# generated using pymatgen data_Sc5Ge3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.94300989 _cell_length_b 7.94301030 _cell_length_c 5.91240581 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999402 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5Ge3 _chemical_formula_sum 'Sc10 Ge6' _cell_volume 323.04656081 _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 0.00000000 1.0 Sc Sc1 1 0.66666700 0.33333300 0.50000000 1.0 Sc Sc2 1 0.66666700 0.33333300 0.00000000 1.0 Sc Sc3 1 0.33333300 0.66666700 0.50000000 1.0 Sc Sc4 1 0.24083138 -0.00000000 0.25000000 1.0 Sc Sc5 1 0.24083138 0.24083138 0.75000000 1.0 Sc Sc6 1 0.00000000 0.75916862 0.75000000 1.0 Sc Sc7 1 -0.00000000 0.24083138 0.25000000 1.0 Sc Sc8 1 0.75916862 0.75916862 0.25000000 1.0 Sc Sc9 1 0.75916862 0.00000000 0.75000000 1.0 Ge Ge10 1 0.60665308 0.00000000 0.25000000 1.0 Ge Ge11 1 0.60665308 0.60665308 0.75000000 1.0 Ge Ge12 1 -0.00000000 0.39334692 0.75000000 1.0 Ge Ge13 1 0.00000000 0.60665308 0.25000000 1.0 Ge Ge14 1 0.39334692 0.39334692 0.25000000 1.0 Ge Ge15 1 0.39334692 -0.00000000 0.75000000 1.0