# generated using pymatgen data_Li4Cr3NiO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.12637721 _cell_length_b 5.89074329 _cell_length_c 10.62229171 _cell_angle_alpha 105.96370510 _cell_angle_beta 85.46103156 _cell_angle_gamma 73.09293087 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Cr3NiO8 _chemical_formula_sum 'Li8 Cr6 Ni2 O16' _cell_volume 290.62546889 _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 0.99998600 0.12504300 0.74993900 1.0 Li Li1 1 0.00062400 0.00218900 0.99573500 1.0 Li Li2 1 0.99944500 0.24787800 0.50426900 1.0 Li Li3 1 0.00046400 0.37486200 0.24997300 1.0 Li Li4 1 0.00001900 0.62495000 0.74994600 1.0 Li Li5 1 0.00400800 0.49323500 0.99917400 1.0 Li Li6 1 0.99623600 0.75673600 0.50083600 1.0 Li Li7 1 0.99940300 0.87532000 0.25019500 1.0 Cr Cr8 1 0.50105600 0.31190000 0.37616100 1.0 Cr Cr9 1 0.50100300 0.55724900 0.87241600 1.0 Cr Cr10 1 0.50050300 0.43508400 0.12323200 1.0 Cr Cr11 1 0.49916700 0.69270000 0.62760500 1.0 Cr Cr12 1 0.49939400 0.81489300 0.37674700 1.0 Cr Cr13 1 0.49885900 0.93811200 0.12382100 1.0 Ni Ni14 1 0.49917200 0.06243800 0.87516200 1.0 Ni Ni15 1 0.50086300 0.18750300 0.62480300 1.0 O O16 1 0.27573400 0.08719100 0.31064500 1.0 O O17 1 0.73030800 0.03199100 0.43437700 1.0 O O18 1 0.27732500 0.34240600 0.81428600 1.0 O O19 1 0.73278000 0.29586700 0.94207900 1.0 O O20 1 0.72417100 0.16282800 0.18934800 1.0 O O21 1 0.26952200 0.21803400 0.06565100 1.0 O O22 1 0.27935100 0.46518600 0.56075900 1.0 O O23 1 0.73296900 0.42280800 0.69349300 1.0 O O24 1 0.27891700 0.58595300 0.31001300 1.0 O O25 1 0.72436500 0.53938000 0.44106500 1.0 O O26 1 0.26719800 0.82718500 0.80653000 1.0 O O27 1 0.72067200 0.78484100 0.93928900 1.0 O O28 1 0.27560300 0.71057700 0.05891900 1.0 O O29 1 0.26721200 0.95404900 0.55792500 1.0 O O30 1 0.72091100 0.66407400 0.18997000 1.0 O O31 1 0.72276300 0.90753700 0.68563800 1.0