# generated using pymatgen data_Bi(BO2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.70615411 _cell_length_b 4.41383443 _cell_length_c 13.99939899 _cell_angle_alpha 84.61540788 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi(BO2)3 _chemical_formula_sum 'Bi4 B12 O24' _cell_volume 412.55160313 _cell_formula_units_Z 4 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 0.80050372 0.22593749 0.42939387 1.0 Bi Bi1 1 0.19949628 0.77406251 0.57060613 1.0 Bi Bi2 1 0.30050372 0.77406251 0.07060613 1.0 Bi Bi3 1 0.69949628 0.22593749 0.92939387 1.0 B B4 1 0.18822402 0.17248197 0.25293690 1.0 B B5 1 0.81177598 0.82751803 0.74706310 1.0 B B6 1 0.91865836 0.12271829 0.13958380 1.0 B B7 1 0.31177598 0.17248197 0.75293690 1.0 B B8 1 0.24126122 0.34355005 0.91333645 1.0 B B9 1 0.68822402 0.82751803 0.24706310 1.0 B B10 1 0.08134164 0.87728171 0.86041620 1.0 B B11 1 0.41865836 0.87728171 0.36041620 1.0 B B12 1 0.58134164 0.12271829 0.63958380 1.0 B B13 1 0.75873878 0.65644995 0.08666355 1.0 B B14 1 0.74126122 0.65644995 0.58666355 1.0 B B15 1 0.25873878 0.34355005 0.41333645 1.0 O O16 1 0.18977386 0.65951050 0.92769965 1.0 O O17 1 0.56261373 0.84129171 0.59347289 1.0 O O18 1 0.38129289 0.23619159 0.65975874 1.0 O O19 1 0.43738627 0.15870829 0.40652711 1.0 O O20 1 0.86417890 0.65721602 0.67468897 1.0 O O21 1 0.81022614 0.34048950 0.07230035 1.0 O O22 1 0.18258820 0.93558890 0.76735500 1.0 O O23 1 0.63052805 0.76355251 0.00403777 1.0 O O24 1 0.93738627 0.84129171 0.09347289 1.0 O O25 1 0.36417890 0.34278398 0.82531103 1.0 O O26 1 0.68977386 0.34048950 0.57230035 1.0 O O27 1 0.88129289 0.76380841 0.84024126 1.0 O O28 1 0.13582110 0.34278398 0.32531103 1.0 O O29 1 0.63582110 0.65721602 0.17468897 1.0 O O30 1 0.68258820 0.06441110 0.73264500 1.0 O O31 1 0.13052805 0.23644749 0.49596223 1.0 O O32 1 0.36947195 0.23644749 0.99596223 1.0 O O33 1 0.86947195 0.76355251 0.50403777 1.0 O O34 1 0.11870711 0.23619159 0.15975874 1.0 O O35 1 0.06261373 0.15870829 0.90652711 1.0 O O36 1 0.31741180 0.93558890 0.26735500 1.0 O O37 1 0.81741180 0.06441110 0.23264500 1.0 O O38 1 0.31022614 0.65951050 0.42769965 1.0 O O39 1 0.61870711 0.76380841 0.34024126 1.0