# generated using pymatgen
data_LiNiO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80170725
_cell_length_b   8.13533612
_cell_length_c   5.79488582
_cell_angle_alpha   89.69796465
_cell_angle_beta   90.72061512
_cell_angle_gamma   89.62395763
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiO2
_chemical_formula_sum   'Li8 Ni8 O16'
_cell_volume   273.48043675
_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  0.24931700  0.74937100  0.24655000  1
  Li  Li1  1  0.75146600  0.25026800  0.75255200  1
  Li  Li2  1  0.25282700  0.25012800  0.25114100  1
  Li  Li3  1  0.74548200  0.74971800  0.74932300  1
  Li  Li4  1  0.74950500  0.74769400  0.25245300  1
  Li  Li5  1  0.25191900  0.25264600  0.74841700  1
  Li  Li6  1  0.50260700  0.99996200  0.00236400  1
  Li  Li7  1  0.99679600  0.50089900  0.49656000  1
  Ni  Ni8  1  0.50213900  0.00061700  0.49850000  1
  Ni  Ni9  1  0.99910400  0.00002800  0.00172800  1
  Ni  Ni10  1  0.50143700  0.50073000  0.49842600  1
  Ni  Ni11  1  0.99835900  0.50092100  0.00141200  1
  Ni  Ni12  1  0.75278000  0.25141700  0.25372000  1
  Ni  Ni13  1  0.24609900  0.74901400  0.74560000  1
  Ni  Ni14  1  0.50079100  0.50104600  0.00092300  1
  Ni  Ni15  1  0.00025300  0.99697800  0.50000100  1
  O  O16  1  0.51579900  0.26121000  0.01622100  1
  O  O17  1  0.01324500  0.76448500  0.51330500  1
  O  O18  1  0.99065600  0.22996500  0.49072500  1
  O  O19  1  0.47854700  0.74121900  0.97860000  1
  O  O20  1  0.76819700  0.99340000  0.26868400  1
  O  O21  1  0.24097800  0.51661600  0.74397200  1
  O  O22  1  0.75622100  0.50626700  0.25325700  1
  O  O23  1  0.23656200  0.98506900  0.73532700  1
  O  O24  1  0.26531000  0.50034400  0.22971400  1
  O  O25  1  0.77310800  0.99926600  0.73416000  1
  O  O26  1  0.51710300  0.25611200  0.48784900  1
  O  O27  1  0.01704300  0.74744200  0.97752900  1
  O  O28  1  0.22817300  0.99855800  0.26660800  1
  O  O29  1  0.73422100  0.50046400  0.76993100  1
  O  O30  1  0.98783700  0.25348900  0.01650700  1
  O  O31  1  0.47611900  0.74466000  0.51793800  1
