# generated using pymatgen data_Li4Fe5Cu3O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.91311938 _cell_length_b 5.85010276 _cell_length_c 9.50225371 _cell_angle_alpha 89.98934863 _cell_angle_beta 89.23733091 _cell_angle_gamma 119.62669938 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Fe5Cu3O16 _chemical_formula_sum 'Li4 Fe5 Cu3 O16' _cell_volume 285.69796947 _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 0.32012200 0.66032200 0.89536300 1.0 Li Li1 1 0.00042800 0.00030200 0.99692300 1.0 Li Li2 1 0.01279900 0.00621000 0.49298600 1.0 Li Li3 1 0.67364100 0.33681500 0.39340600 1.0 Fe Fe4 1 0.34206900 0.67096800 0.49114000 1.0 Fe Fe5 1 0.65702400 0.82862400 0.21441300 1.0 Fe Fe6 1 0.65560200 0.32793800 0.99054300 1.0 Fe Fe7 1 0.83109400 0.66158600 0.71555400 1.0 Fe Fe8 1 0.83111600 0.16946600 0.71552100 1.0 Cu Cu9 1 0.16920000 0.82929000 0.21287200 1.0 Cu Cu10 1 0.16937500 0.34016300 0.21281800 1.0 Cu Cu11 1 0.34227200 0.17120300 0.71145000 1.0 O O12 1 0.16698700 0.83388500 0.59637600 1.0 O O13 1 0.04469800 0.52219700 0.34103400 1.0 O O14 1 0.32256900 0.66139600 0.10727800 1.0 O O15 1 0.00856200 0.00409900 0.30264400 1.0 O O16 1 0.01547500 0.00762700 0.80795800 1.0 O O17 1 0.16742800 0.33259000 0.59643000 1.0 O O18 1 0.49313200 0.96586800 0.34260100 1.0 O O19 1 0.49360800 0.52765900 0.34264600 1.0 O O20 1 0.31905000 0.15957700 0.09914200 1.0 O O21 1 0.67916000 0.83949400 0.60023800 1.0 O O22 1 0.51489700 0.48212900 0.84285800 1.0 O O23 1 0.51441700 0.03314800 0.84272000 1.0 O O24 1 0.66303000 0.33151600 0.60382400 1.0 O O25 1 0.81607300 0.66517600 0.09870700 1.0 O O26 1 0.96052700 0.48024700 0.84178700 1.0 O O27 1 0.81564300 0.15080500 0.09860700 1.0