# generated using pymatgen data_Li3CoNi3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.77462404 _cell_length_b 5.79252020 _cell_length_c 14.32579673 _cell_angle_alpha 89.13323763 _cell_angle_beta 90.93204608 _cell_angle_gamma 121.58554588 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3CoNi3O8 _chemical_formula_sum 'Li9 Co3 Ni9 O24' _cell_volume 408.13824005 _cell_formula_units_Z 3 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 0.83322400 0.66656500 0.83332100 1.0 Li Li1 1 0.33335000 0.16680500 0.83330500 1.0 Li Li2 1 0.33329800 0.66656600 0.83329800 1.0 Li Li3 1 0.50017900 0.00062500 0.50030100 1.0 Li Li4 1 0.50100900 0.49746000 0.49934900 1.0 Li Li5 1 0.00014000 0.50034100 0.50152200 1.0 Li Li6 1 0.66642800 0.83283000 0.16518200 1.0 Li Li7 1 0.16654300 0.33277600 0.16637600 1.0 Li Li8 1 0.16560700 0.83572500 0.16737000 1.0 Co Co9 1 0.66847600 0.33363000 0.67007500 1.0 Co Co10 1 0.33336300 0.66664000 0.33335700 1.0 Co Co11 1 0.99824500 0.99970100 0.99663800 1.0 Ni Ni12 1 0.66908800 0.83532600 0.66683500 1.0 Ni Ni13 1 0.16584400 0.33167800 0.66673400 1.0 Ni Ni14 1 0.16769200 0.83494600 0.66398900 1.0 Ni Ni15 1 0.83335200 0.16664900 0.33332600 1.0 Ni Ni16 1 0.83334500 0.66660800 0.33334300 1.0 Ni Ni17 1 0.33332700 0.16661000 0.33332400 1.0 Ni Ni18 1 0.50090500 0.00183000 0.99992000 1.0 Ni Ni19 1 0.49904900 0.49849600 0.00269400 1.0 Ni Ni20 1 0.99744100 0.49799600 0.99979900 1.0 O O21 1 0.64206000 0.33370400 0.93221700 1.0 O O22 1 0.66498700 0.80645600 0.92508100 1.0 O O23 1 0.16929500 0.85660700 0.92731000 1.0 O O24 1 0.18463200 0.33007000 0.92828900 1.0 O O25 1 0.00178400 0.52743000 0.74179900 1.0 O O26 1 0.48272100 0.00388300 0.73811600 1.0 O O27 1 0.49536200 0.47598600 0.73923800 1.0 O O28 1 0.02526900 0.00047200 0.73433300 1.0 O O29 1 0.83339100 0.19497900 0.59906400 1.0 O O30 1 0.83527400 0.64680900 0.59599600 1.0 O O31 1 0.31396600 0.66096800 0.59465300 1.0 O O32 1 0.35275300 0.15924700 0.59240000 1.0 O O33 1 0.65116700 0.84412000 0.40687000 1.0 O O34 1 0.65361400 0.33848400 0.40544000 1.0 O O35 1 0.17400400 0.34969400 0.40521500 1.0 O O36 1 0.16400000 0.80993500 0.40369300 1.0 O O37 1 0.01309900 0.99472100 0.26125300 1.0 O O38 1 0.50281500 0.52332100 0.26301900 1.0 O O39 1 0.49269300 0.98353200 0.26142800 1.0 O O40 1 0.01549800 0.48912600 0.25982600 1.0 O O41 1 0.83078400 0.68615800 0.07097900 1.0 O O42 1 0.83495400 0.13912200 0.06760900 1.0 O O43 1 0.31414100 0.17385100 0.07401700 1.0 O O44 1 0.35184000 0.67151600 0.07210100 1.0