# generated using pymatgen data_PrZr3(Al3Rh)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.46397225 _cell_length_b 7.44759762 _cell_length_c 9.28127288 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.61803830 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrZr3(Al3Rh)6 _chemical_formula_sum 'Pr1 Zr3 Al18 Rh6' _cell_volume 448.52134374 _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 Pr Pr0 1 0.32954295 0.00826213 0.25000000 1.0 Zr Zr1 1 0.99312525 0.67199264 0.75000000 1.0 Zr Zr2 1 0.00747272 0.32961480 0.25000000 1.0 Zr Zr3 1 0.67172117 0.99358588 0.75000000 1.0 Al Al4 1 0.12061266 0.12300769 0.75000000 1.0 Al Al5 1 0.86834826 0.87510012 0.25000000 1.0 Al Al6 1 0.99692493 0.33473819 0.57737990 1.0 Al Al7 1 0.99800202 0.66098759 0.42974686 1.0 Al Al8 1 0.99800202 0.66098759 0.07025314 1.0 Al Al9 1 0.33522578 0.99788177 0.91683570 1.0 Al Al10 1 0.99692493 0.33473819 0.92262010 1.0 Al Al11 1 0.66973225 0.00158595 0.07045196 1.0 Al Al12 1 0.66973225 0.00158595 0.42954804 1.0 Al Al13 1 0.33522578 0.99788177 0.58316430 1.0 Al Al14 1 0.33176699 0.33559929 0.04590555 1.0 Al Al15 1 0.66855806 0.66854426 0.94090085 1.0 Al Al16 1 0.66855806 0.66854426 0.55909915 1.0 Al Al17 1 0.33176699 0.33559929 0.45409445 1.0 Al Al18 1 0.33769929 0.55399408 0.75000000 1.0 Al Al19 1 0.67050023 0.45510369 0.25000000 1.0 Al Al20 1 0.55633831 0.34023815 0.75000000 1.0 Al Al21 1 0.44513244 0.65122421 0.25000000 1.0 Rh Rh22 1 0.67393548 0.32854668 0.50266241 1.0 Rh Rh23 1 0.32794951 0.67288560 0.50305707 1.0 Rh Rh24 1 0.32794951 0.67288560 0.99694293 1.0 Rh Rh25 1 0.67393548 0.32854668 0.99733759 1.0 Rh Rh26 1 0.99765784 0.99816798 0.50295191 1.0 Rh Rh27 1 0.99765784 0.99816798 0.99704809 1.0