# generated using pymatgen data_MgFeBiO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.20688300 _cell_length_b 9.84667600 _cell_length_c 15.21207900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgFeBiO5 _chemical_formula_sum 'Mg8 Fe8 Bi8 O40' _cell_volume 779.93074228 _cell_formula_units_Z 8 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 0.54507300 0.37615100 0.56500800 1.0 Mg Mg1 1 0.04507300 0.12384900 0.56500800 1.0 Mg Mg2 1 0.04507300 0.62384900 0.93499200 1.0 Mg Mg3 1 0.95492700 0.37615100 0.06500800 1.0 Mg Mg4 1 0.45492700 0.12384900 0.06500800 1.0 Mg Mg5 1 0.95492700 0.87615100 0.43499200 1.0 Mg Mg6 1 0.45492700 0.62384900 0.43499200 1.0 Mg Mg7 1 0.54507300 0.87615100 0.93499200 1.0 Fe Fe8 1 0.02719000 0.37643600 0.43688000 1.0 Fe Fe9 1 0.47281000 0.87643600 0.56312000 1.0 Fe Fe10 1 0.97281000 0.62356400 0.56312000 1.0 Fe Fe11 1 0.52719000 0.12356400 0.43688000 1.0 Fe Fe12 1 0.97281000 0.12356400 0.93688000 1.0 Fe Fe13 1 0.02719000 0.87643600 0.06312000 1.0 Fe Fe14 1 0.47281000 0.37643600 0.93688000 1.0 Fe Fe15 1 0.52719000 0.62356400 0.06312000 1.0 Bi Bi16 1 0.00864500 0.86131200 0.75164700 1.0 Bi Bi17 1 0.99135500 0.13868800 0.24835300 1.0 Bi Bi18 1 0.49135500 0.36131200 0.24835300 1.0 Bi Bi19 1 0.99135500 0.63868800 0.25164700 1.0 Bi Bi20 1 0.50864500 0.13868800 0.74835300 1.0 Bi Bi21 1 0.50864500 0.63868800 0.75164700 1.0 Bi Bi22 1 0.49135500 0.86131200 0.25164700 1.0 Bi Bi23 1 0.00864500 0.36131200 0.74835300 1.0 O O24 1 0.83465700 0.31356000 0.32540100 1.0 O O25 1 0.23609900 0.99802500 0.97615200 1.0 O O26 1 0.26390100 0.49802500 0.02384800 1.0 O O27 1 0.32925100 0.79979100 0.83130400 1.0 O O28 1 0.17074900 0.29979100 0.16869600 1.0 O O29 1 0.83465700 0.81356000 0.17459900 1.0 O O30 1 0.17074900 0.79979100 0.33130400 1.0 O O31 1 0.66534300 0.81356000 0.67459900 1.0 O O32 1 0.23609900 0.49802500 0.52384800 1.0 O O33 1 0.16534300 0.68644000 0.67459900 1.0 O O34 1 0.66534300 0.31356000 0.82540100 1.0 O O35 1 0.79420700 0.24354100 0.49114400 1.0 O O36 1 0.73609900 0.00197500 0.52384800 1.0 O O37 1 0.67074900 0.70020900 0.33130400 1.0 O O38 1 0.23659400 0.99431200 0.15666900 1.0 O O39 1 0.73609900 0.50197500 0.97615200 1.0 O O40 1 0.16534300 0.18644000 0.82540100 1.0 O O41 1 0.82925100 0.20020900 0.66869600 1.0 O O42 1 0.29420700 0.75645900 0.00885600 1.0 O O43 1 0.26390100 0.99802500 0.47615200 1.0 O O44 1 0.20579300 0.75645900 0.50885600 1.0 O O45 1 0.76340600 0.00568800 0.84333100 1.0 O O46 1 0.67074900 0.20020900 0.16869600 1.0 O O47 1 0.73659400 0.00568800 0.34333100 1.0 O O48 1 0.20579300 0.25645900 0.99114400 1.0 O O49 1 0.29420700 0.25645900 0.49114400 1.0 O O50 1 0.76390100 0.50197500 0.47615200 1.0 O O51 1 0.76390100 0.00197500 0.02384800 1.0 O O52 1 0.73659400 0.50568800 0.15666900 1.0 O O53 1 0.70579300 0.74354100 0.50885600 1.0 O O54 1 0.70579300 0.24354100 0.99114400 1.0 O O55 1 0.79420700 0.74354100 0.00885600 1.0 O O56 1 0.76340600 0.50568800 0.65666900 1.0 O O57 1 0.82925100 0.70020900 0.83130400 1.0 O O58 1 0.32925100 0.29979100 0.66869600 1.0 O O59 1 0.23659400 0.49431200 0.34333100 1.0 O O60 1 0.26340600 0.49431200 0.84333100 1.0 O O61 1 0.33465700 0.18644000 0.32540100 1.0 O O62 1 0.26340600 0.99431200 0.65666900 1.0 O O63 1 0.33465700 0.68644000 0.17459900 1.0