.59619500  0.82343300  0.32920300  1
  Li  Li7  1  0.90380500  0.82343300  0.82920300  1
  Li  Li8  1  0.42916600  0.80460500  0.14294400  1
  Li  Li9  1  0.07083400  0.80460500  0.64294400  1
  Li  Li10  1  0.92916600  0.69539500  0.14294400  1
  Li  Li11  1  0.57083400  0.69539500  0.64294400  1
  Li  Li12  1  0.40380500  0.67656700  0.82920300  1
  Li  Li13  1  0.09619500  0.67656700  0.32920300  1
  Li  Li14  1  0.59338700  0.67091100  0.00255900  1
  Li  Li15  1  0.90661300  0.67091100  0.50255900  1
  Li  Li16  1  0.59670700  0.57839900  0.25267000  1
  Li  Li17  1  0.90329300  0.57839900  0.75267000  1
  Li  Li18  1  0.08190300  0.56894800  0.93388400  1
  Li  Li19  1  0.41809700  0.56894800  0.43388400  1
  Li  Li20  1  0.91809700  0.43105200  0.06611600  1
  Li  Li21  1  0.58190300  0.43105200  0.56611600  1
  Li  Li22  1  0.09670700  0.42160100  0.24733000  1
  Li  Li23  1  0.40329300  0.42160100  0.74733000  1
  Li  Li24  1  0.40661300  0.32908900  0.99744100  1
  Li  Li25  1  0.09338700  0.32908900  0.49744100  1
  Li  Li26  1  0.59619500  0.32343300  0.17079700  1
  Li  Li27  1  0.90380500  0.32343300  0.67079700  1
  Li  Li28  1  0.42916600  0.30460500  0.35705600  1
  Li  Li29  1  0.07083400  0.30460500  0.85705600  1
  Li  Li30  1  0.92916600  0.19539500  0.35705600  1
  Li  Li31  1  0.57083400  0.19539500  0.85705600  1
  Li  Li32  1  0.40380500  0.17656700  0.67079700  1
  Li  Li33  1  0.09619500  0.17656700  0.17079700  1
  Li  Li34  1  0.90661300  0.17091100  0.99744100  1
  Li  Li35  1  0.59338700  0.17091100  0.49744100  1
  Li  Li36  1  0.90329300  0.07839900  0.74733000  1
  Li  Li37  1  0.59670700  0.07839900  0.24733000  1
  Li  Li38  1  0.08190300  0.06894800  0.56611600  1
  Li  Li39  1  0.41809700  0.06894800  0.06611600  1
  Ni  Ni40  1  0.82969800  0.96042900  0.12135500  1
  Ni  Ni41  1  0.67030200  0.96042900  0.62135500  1
  Ni  Ni42  1  0.32969800  0.53957100  0.12135500  1
  Ni  Ni43  1  0.17030200  0.53957100  0.62135500  1
  Ni  Ni44  1  0.82969800  0.46042900  0.37864500  1
  Ni  Ni45  1  0.67030200  0.46042900  0.87864500  1
  Ni  Ni46  1  0.32969800  0.03957100  0.37864500  1
  Ni  Ni47  1  0.17030200  0.03957100  0.87864500  1
  O  O48  1  0.18303500  0.95268400  0.12383500  1
  O  O49  1  0.31696500  0.95268400  0.62383500  1
  O  O50  1  0.72761500  0.86395500  0.21924800  1
  O  O51  1  0.77238500  0.86395500  0.71924800  1
  O  O52  1  0.69018700  0.85430500  0.03617100  1
  O  O53  1  0.80981300  0.85430500  0.53617100  1
  O  O54  1  0.27223000  0.85171600  0.87505800  1
  O  O55  1  0.22777000  0.85171600  0.37505800  1
  O  O56  1  0.77223000  0.64828400  0.87505800  1
  O  O57  1  0.72777000  0.64828400  0.37505800  1
  O  O58  1  0.19018700  0.64569500  0.03617100  1
  O  O59  1  0.30981300  0.64569500  0.53617100  1
  O  O60  1  0.22761500  0.63604500  0.21924800  1
  O  O61  1  0.27238500  0.63604500  0.71924800  1
  O  O62  1  0.68303500  0.54731600  0.12383500  1
  O  O63  1  0.81696500  0.54731600  0.62383500  1
  O  O64  1  0.31696500  0.45268400  0.87616500  1
  O  O65  1  0.18303500  0.45268400  0.37616500  1
  O  O66  1  0.72761500  0.36395500  0.28075200  1
  O  O67  1  0.77238500  0.36395500  0.78075200  1
  O  O68  1  0.80981300  0.35430500  0.96382900  1
  O  O69  1  0.69018700  0.35430500  0.46382900  1
  O  O70  1  0.22777000  0.35171600  0.12494200  1
  O  O71  1  0.27223000  0.35171600  0.62494200  1
  O  O72  1  0.77223000  0.14828400  0.62494200  1
  O  O73  1  0.72777000  0.14828400  0.12494200  1
  O  O74  1  0.19018700  0.14569500  0.46382900  1
  O  O75  1  0.30981300  0.14569500  0.96382900  1
  O  O76  1  0.27238500  0.13604500  0.78075200  1
  O  O77  1  0.22761500  0.13604500  0.28075200  1
  O  O78  1  0.68303500  0.04731600  0.37616500  1
  O  O79  1  0.81696500  0.04731600  0.87616500  1
