# generated using pymatgen data_Hf3Sc(GeRh5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.01972718 _cell_length_b 5.51459850 _cell_length_c 10.82467572 _cell_angle_alpha 90.14288588 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Sc(GeRh5)2 _chemical_formula_sum 'Hf3 Sc1 Ge2 Rh10' _cell_volume 239.95180511 _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 Hf Hf0 1 0.50000000 0.81924038 0.36174919 1.0 Hf Hf1 1 0.50000000 0.68186422 0.85768646 1.0 Hf Hf2 1 0.50000000 0.31912902 0.13997815 1.0 Sc Sc3 1 0.50000000 0.18203368 0.63973066 1.0 Ge Ge4 1 0.00000000 0.49470319 0.50164127 1.0 Ge Ge5 1 0.00000000 0.99960011 0.99981210 1.0 Rh Rh6 1 0.50000000 0.18944939 0.89414907 1.0 Rh Rh7 1 0.50000000 0.81115021 0.10723795 1.0 Rh Rh8 1 0.50000000 0.68812568 0.60675680 1.0 Rh Rh9 1 0.50000000 0.31204968 0.39102075 1.0 Rh Rh10 1 0.00000000 0.43699870 0.74507908 1.0 Rh Rh11 1 0.00000000 0.56538115 0.25535392 1.0 Rh Rh12 1 0.00000000 0.99880446 0.49939280 1.0 Rh Rh13 1 0.00000000 0.50079330 0.99987934 1.0 Rh Rh14 1 0.00000000 0.06456762 0.24421895 1.0 Rh Rh15 1 0.00000000 0.93611020 0.75631452 1.0