# generated using pymatgen
data_Li2TiNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.98478600
_cell_length_b   8.16497200
_cell_length_c   8.42009200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiNi3O8
_chemical_formula_sum   'Li8 Ti4 Ni12 O32'
_cell_volume   548.95256365
_cell_formula_units_Z   4
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  0.49386700  0.49465500  0.50435000  1
  Li  Li1  1  0.75795800  0.75720600  0.75024700  1
  Li  Li2  1  0.74204200  0.24279400  0.25024700  1
  Li  Li3  1  0.00613300  0.50534500  0.00435000  1
  Li  Li4  1  0.99386700  0.00534500  0.49565000  1
  Li  Li5  1  0.25795800  0.74279400  0.24975300  1
  Li  Li6  1  0.24204200  0.25720600  0.74975300  1
  Li  Li7  1  0.50613300  0.99465500  0.99565000  1
  Ti  Ti8  1  0.63562500  0.38424900  0.87525500  1
  Ti  Ti9  1  0.86437500  0.61575100  0.37525500  1
  Ti  Ti10  1  0.13562500  0.11575100  0.12474500  1
  Ti  Ti11  1  0.36437500  0.88424900  0.62474500  1
  Ni  Ni12  1  0.62489400  0.62900000  0.12124500  1
  Ni  Ni13  1  0.62453900  0.87811600  0.37574200  1
  Ni  Ni14  1  0.62665300  0.12447200  0.62775900  1
  Ni  Ni15  1  0.87334700  0.87552800  0.12775900  1
  Ni  Ni16  1  0.87546100  0.12188400  0.87574200  1
  Ni  Ni17  1  0.87510600  0.37100000  0.62124500  1
  Ni  Ni18  1  0.12489400  0.87100000  0.87875500  1
  Ni  Ni19  1  0.12453900  0.62188400  0.62425800  1
  Ni  Ni20  1  0.12665300  0.37552800  0.37224100  1
  Ni  Ni21  1  0.37334700  0.62447200  0.87224100  1
  Ni  Ni22  1  0.37546100  0.37811600  0.12425800  1
  Ni  Ni23  1  0.37510600  0.12900000  0.37875500  1
  O  O24  1  0.60907100  0.61493800  0.86947500  1
  O  O25  1  0.61050400  0.38960600  0.11062200  1
  O  O26  1  0.61054700  0.11955900  0.40371500  1
  O  O27  1  0.63214400  0.63400600  0.37258800  1
  O  O28  1  0.61897800  0.89558400  0.61754800  1
  O  O29  1  0.63985100  0.85973300  0.13523400  1
  O  O30  1  0.64122700  0.13251000  0.85369200  1
  O  O31  1  0.63792100  0.35659600  0.63722000  1
  O  O32  1  0.86207900  0.64340400  0.13722000  1
  O  O33  1  0.85877300  0.86749000  0.35369200  1
  O  O34  1  0.86014900  0.14026700  0.63523400  1
  O  O35  1  0.88102200  0.10441600  0.11754800  1
  O  O36  1  0.86785600  0.36599400  0.87258800  1
  O  O37  1  0.88945300  0.88044100  0.90371500  1
  O  O38  1  0.88949600  0.61039400  0.61062200  1
  O  O39  1  0.89092900  0.38506200  0.36947500  1
  O  O40  1  0.10907100  0.88506200  0.13052500  1
  O  O41  1  0.11050400  0.11039400  0.88937800  1
  O  O42  1  0.11054700  0.38044100  0.59628500  1
  O  O43  1  0.13214400  0.86599400  0.62741200  1
  O  O44  1  0.11897800  0.60441600  0.38245200  1
  O  O45  1  0.13985100  0.64026700  0.86476600  1
  O  O46  1  0.14122700  0.36749000  0.14630800  1
  O  O47  1  0.13792100  0.14340400  0.36278000  1
  O  O48  1  0.36207900  0.85659600  0.86278000  1
  O  O49  1  0.35877300  0.63251000  0.64630800  1
  O  O50  1  0.36014900  0.35973300  0.36476600  1
  O  O51  1  0.38102200  0.39558400  0.88245200  1
  O  O52  1  0.36785600  0.13400600  0.12741200  1
  O  O53  1  0.38945300  0.61955900  0.09628500  1
  O  O54  1  0.38949600  0.88960600  0.38937800  1
  O  O55  1  0.39092900  0.11493800  0.63052500  1
