# generated using pymatgen data_Hf5Sc(ZnRh2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.40410729 _cell_length_b 6.20078829 _cell_length_c 13.21344991 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00022734 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Sc(ZnRh2)6 _chemical_formula_sum 'Hf5 Sc1 Zn6 Rh12' _cell_volume 360.84526995 _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 0.00000473 0.00000000 0.99882908 1.0 Hf Hf1 1 0.49977547 0.50000000 0.16589951 1.0 Hf Hf2 1 0.99976590 0.00000000 0.33332767 1.0 Hf Hf3 1 0.50000497 0.50000000 0.50074069 1.0 Hf Hf4 1 0.00023337 0.00000000 0.66784062 1.0 Sc Sc5 1 0.50024005 0.50000000 0.83337015 1.0 Zn Zn6 1 0.00000176 0.50000000 0.99928018 1.0 Zn Zn7 1 0.49985569 0.00000000 0.16622137 1.0 Zn Zn8 1 0.99983187 0.50000000 0.33332925 1.0 Zn Zn9 1 0.50000471 0.00000000 0.50044186 1.0 Zn Zn10 1 0.00015171 0.50000000 0.66739277 1.0 Zn Zn11 1 0.50015548 0.00000000 0.83333475 1.0 Rh Rh12 1 0.49999828 0.24949642 0.00071735 1.0 Rh Rh13 1 0.49999828 0.75050358 0.00071735 1.0 Rh Rh14 1 0.99977153 0.25015067 0.16687707 1.0 Rh Rh15 1 0.99977153 0.74984833 0.16687707 1.0 Rh Rh16 1 0.49975851 0.24990476 0.33330459 1.0 Rh Rh17 1 0.49975851 0.75009524 0.33330459 1.0 Rh Rh18 1 0.00000426 0.25016636 0.49977332 1.0 Rh Rh19 1 0.00000426 0.74983264 0.49977332 1.0 Rh Rh20 1 0.50023331 0.24952211 0.66597563 1.0 Rh Rh21 1 0.50023331 0.75047789 0.66597563 1.0 Rh Rh22 1 0.00022075 0.24871198 0.83334759 1.0 Rh Rh23 1 0.00022075 0.75128702 0.83334759 1.0