# generated using pymatgen data_LiCu5P3O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.24785700 _cell_length_b 8.24237207 _cell_length_c 9.90626032 _cell_angle_alpha 92.35063093 _cell_angle_beta 90.23161270 _cell_angle_gamma 90.35819949 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCu5P3O13 _chemical_formula_sum 'Li2 Cu10 P6 O26' _cell_volume 509.70034918 _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 0.75082600 0.56684200 0.54466900 1.0 Li Li1 1 0.24917400 0.43315800 0.45533100 1.0 Cu Cu2 1 0.49860300 0.86085100 0.21481900 1.0 Cu Cu3 1 0.25683700 0.56771200 0.10256700 1.0 Cu Cu4 1 0.99551400 0.85978400 0.21608400 1.0 Cu Cu5 1 0.00448600 0.14021600 0.78391600 1.0 Cu Cu6 1 0.50139700 0.13914900 0.78518100 1.0 Cu Cu7 1 0.74883100 0.22145700 0.45538600 1.0 Cu Cu8 1 0.74316300 0.43228800 0.89743300 1.0 Cu Cu9 1 0.25116900 0.77854300 0.54461400 1.0 Cu Cu10 1 0.25494500 0.85425900 0.92072200 1.0 Cu Cu11 1 0.74505500 0.14574100 0.07927800 1.0 P P12 1 0.25272300 0.48640000 0.76904100 1.0 P P13 1 0.24978100 0.13196600 0.50781600 1.0 P P14 1 0.74931300 0.84177500 0.88606000 1.0 P P15 1 0.25068700 0.15822500 0.11394000 1.0 P P16 1 0.74727700 0.51360000 0.23095900 1.0 P P17 1 0.75021900 0.86803400 0.49218400 1.0 O O18 1 0.75741200 0.20014700 0.88400400 1.0 O O19 1 0.54316200 0.90138000 0.81265200 1.0 O O20 1 0.75841100 0.65822800 0.87938100 1.0 O O21 1 0.74541200 0.90862400 0.03665900 1.0 O O22 1 0.74869700 0.38540600 0.11118600 1.0 O O23 1 0.95257100 0.62262300 0.21989000 1.0 O O24 1 0.25130300 0.61459400 0.88881400 1.0 O O25 1 0.24947200 0.09231500 0.66351400 1.0 O O26 1 0.75052800 0.90768500 0.33648600 1.0 O O27 1 0.05819700 0.24167000 0.47322900 1.0 O O28 1 0.04506000 0.09161100 0.18487600 1.0 O O29 1 0.25178600 0.96548800 0.43029500 1.0 O O30 1 0.55882400 0.75552900 0.52436700 1.0 O O31 1 0.24258800 0.79985300 0.11599600 1.0 O O32 1 0.54010800 0.61837100 0.22047100 1.0 O O33 1 0.24938700 0.56397500 0.62854600 1.0 O O34 1 0.94180300 0.75833000 0.52677100 1.0 O O35 1 0.74821400 0.03451200 0.56970500 1.0 O O36 1 0.24158900 0.34177200 0.12061900 1.0 O O37 1 0.04742900 0.37737700 0.78011000 1.0 O O38 1 0.95494000 0.90838900 0.81512400 1.0 O O39 1 0.75061300 0.43602500 0.37145400 1.0 O O40 1 0.45989200 0.38162900 0.77952900 1.0 O O41 1 0.25458800 0.09137600 0.96334100 1.0 O O42 1 0.45683800 0.09862000 0.18734800 1.0 O O43 1 0.44117600 0.24447100 0.47563300 1.0