# generated using pymatgen
data_LiNiO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03553301
_cell_length_b   8.75472308
_cell_length_c   5.05887133
_cell_angle_alpha   90.00706784
_cell_angle_beta   81.05319086
_cell_angle_gamma   150.36628774
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiO2
_chemical_formula_sum   'Li3 Ni3 O6'
_cell_volume   104.68394580
_cell_formula_units_Z   3
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  0.99917300  0.99954400  0.00018100  1
  Li  Li1  1  0.00051900  0.33348600  0.00002700  1
  Li  Li2  1  0.00049500  0.66706400  0.00003200  1
  Ni  Ni3  1  0.99927900  0.16580500  0.49954200  1
  Ni  Ni4  1  0.00041200  0.83399000  0.50004500  1
  Ni  Ni5  1  0.00037700  0.50026800  0.50003300  1
  O  O6  1  0.45886100  0.22935500  0.26929700  1
  O  O7  1  0.51150300  0.92819100  0.27702400  1
  O  O8  1  0.51197300  0.58366100  0.27691700  1
  O  O9  1  0.48911700  0.07184500  0.72246000  1
  O  O10  1  0.48941400  0.41750800  0.72243800  1
  O  O11  1  0.53901400  0.76935200  0.73188900  1
