# generated using pymatgen data_Li5Cu3(NiO5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.97920600 _cell_length_b 5.25904157 _cell_length_c 7.48231487 _cell_angle_alpha 105.09080129 _cell_angle_beta 103.26647001 _cell_angle_gamma 103.99056503 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Cu3(NiO5)2 _chemical_formula_sum 'Li5 Cu3 Ni2 O10' _cell_volume 174.39159395 _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 0.20838000 0.89714200 0.39894200 1.0 Li Li1 1 0.39629100 0.28065400 0.78580300 1.0 Li Li2 1 0.50000000 0.50000000 0.50000000 1.0 Li Li3 1 0.60370900 0.71934600 0.21419700 1.0 Li Li4 1 0.79162000 0.10285800 0.60105800 1.0 Cu Cu5 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu6 1 0.69634500 0.88761900 0.89724500 1.0 Cu Cu7 1 0.30365500 0.11238100 0.10275500 1.0 Ni Ni8 1 0.10054900 0.67558400 0.69244000 1.0 Ni Ni9 1 0.89945100 0.32441600 0.30756000 1.0 O O10 1 0.05824600 0.02149500 0.83601400 1.0 O O11 1 0.34048900 0.66843800 0.92425600 1.0 O O12 1 0.12916000 0.33262700 0.54474600 1.0 O O13 1 0.21442200 0.52328400 0.24754000 1.0 O O14 1 0.44363900 0.88024900 0.66317300 1.0 O O15 1 0.55636100 0.11975100 0.33682700 1.0 O O16 1 0.78557800 0.47671600 0.75246000 1.0 O O17 1 0.87084000 0.66737300 0.45525400 1.0 O O18 1 0.65951100 0.33156200 0.07574400 1.0 O O19 1 0.94175400 0.97850500 0.16398600 1.0