# generated using pymatgen data_Sc5(SnBi)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.76891939 _cell_length_b 7.77135732 _cell_length_c 14.81609406 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5(SnBi)2 _chemical_formula_sum 'Sc20 Sn8 Bi8' _cell_volume 894.52239856 _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 Sc Sc0 1 0.40576386 0.83723453 0.88069645 1.0 Sc Sc1 1 0.90576386 0.66276547 0.61930355 1.0 Sc Sc2 1 0.59423614 0.16276547 0.38069645 1.0 Sc Sc3 1 0.09423614 0.33723453 0.11930355 1.0 Sc Sc4 1 0.59423614 0.16276547 0.11930355 1.0 Sc Sc5 1 0.09423614 0.33723453 0.38069645 1.0 Sc Sc6 1 0.40576386 0.83723453 0.61930355 1.0 Sc Sc7 1 0.90576386 0.66276547 0.88069645 1.0 Sc Sc8 1 0.58326372 0.33549627 0.88312132 1.0 Sc Sc9 1 0.08326372 0.16450373 0.61687868 1.0 Sc Sc10 1 0.41673628 0.66450373 0.38312132 1.0 Sc Sc11 1 0.91673628 0.83549627 0.11687868 1.0 Sc Sc12 1 0.41673628 0.66450373 0.11687868 1.0 Sc Sc13 1 0.91673628 0.83549627 0.38312132 1.0 Sc Sc14 1 0.58326372 0.33549627 0.61687868 1.0 Sc Sc15 1 0.08326372 0.16450373 0.88312132 1.0 Sc Sc16 1 0.24360421 0.50001474 0.75000000 1.0 Sc Sc17 1 0.74360421 0.99998526 0.75000000 1.0 Sc Sc18 1 0.75639579 0.49998526 0.25000000 1.0 Sc Sc19 1 0.25639579 0.00001474 0.25000000 1.0 Sn Sn20 1 0.60476719 0.63631465 0.75000000 1.0 Sn Sn21 1 0.10476719 0.86368535 0.75000000 1.0 Sn Sn22 1 0.39523281 0.36368535 0.25000000 1.0 Sn Sn23 1 0.89523281 0.13631465 0.25000000 1.0 Sn Sn24 1 0.38366207 0.13990310 0.75000000 1.0 Sn Sn25 1 0.88366207 0.36009690 0.75000000 1.0 Sn Sn26 1 0.61633793 0.86009690 0.25000000 1.0 Sn Sn27 1 0.11633793 0.63990310 0.25000000 1.0 Bi Bi28 1 0.25390902 0.00353627 0.04608517 1.0 Bi Bi29 1 0.75390902 0.49646373 0.45391483 1.0 Bi Bi30 1 0.74609098 0.99646373 0.54608517 1.0 Bi Bi31 1 0.24609098 0.50353627 0.95391483 1.0 Bi Bi32 1 0.74609098 0.99646373 0.95391483 1.0 Bi Bi33 1 0.24609098 0.50353627 0.54608517 1.0 Bi Bi34 1 0.25390902 0.00353627 0.45391483 1.0 Bi Bi35 1 0.75390902 0.49646373 0.04608517 1.0