# generated using pymatgen
data_Li3TiNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74081361
_cell_length_b   5.93568370
_cell_length_c   10.06899409
_cell_angle_alpha   105.43749167
_cell_angle_beta   106.55597549
_cell_angle_gamma   61.09490703
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3TiNi3O8
_chemical_formula_sum   'Li6 Ti2 Ni6 O16'
_cell_volume   284.51790210
_cell_formula_units_Z   2
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  0.75013900  0.74997900  0.24997200  1
  Li  Li1  1  0.24996300  0.25001000  0.74997700  1
  Li  Li2  1  0.50167400  0.49694600  0.00124500  1
  Li  Li3  1  0.99820500  0.00309100  0.49870600  1
  Li  Li4  1  0.99751900  0.50304600  0.99883400  1
  Li  Li5  1  0.50243000  0.99695300  0.50115200  1
  Ti  Ti6  1  0.00079800  0.99997500  0.99986200  1
  Ti  Ti7  1  0.49899100  0.50002000  0.50001000  1
  Ni  Ni8  1  0.99547200  0.50002900  0.50007200  1
  Ni  Ni9  1  0.25035800  0.74972400  0.75010200  1
  Ni  Ni10  1  0.24996900  0.25009800  0.24990200  1
  Ni  Ni11  1  0.50487900  0.99988900  0.00004600  1
  Ni  Ni12  1  0.75001900  0.25036500  0.25020000  1
  Ni  Ni13  1  0.74993900  0.74999500  0.74995600  1
  O  O14  1  0.87471100  0.34499700  0.12555300  1
  O  O15  1  0.40551500  0.84487500  0.62544900  1
  O  O16  1  0.62499300  0.15512200  0.37442700  1
  O  O17  1  0.09425800  0.65507500  0.87453500  1
  O  O18  1  0.40870900  0.32270100  0.11931500  1
  O  O19  1  0.88781500  0.82284200  0.61932400  1
  O  O20  1  0.09116000  0.17728200  0.38069000  1
  O  O21  1  0.61216800  0.67711200  0.88068000  1
  O  O22  1  0.12802700  0.61448200  0.39113500  1
  O  O23  1  0.62822400  0.11321900  0.88687500  1
  O  O24  1  0.64566600  0.61310800  0.38707200  1
  O  O25  1  0.14891300  0.11438700  0.89115800  1
  O  O26  1  0.85447300  0.88704700  0.11311500  1
  O  O27  1  0.35126400  0.38556400  0.60903400  1
  O  O28  1  0.37202100  0.88530700  0.10863400  1
  O  O29  1  0.87172700  0.38676200  0.61296900  1
