# generated using pymatgen data_Cu4(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.56436424 _cell_length_b 8.56436424 _cell_length_c 7.33125404 _cell_angle_alpha 68.52951134 _cell_angle_beta 68.52951134 _cell_angle_gamma 89.17609028 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu4(PO4)3 _chemical_formula_sum 'Cu8 P6 O24' _cell_volume 461.23206483 _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 Cu Cu0 1 0.25636500 0.74363500 0.25000000 1.0 Cu Cu1 1 0.06611800 0.38294700 0.84193100 1.0 Cu Cu2 1 0.49424700 0.50575300 0.75000000 1.0 Cu Cu3 1 0.38294700 0.06611800 0.34193100 1.0 Cu Cu4 1 0.61705300 0.93388200 0.65806900 1.0 Cu Cu5 1 0.50575300 0.49424700 0.25000000 1.0 Cu Cu6 1 0.74363500 0.25636500 0.75000000 1.0 Cu Cu7 1 0.93388200 0.61705300 0.15806900 1.0 P P8 1 0.72565900 0.27434100 0.25000000 1.0 P P9 1 0.88048000 0.65418700 0.61518500 1.0 P P10 1 0.65418700 0.88048000 0.11518500 1.0 P P11 1 0.34581300 0.11952000 0.88481500 1.0 P P12 1 0.11952000 0.34581300 0.38481500 1.0 P P13 1 0.27434100 0.72565900 0.75000000 1.0 O O14 1 0.50995100 0.73426500 0.16773300 1.0 O O15 1 0.18713800 0.19345400 0.86915000 1.0 O O16 1 0.16176500 0.74443300 0.95380400 1.0 O O17 1 0.27040600 0.53346200 0.76158400 1.0 O O18 1 0.19345400 0.18713800 0.36915000 1.0 O O19 1 0.41458900 0.03983700 0.71670200 1.0 O O20 1 0.03983700 0.41458900 0.21670200 1.0 O O21 1 0.25556700 0.83823500 0.54619600 1.0 O O22 1 0.96016300 0.58541100 0.78329800 1.0 O O23 1 0.74443300 0.16176500 0.45380400 1.0 O O24 1 0.99062200 0.31323200 0.61311500 1.0 O O25 1 0.81286200 0.80654600 0.13085000 1.0 O O26 1 0.83823500 0.25556700 0.04619600 1.0 O O27 1 0.72959400 0.46653800 0.23841600 1.0 O O28 1 0.31323200 0.99062200 0.11311500 1.0 O O29 1 0.58541100 0.96016300 0.28329800 1.0 O O30 1 0.68676800 0.00937800 0.88688500 1.0 O O31 1 0.73426500 0.50995100 0.66773300 1.0 O O32 1 0.53346200 0.27040600 0.26158400 1.0 O O33 1 0.80654600 0.81286200 0.63085000 1.0 O O34 1 0.49004900 0.26573500 0.83226700 1.0 O O35 1 0.46653800 0.72959400 0.73841600 1.0 O O36 1 0.26573500 0.49004900 0.33226700 1.0 O O37 1 0.00937800 0.68676800 0.38688500 1.0