# generated using pymatgen data_Pr8Tm9Sc3Sn16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99670670 _cell_length_b 8.16000588 _cell_length_c 15.49061311 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.99321398 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr8Tm9Sc3Sn16 _chemical_formula_sum 'Pr8 Tm9 Sc3 Sn16' _cell_volume 1010.81166109 _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 0.98680106 0.17759477 0.40295118 1.0 Pr Pr1 1 0.48643632 0.32242065 0.40241095 1.0 Pr Pr2 1 0.51240277 0.67642252 0.90349662 1.0 Pr Pr3 1 0.51240277 0.67642252 0.59650338 1.0 Pr Pr4 1 0.01336118 0.82160320 0.59647735 1.0 Pr Pr5 1 0.01336118 0.82160320 0.90352265 1.0 Pr Pr6 1 0.48643632 0.32242065 0.09758905 1.0 Pr Pr7 1 0.98680106 0.17759477 0.09704882 1.0 Tm Tm8 1 0.35247683 0.16288908 0.62351432 1.0 Tm Tm9 1 0.64742158 0.83817943 0.37529212 1.0 Tm Tm10 1 0.68536082 0.00441846 0.75000000 1.0 Tm Tm11 1 0.14673744 0.66186067 0.37568043 1.0 Tm Tm12 1 0.85336656 0.33832162 0.87656203 1.0 Tm Tm13 1 0.85336656 0.33832162 0.62343797 1.0 Tm Tm14 1 0.35247683 0.16288908 0.87648568 1.0 Tm Tm15 1 0.14673744 0.66186067 0.12431957 1.0 Tm Tm16 1 0.64742158 0.83817943 0.12470788 1.0 Sc Sc17 1 0.81508520 0.50547729 0.25000000 1.0 Sc Sc18 1 0.31588380 0.99472948 0.25000000 1.0 Sc Sc19 1 0.18497488 0.49531533 0.75000000 1.0 Sn Sn20 1 0.31642936 0.85185139 0.75000000 1.0 Sn Sn21 1 0.45215267 0.62736268 0.25000000 1.0 Sn Sn22 1 0.05182635 0.13117956 0.75000000 1.0 Sn Sn23 1 0.54650392 0.37480703 0.75000000 1.0 Sn Sn24 1 0.19140484 0.45869250 0.54394512 1.0 Sn Sn25 1 0.95269699 0.87239920 0.25000000 1.0 Sn Sn26 1 0.68045818 0.14706753 0.25000000 1.0 Sn Sn27 1 0.80799008 0.54138419 0.04476120 1.0 Sn Sn28 1 0.30896784 0.95850606 0.04479146 1.0 Sn Sn29 1 0.19140484 0.45869250 0.95605488 1.0 Sn Sn30 1 0.69088372 0.04197651 0.54243842 1.0 Sn Sn31 1 0.30896784 0.95850606 0.45520854 1.0 Sn Sn32 1 0.80799008 0.54138419 0.45523880 1.0 Sn Sn33 1 0.82227750 0.64305330 0.75000000 1.0 Sn Sn34 1 0.17984291 0.35263536 0.25000000 1.0 Sn Sn35 1 0.69088372 0.04197651 0.95756158 1.0