# generated using pymatgen
data_Li6NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.60063926
_cell_length_b   8.08130338
_cell_length_c   8.08150936
_cell_angle_alpha   109.47817819
_cell_angle_beta   90.03271964
_cell_angle_gamma   89.97227224
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6NiO4
_chemical_formula_sum   'Li24 Ni4 O16'
_cell_volume   406.41046949
_cell_formula_units_Z   4
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  0.24999100  0.47543100  0.22540500  1
  Li  Li1  1  0.24998900  0.97537600  0.72536300  1
  Li  Li2  1  0.24998700  0.22540800  0.97539000  1
  Li  Li3  1  0.24998900  0.72540600  0.47538900  1
  Li  Li4  1  0.75015000  0.52635800  0.77638800  1
  Li  Li5  1  0.74989000  0.02639100  0.27634200  1
  Li  Li6  1  0.74999900  0.77627200  0.02625700  1
  Li  Li7  1  0.75003900  0.27626600  0.52625200  1
  Li  Li8  1  0.03112000  0.64110600  0.10757700  1
  Li  Li9  1  0.03094500  0.14115600  0.60779200  1
  Li  Li10  1  0.03014900  0.85838700  0.89085800  1
  Li  Li11  1  0.03009800  0.35815100  0.39073700  1
  Li  Li12  1  0.46991300  0.64074300  0.10813300  1
  Li  Li13  1  0.46989200  0.14083400  0.60838800  1
  Li  Li14  1  0.46900700  0.85779200  0.89113800  1
  Li  Li15  1  0.46887200  0.35758300  0.39107400  1
  Li  Li16  1  0.53207200  0.13975400  0.10954900  1
  Li  Li17  1  0.53223900  0.63955700  0.60948200  1
  Li  Li18  1  0.53347000  0.35906000  0.89034900  1
  Li  Li19  1  0.53338700  0.85895400  0.39018900  1
  Li  Li20  1  0.96655400  0.14032100  0.10907500  1
  Li  Li21  1  0.96665800  0.64016800  0.60896200  1
  Li  Li22  1  0.96794700  0.35958300  0.88972200  1
  Li  Li23  1  0.96777300  0.85950000  0.38950300  1
  Ni  Ni24  1  0.75006300  0.99613900  0.74615100  1
  Ni  Ni25  1  0.25004300  0.49550300  0.74560100  1
  Ni  Ni26  1  0.24995400  0.99580000  0.24590000  1
  Ni  Ni27  1  0.75000500  0.49647800  0.24626700  1
  O  O28  1  0.01111500  0.60693500  0.35634000  1
  O  O29  1  0.01110800  0.10691900  0.85635000  1
  O  O30  1  0.48885900  0.60636900  0.35692600  1
  O  O31  1  0.48890900  0.10635900  0.85688900  1
  O  O32  1  0.24936300  0.23704000  0.22597400  1
  O  O33  1  0.24942400  0.73705900  0.72585200  1
  O  O34  1  0.25067000  0.47597100  0.98701300  1
  O  O35  1  0.25059300  0.97588300  0.48713000  1
  O  O36  1  0.51648400  0.39519000  0.64565700  1
  O  O37  1  0.51631200  0.89519700  0.14569500  1
  O  O38  1  0.98372100  0.39569200  0.64520100  1
  O  O39  1  0.98362400  0.89570400  0.14523600  1
  O  O40  1  0.74947600  0.76239100  0.77868100  1
  O  O41  1  0.74937600  0.26239900  0.27889200  1
  O  O42  1  0.75060800  0.52890500  0.01234200  1
  O  O43  1  0.75051600  0.02869000  0.51240300  1
