# generated using pymatgen data_Sc2Pa6Sn3Bi7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.49795339 _cell_length_b 9.49795358 _cell_length_c 6.29748404 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000286 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Pa6Sn3Bi7 _chemical_formula_sum 'Sc2 Pa6 Sn3 Bi7' _cell_volume 491.99169477 _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 Sc Sc0 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc1 1 0.00000000 0.00000000 0.50000000 1.0 Pa Pa2 1 0.00483991 0.60697979 0.24666840 1.0 Pa Pa3 1 0.39302021 0.39786012 0.24666840 1.0 Pa Pa4 1 0.39302021 0.99516009 0.75333160 1.0 Pa Pa5 1 0.60213988 0.60697979 0.75333160 1.0 Pa Pa6 1 0.60213988 0.99516009 0.24666840 1.0 Pa Pa7 1 0.00483991 0.39786012 0.75333160 1.0 Sn Sn8 1 0.33333300 0.66666700 0.50000000 1.0 Sn Sn9 1 0.66666700 0.33333300 0.00000000 1.0 Sn Sn10 1 0.33333300 0.66666700 0.00000000 1.0 Bi Bi11 1 0.99888493 0.26678274 0.25042043 1.0 Bi Bi12 1 0.26789781 0.26678274 0.74957957 1.0 Bi Bi13 1 0.73321726 0.00111507 0.74957957 1.0 Bi Bi14 1 0.99888493 0.73210219 0.74957957 1.0 Bi Bi15 1 0.73321726 0.73210219 0.25042043 1.0 Bi Bi16 1 0.26789781 0.00111507 0.25042043 1.0 Bi Bi17 1 0.66666700 0.33333300 0.50000000 1.0