# generated using pymatgen data_Pr16Ho3TmPb16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.39235532 _cell_length_b 16.17666558 _cell_length_c 8.51104322 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99753541 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr16Ho3TmPb16 _chemical_formula_sum 'Pr16 Ho3 Tm1 Pb16' _cell_volume 1155.46199623 _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 0.62482276 0.61871765 0.15542130 1.0 Pr Pr1 1 0.12440268 0.88126518 0.34480880 1.0 Pr Pr2 1 0.37542055 0.11864335 0.84465702 1.0 Pr Pr3 1 0.87540595 0.38148432 0.65532558 1.0 Pr Pr4 1 0.37542055 0.38135665 0.84465702 1.0 Pr Pr5 1 0.87540595 0.11851568 0.65532558 1.0 Pr Pr6 1 0.62482276 0.88128235 0.15542130 1.0 Pr Pr7 1 0.12440268 0.61873482 0.34480880 1.0 Pr Pr8 1 0.46678716 0.60091465 0.67664938 1.0 Pr Pr9 1 0.96656836 0.89913806 0.82288907 1.0 Pr Pr10 1 0.53324396 0.10077179 0.32317750 1.0 Pr Pr11 1 0.03328280 0.39914869 0.17682085 1.0 Pr Pr12 1 0.53324396 0.39922821 0.32317750 1.0 Pr Pr13 1 0.03328280 0.10085131 0.17682085 1.0 Pr Pr14 1 0.46678716 0.89908535 0.67664938 1.0 Pr Pr15 1 0.96656836 0.60086194 0.82288907 1.0 Ho Ho16 1 0.29079575 0.75000000 0.00260228 1.0 Ho Ho17 1 0.20923914 0.25000000 0.50282096 1.0 Ho Ho18 1 0.70927713 0.25000000 0.99729998 1.0 Tm Tm19 1 0.79040747 0.75000000 0.49699481 1.0 Pb Pb20 1 0.71950479 0.45258658 0.96890834 1.0 Pb Pb21 1 0.21953279 0.04741130 0.53119639 1.0 Pb Pb22 1 0.28049926 0.95252593 0.03121596 1.0 Pb Pb23 1 0.78041565 0.54785309 0.46908234 1.0 Pb Pb24 1 0.28049926 0.54747407 0.03121596 1.0 Pb Pb25 1 0.78041565 0.95214691 0.46908234 1.0 Pb Pb26 1 0.71950479 0.04741342 0.96890834 1.0 Pb Pb27 1 0.21953279 0.45258870 0.53119639 1.0 Pb Pb28 1 0.43134823 0.75000000 0.37228997 1.0 Pb Pb29 1 0.93067705 0.75000000 0.12847319 1.0 Pb Pb30 1 0.56942541 0.25000000 0.62809027 1.0 Pb Pb31 1 0.06921007 0.25000000 0.87183287 1.0 Pb Pb32 1 0.65554467 0.75000000 0.84548521 1.0 Pb Pb33 1 0.15515290 0.75000000 0.65365641 1.0 Pb Pb34 1 0.34454935 0.25000000 0.15368108 1.0 Pb Pb35 1 0.84460437 0.25000000 0.34647291 1.0