# generated using pymatgen
data_Li3Ti(NiO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89780767
_cell_length_b   5.90359853
_cell_length_c   5.91950147
_cell_angle_alpha   119.91030387
_cell_angle_beta   59.75634118
_cell_angle_gamma   90.45492734
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti(NiO2)4
_chemical_formula_sum   'Li3 Ti1 Ni4 O8'
_cell_volume   145.97082977
_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  0.99998300  0.50002000  0.00000600  1
  Li  Li1  1  0.49994300  0.50002900  0.50001800  1
  Li  Li2  1  0.00001800  0.50000200  0.50001700  1
  Ti  Ti3  1  0.49997900  0.00003700  0.00003400  1
  Ni  Ni4  1  0.00002200  0.99961700  0.99981000  1
  Ni  Ni5  1  0.99998400  0.00010600  0.49992700  1
  Ni  Ni6  1  0.49982600  0.50028900  0.00001200  1
  Ni  Ni7  1  0.50012600  0.99980200  0.50015100  1
  O  O8  1  0.75437400  0.77633700  0.52164200  1
  O  O9  1  0.24569000  0.22358600  0.47831700  1
  O  O10  1  0.23432700  0.77167900  0.50007300  1
  O  O11  1  0.76582800  0.22837600  0.49997600  1
  O  O12  1  0.26962600  0.75383100  0.98395200  1
  O  O13  1  0.73516100  0.76482000  0.00291000  1
  O  O14  1  0.26481400  0.23528200  0.99707900  1
  O  O15  1  0.73029900  0.24618600  0.01607700  1
