# generated using pymatgen
data_Li11Ti12(NiO8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42582406
_cell_length_b   8.42395681
_cell_length_c   8.42511087
_cell_angle_alpha   90.09311244
_cell_angle_beta   89.90385724
_cell_angle_gamma   89.90146096
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li11Ti12(NiO8)4
_chemical_formula_sum   'Li11 Ti12 Ni4 O32'
_cell_volume   598.00155518
_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  0.49816900  0.00157900  0.50160800  1
  Li  Li1  1  0.12506700  0.12330500  0.12675400  1
  Li  Li2  1  0.87351100  0.12338800  0.87466600  1
  Li  Li3  1  0.12710300  0.37698300  0.37513800  1
  Li  Li4  1  0.87345300  0.37507300  0.62315200  1
  Li  Li5  1  0.37645500  0.37490500  0.12668300  1
  Li  Li6  1  0.62495200  0.37304800  0.87702700  1
  Li  Li7  1  0.12487400  0.62651500  0.62342900  1
  Li  Li8  1  0.37660600  0.62664400  0.87495400  1
  Li  Li9  1  0.75168300  0.74839400  0.24819900  1
  Li  Li10  1  0.12293600  0.87509600  0.87272700  1
  Ti  Ti11  1  0.86560700  0.11576200  0.37521400  1
  Ti  Ti12  1  0.12760200  0.11790300  0.62002200  1
  Ti  Ti13  1  0.38224100  0.11971500  0.87227800  1
  Ti  Ti14  1  0.86821300  0.37741900  0.13016200  1
  Ti  Ti15  1  0.62256100  0.37491500  0.37289000  1
  Ti  Ti16  1  0.38015300  0.37257200  0.61833500  1
  Ti  Ti17  1  0.12242600  0.63022500  0.13219400  1
  Ti  Ti18  1  0.87004500  0.63216600  0.87752600  1
  Ti  Ti19  1  0.62516800  0.63425100  0.61557500  1
  Ti  Ti20  1  0.12517700  0.87299600  0.37718000  1
  Ti  Ti21  1  0.38419800  0.87502800  0.13416400  1
  Ti  Ti22  1  0.62693600  0.87720800  0.87506300  1
  Ni  Ni23  1  0.62511500  0.12072700  0.12923300  1
  Ni  Ni24  1  0.12477300  0.37497500  0.87499400  1
  Ni  Ni25  1  0.37928900  0.62932500  0.37494300  1
  Ni  Ni26  1  0.87025400  0.87495300  0.62021300  1
  O  O27  1  0.89513100  0.12717800  0.61120900  1
  O  O28  1  0.10942600  0.11604500  0.38279600  1
  O  O29  1  0.37301000  0.11100800  0.10471200  1
  O  O30  1  0.61708900  0.11428900  0.88524600  1
  O  O31  1  0.87714700  0.14502100  0.13934100  1
  O  O32  1  0.64011000  0.13897300  0.37367700  1
  O  O33  1  0.36394100  0.13600200  0.63576000  1
  O  O34  1  0.13629700  0.12506500  0.85849700  1
  O  O35  1  0.63297700  0.36468500  0.13615000  1
  O  O36  1  0.86610500  0.35942000  0.36736700  1
  O  O37  1  0.14150200  0.36359400  0.62477200  1
  O  O38  1  0.37493600  0.35864600  0.86353500  1
  O  O39  1  0.11348800  0.39132000  0.12524500  1
  O  O40  1  0.87469400  0.38640200  0.89157600  1
  O  O41  1  0.61726300  0.39057800  0.61630300  1
  O  O42  1  0.38602400  0.38543200  0.38298100  1
  O  O43  1  0.10848500  0.62501700  0.88625400  1
  O  O44  1  0.88583800  0.61405100  0.11394400  1
  O  O45  1  0.62365700  0.61100900  0.39011500  1
  O  O46  1  0.38927500  0.60492700  0.62714300  1
  O  O47  1  0.13523300  0.63583800  0.36710200  1
  O  O48  1  0.35478300  0.63898100  0.12284800  1
  O  O49  1  0.63280200  0.63400600  0.85944100  1
  O  O50  1  0.86112300  0.62279600  0.64500300  1
  O  O51  1  0.36087900  0.87352800  0.35993100  1
  O  O52  1  0.14061100  0.86746200  0.13385100  1
  O  O53  1  0.86429100  0.86708900  0.86469400  1
  O  O54  1  0.62643500  0.86005300  0.63903500  1
  O  O55  1  0.88911100  0.88994800  0.37642700  1
  O  O56  1  0.11470700  0.88293200  0.61441000  1
  O  O57  1  0.38380000  0.88258000  0.89053100  1
  O  O58  1  0.60994400  0.87643200  0.11085100  1
