# generated using pymatgen data_Hf3Sc(PRh)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.77148243 _cell_length_b 6.44773816 _cell_length_c 7.37708086 _cell_angle_alpha 89.87754551 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Sc(PRh)4 _chemical_formula_sum 'Hf3 Sc1 P4 Rh4' _cell_volume 179.39198405 _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 0.75000000 0.47041145 0.82049495 1.0 Hf Hf1 1 0.75000000 0.97056179 0.68027597 1.0 Hf Hf2 1 0.25000000 0.02896092 0.31920417 1.0 Sc Sc3 1 0.25000000 0.52978086 0.18127990 1.0 P P4 1 0.25000000 0.75812891 0.87621006 1.0 P P5 1 0.75000000 0.24086992 0.12347726 1.0 P P6 1 0.75000000 0.74194840 0.37682434 1.0 P P7 1 0.25000000 0.25926963 0.62246123 1.0 Rh Rh8 1 0.25000000 0.65067584 0.56285688 1.0 Rh Rh9 1 0.75000000 0.34918918 0.43869732 1.0 Rh Rh10 1 0.75000000 0.85093876 0.06211302 1.0 Rh Rh11 1 0.25000000 0.14926136 0.93610791 1.0