# generated using pymatgen data_MgBi3O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.60390200 _cell_length_b 10.80786000 _cell_length_c 10.82931100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgBi3O7 _chemical_formula_sum 'Mg4 Bi12 O28' _cell_volume 655.89008886 _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 Mg Mg0 1 0.30955600 0.13810300 0.25000000 1.0 Mg Mg1 1 0.80955600 0.36189700 0.75000000 1.0 Mg Mg2 1 0.69044400 0.86189700 0.75000000 1.0 Mg Mg3 1 0.19044400 0.63810300 0.25000000 1.0 Bi Bi4 1 0.68366500 0.62793200 0.01652900 1.0 Bi Bi5 1 0.18366500 0.87206800 0.98347100 1.0 Bi Bi6 1 0.31633500 0.37206800 0.51652900 1.0 Bi Bi7 1 0.81633500 0.12793200 0.48347100 1.0 Bi Bi8 1 0.73192400 0.85958900 0.25000000 1.0 Bi Bi9 1 0.23192400 0.64041100 0.75000000 1.0 Bi Bi10 1 0.26807600 0.14041100 0.75000000 1.0 Bi Bi11 1 0.76807600 0.35958900 0.25000000 1.0 Bi Bi12 1 0.18366500 0.87206800 0.51652900 1.0 Bi Bi13 1 0.68366500 0.62793200 0.48347100 1.0 Bi Bi14 1 0.81633500 0.12793200 0.01652900 1.0 Bi Bi15 1 0.31633500 0.37206800 0.98347100 1.0 O O16 1 0.01402100 0.22991200 0.87101800 1.0 O O17 1 0.51402100 0.27008800 0.12898200 1.0 O O18 1 0.98597900 0.77008800 0.37101800 1.0 O O19 1 0.48597900 0.72991200 0.62898200 1.0 O O20 1 0.98597900 0.77008800 0.12898200 1.0 O O21 1 0.48597900 0.72991200 0.87101800 1.0 O O22 1 0.01402100 0.22991200 0.62898200 1.0 O O23 1 0.51402100 0.27008800 0.37101800 1.0 O O24 1 0.50999600 0.20911200 0.88105300 1.0 O O25 1 0.00999600 0.29088800 0.11894700 1.0 O O26 1 0.49000400 0.79088800 0.38105300 1.0 O O27 1 0.99000400 0.70911200 0.61894700 1.0 O O28 1 0.49000400 0.79088800 0.11894700 1.0 O O29 1 0.99000400 0.70911200 0.88105300 1.0 O O30 1 0.50999600 0.20911200 0.61894700 1.0 O O31 1 0.00999600 0.29088800 0.38105300 1.0 O O32 1 0.84265300 0.54754400 0.25000000 1.0 O O33 1 0.34265300 0.95245600 0.75000000 1.0 O O34 1 0.15734700 0.45245600 0.75000000 1.0 O O35 1 0.65734700 0.04754400 0.25000000 1.0 O O36 1 0.85404100 0.95609700 0.60001100 1.0 O O37 1 0.35404100 0.54390300 0.39998900 1.0 O O38 1 0.14595900 0.04390300 0.10001100 1.0 O O39 1 0.64595900 0.45609700 0.89998900 1.0 O O40 1 0.14595900 0.04390300 0.39998900 1.0 O O41 1 0.64595900 0.45609700 0.60001100 1.0 O O42 1 0.85404100 0.95609700 0.89998900 1.0 O O43 1 0.35404100 0.54390300 0.10001100 1.0