# generated using pymatgen data_Sc5Sn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.43376050 _cell_length_b 8.43376059 _cell_length_c 6.10509602 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000771 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5Sn3 _chemical_formula_sum 'Sc10 Sn6' _cell_volume 376.06734955 _cell_formula_units_Z 2 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 0.33333300 0.66666700 0.50000000 1.0 Sc Sc1 1 0.66666700 0.33333300 0.00000000 1.0 Sc Sc2 1 0.66666700 0.33333300 0.50000000 1.0 Sc Sc3 1 0.33333300 0.66666700 0.00000000 1.0 Sc Sc4 1 0.76332690 1.00000000 0.75000000 1.0 Sc Sc5 1 0.76332690 0.76332690 0.25000000 1.0 Sc Sc6 1 0.23667310 0.00000000 0.25000000 1.0 Sc Sc7 1 0.23667310 0.23667310 0.75000000 1.0 Sc Sc8 1 1.00000000 0.76332690 0.75000000 1.0 Sc Sc9 1 0.00000000 0.23667310 0.25000000 1.0 Sn Sn10 1 0.39421174 0.00000000 0.75000000 1.0 Sn Sn11 1 0.39421174 0.39421174 0.25000000 1.0 Sn Sn12 1 1.00000000 0.60578826 0.25000000 1.0 Sn Sn13 1 0.00000000 0.39421174 0.75000000 1.0 Sn Sn14 1 0.60578826 0.60578826 0.75000000 1.0 Sn Sn15 1 0.60578826 1.00000000 0.25000000 1.0