# generated using pymatgen data_Bi3P3O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.05798500 _cell_length_b 8.10812200 _cell_length_c 11.49472030 _cell_angle_alpha 84.57050822 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi3P3O13 _chemical_formula_sum 'Bi6 P6 O26' _cell_volume 654.85707012 _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 Bi Bi0 1 0.25000000 0.64150300 0.21099800 1.0 Bi Bi1 1 0.75000000 0.35849700 0.78900200 1.0 Bi Bi2 1 0.25000000 0.21002200 0.45050800 1.0 Bi Bi3 1 0.50000000 0.00000000 0.00000000 1.0 Bi Bi4 1 0.75000000 0.78997800 0.54949200 1.0 Bi Bi5 1 0.00000000 0.00000000 0.00000000 1.0 P P6 1 0.25000000 0.78026300 0.48882300 1.0 P P7 1 0.75000000 0.21973700 0.51117700 1.0 P P8 1 0.25000000 0.25029900 0.77106200 1.0 P P9 1 0.75000000 0.74970100 0.22893800 1.0 P P10 1 0.75000000 0.68439300 0.87864700 1.0 P P11 1 0.25000000 0.31560700 0.12135300 1.0 O O12 1 0.75000000 0.64701500 0.74474900 1.0 O O13 1 0.57240600 0.23704000 0.43394800 1.0 O O14 1 0.25000000 0.18482200 0.65106800 1.0 O O15 1 0.56696300 0.77776800 0.90473200 1.0 O O16 1 0.75000000 0.36631500 0.59338500 1.0 O O17 1 0.75000000 0.12994800 0.91121600 1.0 O O18 1 0.25000000 0.63368500 0.40661500 1.0 O O19 1 0.06696300 0.22223200 0.09526800 1.0 O O20 1 0.25000000 0.94726400 0.40754600 1.0 O O21 1 0.75000000 0.05273600 0.59245400 1.0 O O22 1 0.07363500 0.35504900 0.79494700 1.0 O O23 1 0.25000000 0.87005200 0.08878400 1.0 O O24 1 0.57363500 0.64495100 0.20505300 1.0 O O25 1 0.75000000 0.50491100 0.94162500 1.0 O O26 1 0.75000000 0.81517800 0.34893200 1.0 O O27 1 0.43303700 0.22223200 0.09526800 1.0 O O28 1 0.92759400 0.23704000 0.43394800 1.0 O O29 1 0.42759400 0.76296000 0.56605200 1.0 O O30 1 0.42636500 0.35504900 0.79494700 1.0 O O31 1 0.25000000 0.35298500 0.25525100 1.0 O O32 1 0.75000000 0.90668700 0.13087600 1.0 O O33 1 0.25000000 0.09331300 0.86912400 1.0 O O34 1 0.92636500 0.64495100 0.20505300 1.0 O O35 1 0.93303700 0.77776800 0.90473200 1.0 O O36 1 0.07240600 0.76296000 0.56605200 1.0 O O37 1 0.25000000 0.49508900 0.05837500 1.0