# generated using pymatgen data_Sc5ReAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.86465197 _cell_length_b 7.79209531 _cell_length_c 7.98739297 _cell_angle_alpha 119.19442426 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5ReAs2 _chemical_formula_sum 'Sc10 Re2 As4' _cell_volume 318.64025979 _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 0.00000000 0.66184146 0.32368191 1.0 Sc Sc1 1 0.00000000 0.33815854 0.67631809 1.0 Sc Sc2 1 0.50000000 0.33815854 0.67631809 1.0 Sc Sc3 1 0.50000000 0.66184146 0.32368191 1.0 Sc Sc4 1 0.75000000 0.74009011 0.76386179 1.0 Sc Sc5 1 0.25000000 0.25990989 0.23613821 1.0 Sc Sc6 1 0.75000000 0.97622932 0.23613821 1.0 Sc Sc7 1 0.25000000 0.02377068 0.76386179 1.0 Sc Sc8 1 0.75000000 0.25158894 0.00000000 1.0 Sc Sc9 1 0.25000000 0.74841106 1.00000000 1.0 Re Re10 1 0.75000000 0.59130345 0.00000000 1.0 Re Re11 1 0.25000000 0.40869655 1.00000000 1.0 As As12 1 0.75000000 0.37783903 0.38770536 1.0 As As13 1 0.25000000 0.62216097 0.61229464 1.0 As As14 1 0.75000000 0.99013467 0.61229464 1.0 As As15 1 0.25000000 0.00986533 0.38770536 1.0