# generated using pymatgen data_Li4Cu7(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.90643923 _cell_length_b 8.90643923 _cell_length_c 6.25427756 _cell_angle_alpha 80.92774382 _cell_angle_beta 80.92774382 _cell_angle_gamma 103.09423308 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Cu7(PO4)6 _chemical_formula_sum 'Li4 Cu7 P6 O24' _cell_volume 467.42733614 _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 0.72991600 0.72991600 0.52752300 1.0 Li Li1 1 0.54105300 0.28721000 0.53119900 1.0 Li Li2 1 0.28721000 0.54105300 0.53119900 1.0 Li Li3 1 0.05598200 0.05598200 0.51308000 1.0 Cu Cu4 1 0.98527600 0.36011500 0.18148700 1.0 Cu Cu5 1 0.36011500 0.98527600 0.18148700 1.0 Cu Cu6 1 0.62594800 0.37571100 0.99792500 1.0 Cu Cu7 1 0.37571100 0.62594800 0.99792500 1.0 Cu Cu8 1 0.00737500 0.00737500 0.00069800 1.0 Cu Cu9 1 0.65038100 0.00691500 0.81659400 1.0 Cu Cu10 1 0.00691500 0.65038100 0.81659400 1.0 P P11 1 0.28519600 0.90436200 0.71176600 1.0 P P12 1 0.90436200 0.28519600 0.71176600 1.0 P P13 1 0.67162800 0.67162800 0.07167800 1.0 P P14 1 0.32086800 0.32086800 0.92320600 1.0 P P15 1 0.71518500 0.08530700 0.29172700 1.0 P P16 1 0.08530700 0.71518500 0.29172700 1.0 O O17 1 0.58949700 0.76700900 0.91163200 1.0 O O18 1 0.76700900 0.58949700 0.91163200 1.0 O O19 1 0.76911500 0.76911500 0.19940800 1.0 O O20 1 0.97542900 0.38867000 0.86665100 1.0 O O21 1 0.38867000 0.97542900 0.86665100 1.0 O O22 1 0.10380300 0.90142500 0.77202100 1.0 O O23 1 0.90142500 0.10380300 0.77202100 1.0 O O24 1 0.72570600 0.28204000 0.73319700 1.0 O O25 1 0.28204000 0.72570600 0.73319700 1.0 O O26 1 0.53408500 0.53408500 0.21574600 1.0 O O27 1 0.43974300 0.43974300 0.72724700 1.0 O O28 1 0.11010900 0.90023900 0.21725400 1.0 O O29 1 0.90023900 0.11010900 0.21725400 1.0 O O30 1 0.69561800 0.25329100 0.29502100 1.0 O O31 1 0.25329100 0.69561800 0.29502100 1.0 O O32 1 0.66489000 0.96929400 0.51703200 1.0 O O33 1 0.96929400 0.66489000 0.51703200 1.0 O O34 1 0.20526600 0.20526600 0.83685700 1.0 O O35 1 0.61484900 0.01348100 0.13258500 1.0 O O36 1 0.01348100 0.61484900 0.13258500 1.0 O O37 1 0.41687500 0.23535800 0.07087300 1.0 O O38 1 0.23535800 0.41687500 0.07087300 1.0 O O39 1 0.01278900 0.34798500 0.48247700 1.0 O O40 1 0.34798500 0.01278900 0.48247700 1.0