# generated using pymatgen data_Li5Ti2Cu5O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06865373 _cell_length_b 5.06865373 _cell_length_c 9.71972142 _cell_angle_alpha 89.51186562 _cell_angle_beta 89.51186562 _cell_angle_gamma 113.56447755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Ti2Cu5O12 _chemical_formula_sum 'Li5 Ti2 Cu5 O12' _cell_volume 228.86084288 _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 0.84103500 0.67791000 0.25341500 1.0 Li Li1 1 0.68055900 0.85122600 0.74194200 1.0 Li Li2 1 0.32209000 0.15896500 0.74658500 1.0 Li Li3 1 0.14877400 0.31944100 0.25805800 1.0 Li Li4 1 0.08732300 0.91267700 0.50000000 1.0 Ti Ti5 1 0.75541200 0.24458800 0.50000000 1.0 Ti Ti6 1 0.25438900 0.74561100 0.00000000 1.0 Cu Cu7 1 0.92156300 0.07843700 0.00000000 1.0 Cu Cu8 1 0.00112900 0.51208500 0.74790200 1.0 Cu Cu9 1 0.48791500 0.99887100 0.25209800 1.0 Cu Cu10 1 0.58330800 0.41669200 0.00000000 1.0 Cu Cu11 1 0.41508000 0.58492000 0.50000000 1.0 O O12 1 0.01095300 0.20491100 0.63440900 1.0 O O13 1 0.79508900 0.98904700 0.36559100 1.0 O O14 1 0.92091800 0.41739800 0.09797300 1.0 O O15 1 0.58260200 0.07908200 0.90202700 1.0 O O16 1 0.69124200 0.52763200 0.62125100 1.0 O O17 1 0.47236800 0.30875800 0.37874900 1.0 O O18 1 0.52221800 0.69157500 0.12675700 1.0 O O19 1 0.30842500 0.47778200 0.87324300 1.0 O O20 1 0.42738300 0.91438100 0.59873800 1.0 O O21 1 0.08561900 0.57261700 0.40126200 1.0 O O22 1 0.19056700 0.00596000 0.13108400 1.0 O O23 1 0.99404000 0.80943300 0.86891600 1.0