# generated using pymatgen data_Li4Co3NiO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85268794 _cell_length_b 10.14402436 _cell_length_c 5.85254570 _cell_angle_alpha 72.87120556 _cell_angle_beta 59.84272808 _cell_angle_gamma 72.63029908 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Co3NiO8 _chemical_formula_sum 'Li8 Co6 Ni2 O16' _cell_volume 282.30195427 _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 0.74409200 0.75138000 0.75599400 1.0 Li Li1 1 0.25592100 0.24861800 0.24399500 1.0 Li Li2 1 0.25238700 0.74927900 0.24648000 1.0 Li Li3 1 0.74761400 0.25071100 0.75352600 1.0 Li Li4 1 0.24676900 0.74723000 0.74772000 1.0 Li Li5 1 0.75334000 0.25277000 0.25237100 1.0 Li Li6 1 0.74382900 0.75508000 0.24940000 1.0 Li Li7 1 0.25620500 0.24492100 0.75058600 1.0 Co Co8 1 0.99994700 0.50001700 0.49996700 1.0 Co Co9 1 0.49999500 0.00001400 0.99997300 1.0 Co Co10 1 0.49994500 0.00000700 0.49998700 1.0 Co Co11 1 0.50009900 0.50002500 0.99986400 1.0 Co Co12 1 0.99999700 0.00000600 0.50000500 1.0 Co Co13 1 0.99997900 0.50000800 0.00004000 1.0 Ni Ni14 1 0.49972700 0.49988900 0.50038700 1.0 Ni Ni15 1 0.00001600 0.00021200 0.00010500 1.0 O O16 1 0.14827500 0.61606100 0.11654900 1.0 O O17 1 0.64286400 0.11486600 0.64420300 1.0 O O18 1 0.35712200 0.88515000 0.35571000 1.0 O O19 1 0.85187200 0.38393500 0.88335300 1.0 O O20 1 0.84531800 0.88382800 0.89083700 1.0 O O21 1 0.37979700 0.38640700 0.35026500 1.0 O O22 1 0.10791000 0.61100200 0.63777300 1.0 O O23 1 0.60713600 0.10476900 0.13939300 1.0 O O24 1 0.62149600 0.61115500 0.11672100 1.0 O O25 1 0.14080600 0.10685300 0.61220900 1.0 O O26 1 0.85914400 0.89313400 0.38782900 1.0 O O27 1 0.37852700 0.38876200 0.88329700 1.0 O O28 1 0.39284700 0.89523700 0.86055500 1.0 O O29 1 0.89209400 0.38899600 0.36218300 1.0 O O30 1 0.62022200 0.61346200 0.64957800 1.0 O O31 1 0.15471900 0.11621700 0.10915100 1.0