# generated using pymatgen data_Sm2MgTi3(BiO6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.89986618 _cell_length_b 3.89986428 _cell_length_c 18.38251938 _cell_angle_alpha 96.17055960 _cell_angle_beta 96.17090148 _cell_angle_gamma 89.99189794 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2MgTi3(BiO6)2 _chemical_formula_sum 'Sm2 Mg1 Ti3 Bi2 O12' _cell_volume 276.33000403 _cell_formula_units_Z 1 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 Sm Sm0 1 0.08435500 0.08435800 0.17205400 1.0 Sm Sm1 1 0.91567700 0.91567700 0.82802300 1.0 Mg Mg2 1 0.00001000 0.00000800 0.00002100 1.0 Ti Ti3 1 0.36366500 0.36366200 0.72614900 1.0 Ti Ti4 1 0.49999800 0.49999700 0.99999600 1.0 Ti Ti5 1 0.63629600 0.63629500 0.27374600 1.0 Bi Bi6 1 0.21553300 0.21553100 0.43191300 1.0 Bi Bi7 1 0.78443900 0.78443400 0.56806800 1.0 O O8 1 0.68495000 0.68495200 0.37029700 1.0 O O9 1 0.12078500 0.62058100 0.24283100 1.0 O O10 1 0.24999200 0.74999300 0.49998400 1.0 O O11 1 0.74999500 0.24999100 0.49998400 1.0 O O12 1 0.00000200 0.50000000 0.00000100 1.0 O O13 1 0.62058000 0.12078500 0.24283100 1.0 O O14 1 0.87923200 0.37944500 0.75720600 1.0 O O15 1 0.37944200 0.87923500 0.75720600 1.0 O O16 1 0.31502900 0.31503000 0.62965400 1.0 O O17 1 0.55756300 0.55756100 0.11397200 1.0 O O18 1 0.44246200 0.44246500 0.88606500 1.0 O O19 1 0.50000000 0.00000100 0.00000100 1.0