# generated using pymatgen
data_Li4Ti2Nb3Ni3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98211046
_cell_length_b   9.78890508
_cell_length_c   10.51692910
_cell_angle_alpha   90.92967897
_cell_angle_beta   89.99934403
_cell_angle_gamma   89.99949163
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti2Nb3Ni3O16
_chemical_formula_sum   'Li8 Ti4 Nb6 Ni6 O32'
_cell_volume   615.77254020
_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  0.50000500  0.89489500  0.16578800  1
  Li  Li1  1  0.00000500  0.89488900  0.66578400  1
  Li  Li2  1  0.49995400  0.98400100  0.48509400  1
  Li  Li3  1  0.99995500  0.98401000  0.98512900  1
  Li  Li4  1  0.50000500  0.50109700  0.49171300  1
  Li  Li5  1  0.00000200  0.50110200  0.99171900  1
  Li  Li6  1  0.00001900  0.40489900  0.33479600  1
  Li  Li7  1  0.50001900  0.40491100  0.83479900  1
  Ti  Ti8  1  0.50003000  0.50776400  0.16969700  1
  Ti  Ti9  1  0.00002900  0.50775400  0.66970400  1
  Ti  Ti10  1  0.99996300  0.98168900  0.35830600  1
  Ti  Ti11  1  0.49996000  0.98171000  0.85826200  1
  Nb  Nb12  1  0.00005300  0.72754400  0.17780200  1
  Nb  Nb13  1  0.50005400  0.72752500  0.67778400  1
  Nb  Nb14  1  0.74864600  0.21788400  0.09124100  1
  Nb  Nb15  1  0.24864000  0.21789100  0.59123300  1
  Nb  Nb16  1  0.25133400  0.21787900  0.09124200  1
  Nb  Nb17  1  0.75133900  0.21788400  0.59123200  1
  Ni  Ni18  1  0.24490200  0.70772800  0.41530000  1
  Ni  Ni19  1  0.74486700  0.70778400  0.91530400  1
  Ni  Ni20  1  0.75524800  0.70769900  0.41527000  1
  Ni  Ni21  1  0.25527900  0.70774600  0.91526900  1
  Ni  Ni22  1  0.99995200  0.20799700  0.82993600  1
  Ni  Ni23  1  0.49995600  0.20801300  0.32996700  1
  O  O24  1  0.49999200  0.34226400  0.01448600  1
  O  O25  1  0.99999100  0.34224900  0.51445500  1
  O  O26  1  0.49999100  0.09514000  0.16371200  1
  O  O27  1  0.99999000  0.09512500  0.66370200  1
  O  O28  1  0.49998800  0.31440600  0.49409300  1
  O  O29  1  0.99998800  0.31438400  0.99407100  1
  O  O30  1  0.00010100  0.79976500  0.00412400  1
  O  O31  1  0.50009900  0.79976300  0.50410900  1
  O  O32  1  0.99998800  0.09507500  0.16483100  1
  O  O33  1  0.49998800  0.09507200  0.66483500  1
  O  O34  1  0.50002300  0.58973400  0.32654100  1
  O  O35  1  0.00002100  0.58974300  0.82653500  1
  O  O36  1  0.00008800  0.60165300  0.32260100  1
  O  O37  1  0.50009000  0.60166700  0.82260700  1
  O  O38  1  0.00001800  0.85076900  0.47871700  1
  O  O39  1  0.50001600  0.85079400  0.97871800  1
  O  O40  1  0.74590000  0.59443700  0.09073800  1
  O  O41  1  0.24592100  0.59441000  0.59071200  1
  O  O42  1  0.25416500  0.59444500  0.09073800  1
  O  O43  1  0.75414600  0.59442100  0.59071300  1
  O  O44  1  0.72571500  0.34197300  0.23424300  1
  O  O45  1  0.22570200  0.34199500  0.73422400  1
  O  O46  1  0.27427900  0.34197600  0.23423600  1
  O  O47  1  0.77428800  0.34199800  0.73421600  1
  O  O48  1  0.22079300  0.84875500  0.25616800  1
  O  O49  1  0.72078500  0.84874900  0.75614600  1
  O  O50  1  0.77923100  0.84873600  0.25614600  1
  O  O51  1  0.27923800  0.84872900  0.75612400  1
  O  O52  1  0.24357300  0.09381000  0.42126200  1
  O  O53  1  0.74357700  0.09377900  0.92128000  1
  O  O54  1  0.75635100  0.09380000  0.42126600  1
  O  O55  1  0.25634600  0.09377000  0.92128400  1
