# generated using pymatgen
data_Li3Ti(NiO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90156848
_cell_length_b   8.40379048
_cell_length_c   5.91948926
_cell_angle_alpha   89.69520618
_cell_angle_beta   90.00846867
_cell_angle_gamma   90.00011817
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti(NiO2)4
_chemical_formula_sum   'Li6 Ti2 Ni8 O16'
_cell_volume   293.57613837
_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  0.50000000  0.49999500  0.00000100  1
  Li  Li1  1  0.00000000  0.00000400  0.50000000  1
  Li  Li2  1  0.25004800  0.25031200  0.24992400  1
  Li  Li3  1  0.74995200  0.74968600  0.75007800  1
  Li  Li4  1  0.25004900  0.74969000  0.75008100  1
  Li  Li5  1  0.74995100  0.25030900  0.24992100  1
  Ti  Ti6  1  0.00000000  0.49999400  0.49999800  1
  Ti  Ti7  1  0.50000000  0.00000300  0.00000300  1
  Ni  Ni8  1  0.49999900  0.50000000  0.49999900  1
  Ni  Ni9  1  0.00000000  0.49999700  0.00000000  1
  Ni  Ni10  1  0.50000000  0.00000000  0.49999900  1
  Ni  Ni11  1  0.00000000  0.99999900  0.00000000  1
  Ni  Ni12  1  0.24991600  0.25071600  0.74977200  1
  Ni  Ni13  1  0.75008200  0.74930500  0.25022700  1
  Ni  Ni14  1  0.75008700  0.25071800  0.74976600  1
  Ni  Ni15  1  0.24991600  0.74930300  0.25022900  1
  O  O16  1  0.49998600  0.76226000  0.01048700  1
  O  O17  1  0.99999400  0.26156100  0.51039700  1
  O  O18  1  0.00000600  0.73842800  0.48959100  1
  O  O19  1  0.50001300  0.23774000  0.98952500  1
  O  O20  1  0.50008500  0.24977900  0.51838600  1
  O  O21  1  0.00008800  0.75069500  0.01849800  1
  O  O22  1  0.99991200  0.24929500  0.98151600  1
  O  O23  1  0.49991500  0.75021700  0.48160100  1
  O  O24  1  0.73822900  0.99851300  0.76200800  1
  O  O25  1  0.23804300  0.49866400  0.26203800  1
  O  O26  1  0.26180700  0.99852000  0.76203900  1
  O  O27  1  0.76196100  0.49865500  0.26204800  1
  O  O28  1  0.23804000  0.50134100  0.73795400  1
  O  O29  1  0.73819100  0.00148100  0.23796000  1
  O  O30  1  0.76195600  0.50133200  0.73796400  1
  O  O31  1  0.26177300  0.00148800  0.23799100  1
