# generated using pymatgen data_Li4Cr3NiO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.10989200 _cell_length_b 5.89050263 _cell_length_c 10.20608167 _cell_angle_alpha 89.83011874 _cell_angle_beta 99.60828176 _cell_angle_gamma 106.99762711 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Cr3NiO8 _chemical_formula_sum 'Li8 Cr6 Ni2 O16' _cell_volume 289.31829504 _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 0.00074400 0.24537400 0.25380600 1.0 Li Li1 1 0.99621200 0.24302000 0.74967100 1.0 Li Li2 1 0.00000000 0.00000000 0.00000000 1.0 Li Li3 1 0.00000000 0.00000000 0.50000000 1.0 Li Li4 1 0.00378800 0.75698000 0.25032900 1.0 Li Li5 1 0.99925600 0.75462600 0.74619400 1.0 Li Li6 1 0.00000000 0.50000000 0.00000000 1.0 Li Li7 1 0.00000000 0.50000000 0.50000000 1.0 Cr Cr8 1 0.49953400 0.12392500 0.87333000 1.0 Cr Cr9 1 0.50046600 0.87607500 0.12667000 1.0 Cr Cr10 1 0.50081300 0.62585200 0.87365400 1.0 Cr Cr11 1 0.50049800 0.62866300 0.37769700 1.0 Cr Cr12 1 0.49918700 0.37414800 0.12634600 1.0 Cr Cr13 1 0.49950200 0.37133700 0.62230300 1.0 Ni Ni14 1 0.49897400 0.12485300 0.37473000 1.0 Ni Ni15 1 0.50102600 0.87514700 0.62527000 1.0 O O16 1 0.26957700 0.06503300 0.18520700 1.0 O O17 1 0.26689800 0.07475600 0.69143500 1.0 O O18 1 0.72557900 0.18245100 0.06068300 1.0 O O19 1 0.72299900 0.18585900 0.56381100 1.0 O O20 1 0.27442100 0.81754900 0.93931700 1.0 O O21 1 0.73042300 0.93496700 0.81479300 1.0 O O22 1 0.27700100 0.81414100 0.43618900 1.0 O O23 1 0.73310200 0.92524400 0.30856500 1.0 O O24 1 0.27399600 0.56857200 0.19127100 1.0 O O25 1 0.72357700 0.68123600 0.06025900 1.0 O O26 1 0.27893000 0.56486800 0.68871100 1.0 O O27 1 0.73317700 0.67456000 0.55672800 1.0 O O28 1 0.27642300 0.31876400 0.93974100 1.0 O O29 1 0.72600400 0.43142800 0.80872900 1.0 O O30 1 0.26682300 0.32544000 0.44327200 1.0 O O31 1 0.72107000 0.43513200 0.31128900 1.0