# generated using pymatgen
data_Li5Ti2Ni5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11241419
_cell_length_b   5.11241419
_cell_length_c   9.78247201
_cell_angle_alpha   85.14783564
_cell_angle_beta   85.14783564
_cell_angle_gamma   120.67373316
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Ti2Ni5O12
_chemical_formula_sum   'Li5 Ti2 Ni5 O12'
_cell_volume   216.67310167
_cell_formula_units_Z   1
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  0.83020300  0.67723000  0.75386200  1
  Li  Li1  1  0.67314500  0.83128200  0.24410300  1
  Li  Li2  1  0.32277000  0.16979700  0.24613800  1
  Li  Li3  1  0.16871800  0.32685500  0.75589700  1
  Li  Li4  1  0.08364300  0.91635700  0.00000000  1
  Ti  Ti5  1  0.75406700  0.24593300  0.00000000  1
  Ti  Ti6  1  0.25229200  0.74770800  0.50000000  1
  Ni  Ni7  1  0.91778500  0.08221500  0.50000000  1
  Ni  Ni8  1  0.00070500  0.50670500  0.24536000  1
  Ni  Ni9  1  0.49329500  0.99929500  0.75464000  1
  Ni  Ni10  1  0.58300400  0.41699600  0.50000000  1
  Ni  Ni11  1  0.41950700  0.58049300  0.00000000  1
  O  O12  1  0.02572500  0.21891000  0.12116000  1
  O  O13  1  0.78109000  0.97427500  0.87884000  1
  O  O14  1  0.88690700  0.38674300  0.61798100  1
  O  O15  1  0.61325700  0.11309300  0.38201900  1
  O  O16  1  0.70066500  0.52149600  0.11777000  1
  O  O17  1  0.47850400  0.29933500  0.88223000  1
  O  O18  1  0.52860400  0.71539500  0.61963400  1
  O  O19  1  0.28460500  0.47139600  0.38036600  1
  O  O20  1  0.39099300  0.87563300  0.11553800  1
  O  O21  1  0.12436700  0.60900700  0.88446200  1
  O  O22  1  0.21465500  0.02850300  0.61974400  1
  O  O23  1  0.97149700  0.78534500  0.38025600  1
