# generated using pymatgen data_Bi12PO20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.81932703 _cell_length_b 8.81925740 _cell_length_c 8.81925799 _cell_angle_alpha 109.47115961 _cell_angle_beta 109.47122883 _cell_angle_gamma 109.47116624 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi12PO20 _chemical_formula_sum 'Bi12 P1 O20' _cell_volume 528.05382965 _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 Bi Bi0 1 0.80254337 0.14834312 0.30178301 1.0 Bi Bi1 1 0.85165886 0.65420056 0.15343981 1.0 Bi Bi2 1 0.49924190 0.34580781 0.19746226 1.0 Bi Bi3 1 0.34580186 0.19745913 0.49923946 1.0 Bi Bi4 1 0.65419975 0.15344017 0.85165667 1.0 Bi Bi5 1 0.84656448 0.50076070 0.69822158 1.0 Bi Bi6 1 0.19745951 0.49923841 0.34580045 1.0 Bi Bi7 1 0.69822123 0.84656221 0.50075979 1.0 Bi Bi8 1 0.30177705 0.80253355 0.14834399 1.0 Bi Bi9 1 0.14834206 0.30177915 0.80254077 1.0 Bi Bi10 1 0.50076073 0.69821806 0.84656231 1.0 Bi Bi11 1 0.15343329 0.85165511 0.65419170 1.0 P P12 1 -0.00001049 0.00000988 0.00000649 1.0 O O13 1 0.59688677 0.00000020 0.00000006 1.0 O O14 1 0.75947413 0.37574455 0.11970662 1.0 O O15 1 0.17592841 -0.00000083 -0.00000181 1.0 O O16 1 0.61627223 0.24052974 0.36023545 1.0 O O17 1 0.88029480 0.25603427 0.63976787 1.0 O O18 1 -0.00000120 0.17593090 -0.00000168 1.0 O O19 1 -0.00000157 -0.00000159 0.17592857 1.0 O O20 1 0.74396757 0.62426196 0.38373314 1.0 O O21 1 0.40311443 0.40311438 0.40311297 1.0 O O22 1 0.37574214 0.11970665 0.75947211 1.0 O O23 1 0.62425842 0.38373333 0.74396527 1.0 O O24 1 0.36023106 0.61626204 0.24052384 1.0 O O25 1 0.63976976 0.88029279 0.25603642 1.0 O O26 1 0.00000087 0.59688679 0.00000176 1.0 O O27 1 -0.00000074 0.99999768 0.59688574 1.0 O O28 1 0.24052673 0.36023179 0.61626844 1.0 O O29 1 0.82406985 0.82406991 0.82406769 1.0 O O30 1 0.38373143 0.74396203 0.62425495 1.0 O O31 1 0.11970527 0.75947204 0.37573812 1.0 O O32 1 0.25603504 0.63976349 0.88029416 1.0