# generated using pymatgen data_Bi3IrO7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.46028818 _cell_length_b 6.94844532 _cell_length_c 7.48512552 _cell_angle_alpha 105.61425731 _cell_angle_beta 89.86631681 _cell_angle_gamma 102.61099657 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi3IrO7 _chemical_formula_sum 'Bi6 Ir2 O14' _cell_volume 315.22299449 _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 0.53223452 0.00655300 0.74571645 1.0 Bi Bi1 1 0.46776548 0.99344700 0.25428355 1.0 Bi Bi2 1 0.26546317 0.50783903 0.87514590 1.0 Bi Bi3 1 0.73453683 0.49216097 0.12485410 1.0 Bi Bi4 1 0.75939945 0.55047002 0.63725483 1.0 Bi Bi5 1 0.24060055 0.44952998 0.36274517 1.0 Ir Ir6 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir7 1 0.00000000 0.00000000 0.00000000 1.0 O O8 1 0.46839234 0.64044293 0.17366708 1.0 O O9 1 0.53160766 0.35955707 0.82633292 1.0 O O10 1 0.27950122 0.94161501 0.95437105 1.0 O O11 1 0.72049878 0.05838499 0.04562895 1.0 O O12 1 0.28003822 0.94150116 0.51474240 1.0 O O13 1 0.71996178 0.05849884 0.48525760 1.0 O O14 1 0.52708998 0.34136322 0.34855492 1.0 O O15 1 0.47291002 0.65863678 0.65144508 1.0 O O16 1 0.88227800 0.70011612 0.95522538 1.0 O O17 1 0.11772200 0.29988388 0.04477462 1.0 O O18 1 0.11324738 0.29926843 0.60638012 1.0 O O19 1 0.88675262 0.70073157 0.39361988 1.0 O O20 1 0.90120911 0.92109196 0.73048615 1.0 O O21 1 0.09879089 0.07890804 0.26951385 1.0