# generated using pymatgen data_Li2FeCu(PO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.04845300 _cell_length_b 4.71349200 _cell_length_c 10.08066001 _cell_angle_alpha 88.72342458 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2FeCu(PO4)2 _chemical_formula_sum 'Li4 Fe2 Cu2 P4 O16' _cell_volume 287.32158087 _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 0.00000000 0.00000000 0.00000000 1.0 Li Li1 1 0.50000000 0.00000000 0.00000000 1.0 Li Li2 1 0.00000000 0.50000000 0.50000000 1.0 Li Li3 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe4 1 0.75000000 0.47869800 0.78109200 1.0 Fe Fe5 1 0.25000000 0.52130200 0.21890800 1.0 Cu Cu6 1 0.25000000 0.94854100 0.71540800 1.0 Cu Cu7 1 0.75000000 0.05145900 0.28459200 1.0 P P8 1 0.25000000 0.41933600 0.90307300 1.0 P P9 1 0.75000000 0.92074400 0.59306000 1.0 P P10 1 0.25000000 0.07925600 0.40694000 1.0 P P11 1 0.75000000 0.58066400 0.09692700 1.0 O O12 1 0.75000000 0.70780300 0.95356600 1.0 O O13 1 0.25000000 0.74960200 0.89842100 1.0 O O14 1 0.04146200 0.29397400 0.83496500 1.0 O O15 1 0.45853800 0.29397400 0.83496500 1.0 O O16 1 0.54843000 0.77556800 0.66564500 1.0 O O17 1 0.95157000 0.77556800 0.66564500 1.0 O O18 1 0.75000000 0.24415500 0.59631600 1.0 O O19 1 0.25000000 0.19380100 0.55153700 1.0 O O20 1 0.75000000 0.80619900 0.44846300 1.0 O O21 1 0.25000000 0.75584500 0.40368400 1.0 O O22 1 0.04843000 0.22443200 0.33435500 1.0 O O23 1 0.45157000 0.22443200 0.33435500 1.0 O O24 1 0.54146200 0.70602600 0.16503500 1.0 O O25 1 0.95853800 0.70602600 0.16503500 1.0 O O26 1 0.75000000 0.25039800 0.10157900 1.0 O O27 1 0.25000000 0.29219700 0.04643400 1.0