# generated using pymatgen data_Sc4As6Ru2Rh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.03305118 _cell_length_b 7.03289579 _cell_length_c 7.03305083 _cell_angle_alpha 109.48512102 _cell_angle_beta 109.44511000 _cell_angle_gamma 109.48512653 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4As6Ru2Rh5 _chemical_formula_sum 'Sc4 As6 Ru2 Rh5' _cell_volume 267.78773601 _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 0.00140649 0.00282421 0.50140303 1.0 Sc Sc1 1 0.49859697 0.99717579 0.99859351 1.0 Sc Sc2 1 0.00141412 0.50000000 0.99858588 1.0 Sc Sc3 1 0.49859200 0.50000000 0.50140800 1.0 As As4 1 0.68485096 0.68625845 0.99857829 1.0 As As5 1 0.31229358 0.31374980 0.99858304 1.0 As As6 1 0.00141696 0.68625020 0.68770642 1.0 As As7 1 0.00142171 0.31374155 0.31514904 1.0 As As8 1 0.68681462 0.99999739 0.68679922 1.0 As As9 1 0.31320078 0.00000261 0.31318538 1.0 Ru Ru10 1 0.99999592 1.00000000 0.00000408 1.0 Ru Ru11 1 0.25000401 0.50000000 0.74999599 1.0 Rh Rh12 1 0.74910924 0.24935915 0.49974636 1.0 Rh Rh13 1 0.50024282 0.24935635 0.74961444 1.0 Rh Rh14 1 0.50025364 0.75064085 0.25089076 1.0 Rh Rh15 1 0.75000062 0.50000000 0.24999938 1.0 Rh Rh16 1 0.25038556 0.75064365 0.49975718 1.0