# generated using pymatgen
data_Li5NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77978400
_cell_length_b   9.43203230
_cell_length_c   8.68584373
_cell_angle_alpha   90.00015980
_cell_angle_beta   89.99887519
_cell_angle_gamma   89.99974289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5NiO4
_chemical_formula_sum   'Li20 Ni4 O16'
_cell_volume   391.58456220
_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  0.75000100  0.73221700  0.24999900  1
  Li  Li1  1  0.75000100  0.23217400  0.74999800  1
  Li  Li2  1  0.25000300  0.73217900  0.75000000  1
  Li  Li3  1  0.25000200  0.23221200  0.25000100  1
  Li  Li4  1  0.77563200  0.49601700  0.45446200  1
  Li  Li5  1  0.77563000  0.99601500  0.95450900  1
  Li  Li6  1  0.72437200  0.49601500  0.04553900  1
  Li  Li7  1  0.72437500  0.99601200  0.54549200  1
  Li  Li8  1  0.22437700  0.49601300  0.95450800  1
  Li  Li9  1  0.22437000  0.99601000  0.45446000  1
  Li  Li10  1  0.27563000  0.49601700  0.54549100  1
  Li  Li11  1  0.27563700  0.99601300  0.04553800  1
  Li  Li12  1  0.69400800  0.24804000  0.03575500  1
  Li  Li13  1  0.69404100  0.74803900  0.53571800  1
  Li  Li14  1  0.19404300  0.24803400  0.96427900  1
  Li  Li15  1  0.19400500  0.74804000  0.46424200  1
  Li  Li16  1  0.30599400  0.74804100  0.03576000  1
  Li  Li17  1  0.30595500  0.24803600  0.53572300  1
  Li  Li18  1  0.80595900  0.74803900  0.96427800  1
  Li  Li19  1  0.80598900  0.24803800  0.46424100  1
  Ni  Ni20  1  0.24996200  0.00568500  0.75000600  1
  Ni  Ni21  1  0.74999100  0.50569100  0.75000900  1
  Ni  Ni22  1  0.24998500  0.50571500  0.25000600  1
  Ni  Ni23  1  0.75001300  0.00568400  0.24999400  1
  O  O24  1  0.97694300  0.61804600  0.62164500  1
  O  O25  1  0.97707800  0.11813900  0.12165800  1
  O  O26  1  0.47704900  0.61812000  0.37833100  1
  O  O27  1  0.47696500  0.11805700  0.87835600  1
  O  O28  1  0.02295400  0.61812000  0.12166600  1
  O  O29  1  0.02303600  0.11805900  0.62164100  1
  O  O30  1  0.52306200  0.61804700  0.87835500  1
  O  O31  1  0.52292700  0.11813500  0.37834100  1
  O  O32  1  0.41558400  0.37689300  0.11118000  1
  O  O33  1  0.41565900  0.87689800  0.61121700  1
  O  O34  1  0.91567900  0.37688500  0.88878700  1
  O  O35  1  0.91552200  0.87695200  0.38882200  1
  O  O36  1  0.58447900  0.87695400  0.11117900  1
  O  O37  1  0.58432600  0.37688500  0.61121100  1
  O  O38  1  0.08434700  0.87689700  0.88878300  1
  O  O39  1  0.08441500  0.37689400  0.38881900  1
