# generated using pymatgen data_Pr3Sb5Pd6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.46435308 _cell_length_b 10.25403819 _cell_length_c 13.50534333 _cell_angle_alpha 90.00080941 _cell_angle_beta 90.00025178 _cell_angle_gamma 89.99999337 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Sb5Pd6 _chemical_formula_sum 'Pr6 Sb10 Pd12' _cell_volume 618.24283922 _cell_formula_units_Z 2 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 -0.00000170 0.24216519 0.00003016 1.0 Pr Pr1 1 0.49999990 0.75784054 0.49997420 1.0 Pr Pr2 1 -0.00000067 0.24770359 0.32689869 1.0 Pr Pr3 1 0.49999900 0.75229794 0.17310383 1.0 Pr Pr4 1 -0.00000048 0.24770565 0.67308325 1.0 Pr Pr5 1 0.49999955 0.75228105 0.82690781 1.0 Sb Sb6 1 -0.00000174 0.51948242 0.12836874 1.0 Sb Sb7 1 0.49999841 0.48054792 0.37165181 1.0 Sb Sb8 1 -0.00000087 0.51949367 0.87163782 1.0 Sb Sb9 1 0.49999852 0.48052039 0.62834211 1.0 Sb Sb10 1 0.00000107 0.86302552 0.33553406 1.0 Sb Sb11 1 0.49999767 0.13695932 0.16451378 1.0 Sb Sb12 1 0.00000102 0.86304550 0.66444630 1.0 Sb Sb13 1 0.49999615 0.13694967 0.83551409 1.0 Sb Sb14 1 -0.00000072 0.83868152 0.00001386 1.0 Sb Sb15 1 0.50001795 0.16143797 0.49999077 1.0 Pd Pd16 1 -0.00000169 0.99333660 0.16184648 1.0 Pd Pd17 1 0.50000038 0.00663871 0.33819585 1.0 Pd Pd18 1 -0.00000323 0.99335493 0.83817689 1.0 Pd Pd19 1 0.50000038 0.00663577 0.66177042 1.0 Pd Pd20 1 0.49999901 0.98727582 0.00003764 1.0 Pd Pd21 1 0.00000124 0.01279205 0.49996676 1.0 Pd Pd22 1 0.00000201 0.60798658 0.31873588 1.0 Pd Pd23 1 0.49999886 0.39200507 0.18129858 1.0 Pd Pd24 1 0.00000317 0.60798250 0.68123300 1.0 Pd Pd25 1 0.49999927 0.39199635 0.81873424 1.0 Pd Pd26 1 0.49999898 0.51985736 0.00002617 1.0 Pd Pd27 1 -0.00000144 0.48000041 0.49996480 1.0