# generated using pymatgen
data_Li5NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.07108700
_cell_length_b   9.15284600
_cell_length_c   9.18443900
_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   762.54964208
_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  0.85651300  0.38805600  0.10925300  1
  Li  Li1  1  0.35651300  0.11194400  0.10925300  1
  Li  Li2  1  0.15955800  0.89005300  0.11795100  1
  Li  Li3  1  0.65955800  0.60994700  0.11795100  1
  Li  Li4  1  0.62615400  0.14823100  0.11894500  1
  Li  Li5  1  0.12615400  0.35176900  0.11894500  1
  Li  Li6  1  0.89633600  0.12347200  0.14730100  1
  Li  Li7  1  0.39633600  0.37652800  0.14730100  1
  Li  Li8  1  0.60532800  0.88109500  0.15604100  1
  Li  Li9  1  0.10532800  0.61890500  0.15604100  1
  Li  Li10  1  0.10532800  0.11890500  0.34395900  1
  Li  Li11  1  0.60532800  0.38109500  0.34395900  1
  Li  Li12  1  0.89633600  0.62347200  0.35269900  1
  Li  Li13  1  0.39633600  0.87652800  0.35269900  1
  Li  Li14  1  0.62615400  0.64823100  0.38105500  1
  Li  Li15  1  0.12615400  0.85176900  0.38105500  1
  Li  Li16  1  0.65955800  0.10994700  0.38204900  1
  Li  Li17  1  0.15955800  0.39005300  0.38204900  1
  Li  Li18  1  0.85651300  0.88805600  0.39074700  1
  Li  Li19  1  0.35651300  0.61194400  0.39074700  1
  Li  Li20  1  0.64348700  0.38805600  0.60925300  1
  Li  Li21  1  0.14348700  0.11194400  0.60925300  1
  Li  Li22  1  0.34044200  0.89005300  0.61795100  1
  Li  Li23  1  0.84044200  0.60994700  0.61795100  1
  Li  Li24  1  0.37384600  0.35176900  0.61894500  1
  Li  Li25  1  0.87384600  0.14823100  0.61894500  1
  Li  Li26  1  0.10366400  0.37652800  0.64730100  1
  Li  Li27  1  0.60366400  0.12347200  0.64730100  1
  Li  Li28  1  0.89467200  0.88109500  0.65604100  1
  Li  Li29  1  0.39467200  0.61890500  0.65604100  1
  Li  Li30  1  0.89467200  0.38109500  0.84395900  1
  Li  Li31  1  0.39467200  0.11890500  0.84395900  1
  Li  Li32  1  0.60366400  0.62347200  0.85269900  1
  Li  Li33  1  0.10366400  0.87652800  0.85269900  1
  Li  Li34  1  0.37384600  0.85176900  0.88105500  1
  Li  Li35  1  0.87384600  0.64823100  0.88105500  1
  Li  Li36  1  0.34044200  0.39005300  0.88204900  1
  Li  Li37  1  0.84044200  0.10994700  0.88204900  1
  Li  Li38  1  0.64348700  0.88805600  0.89074700  1
  Li  Li39  1  0.14348700  0.61194400  0.89074700  1
  Ni  Ni40  1  0.88189200  0.85341400  0.11726800  1
  Ni  Ni41  1  0.38189200  0.64658600  0.11726800  1
  Ni  Ni42  1  0.88189200  0.35341400  0.38273200  1
  Ni  Ni43  1  0.38189200  0.14658600  0.38273200  1
  Ni  Ni44  1  0.61810800  0.85341400  0.61726800  1
  Ni  Ni45  1  0.11810800  0.64658600  0.61726800  1
  Ni  Ni46  1  0.61810800  0.35341400  0.88273200  1
  Ni  Ni47  1  0.11810800  0.14658600  0.88273200  1
  O  O48  1  0.51445000  0.74837800  0.00618600  1
  O  O49  1  0.01445000  0.75162200  0.00618600  1
  O  O50  1  0.75554900  0.99215100  0.03532000  1
  O  O51  1  0.25554900  0.50784900  0.03532000  1
  O  O52  1  0.99930700  0.96582100  0.24537500  1
  O  O53  1  0.49930700  0.53417900  0.24537500  1
  O  O54  1  0.76103500  0.75211600  0.24592300  1
  O  O55  1  0.26103500  0.74788400  0.24592300  1
  O  O56  1  0.76103500  0.25211600  0.25407700  1
  O  O57  1  0.26103500  0.24788400  0.25407700  1
  O  O58  1  0.99930700  0.46582100  0.25462500  1
  O  O59  1  0.49930700  0.03417900  0.25462500  1
  O  O60  1  0.75554900  0.49215100  0.46468000  1
  O  O61  1  0.25554900  0.00784900  0.46468000  1
  O  O62  1  0.51445000  0.24837800  0.49381400  1
  O  O63  1  0.01445000  0.25162200  0.49381400  1
  O  O64  1  0.98555000  0.74837800  0.50618600  1
  O  O65  1  0.48555000  0.75162200  0.50618600  1
  O  O66  1  0.74445100  0.99215100  0.53532000  1
  O  O67  1  0.24445100  0.50784900  0.53532000  1
  O  O68  1  0.50069300  0.96582100  0.74537500  1
  O  O69  1  0.00069300  0.53417900  0.74537500  1
  O  O70  1  0.73896500  0.75211600  0.74592300  1
  O  O71  1  0.23896500  0.74788400  0.74592300  1
  O  O72  1  0.73896500  0.25211600  0.75407700  1
  O  O73  1  0.23896500  0.24788400  0.75407700  1
  O  O74  1  0.50069300  0.46582100  0.75462500  1
  O  O75  1  0.00069300  0.03417900  0.75462500  1
  O  O76  1  0.24445100  0.00784900  0.96468000  1
  O  O77  1  0.74445100  0.49215100  0.96468000  1
  O  O78  1  0.98555000  0.24837800  0.99381400  1
  O  O79  1  0.48555000  0.25162200  0.99381400  1
