# generated using pymatgen data_Er15Sc5Pb16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96772243 _cell_length_b 8.06865906 _cell_length_c 15.29044050 _cell_angle_alpha 89.99416679 _cell_angle_beta 89.64070534 _cell_angle_gamma 90.29003980 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er15Sc5Pb16 _chemical_formula_sum 'Er15 Sc5 Pb16' _cell_volume 982.97268738 _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 Er Er0 1 0.87361486 0.65572211 0.62351918 1.0 Er Er1 1 0.62691634 0.15341359 0.37835728 1.0 Er Er2 1 0.13049668 0.34499350 0.12017144 1.0 Er Er3 1 0.62801572 0.15452895 0.12232012 1.0 Er Er4 1 0.12577113 0.34459887 0.37792997 1.0 Er Er5 1 0.37423664 0.84605230 0.62210442 1.0 Er Er6 1 0.87290828 0.65441766 0.87834153 1.0 Er Er7 1 0.53506556 0.32026639 0.90354662 1.0 Er Er8 1 0.04033280 0.17614035 0.60038237 1.0 Er Er9 1 0.46129987 0.67692705 0.40172235 1.0 Er Er10 1 0.96079992 0.82323642 0.09843596 1.0 Er Er11 1 0.46669831 0.68118549 0.09445485 1.0 Er Er12 1 0.96077185 0.82305319 0.40029372 1.0 Er Er13 1 0.53835295 0.32255365 0.59976355 1.0 Er Er14 1 0.03659877 0.17552496 0.90077153 1.0 Sc Sc15 1 0.36905616 0.84803228 0.87559859 1.0 Sc Sc16 1 0.20531421 0.50454929 0.75049435 1.0 Sc Sc17 1 0.70357776 0.99381850 0.75134581 1.0 Sc Sc18 1 0.79580748 0.49507563 0.25024610 1.0 Sc Sc19 1 0.29544567 0.00475648 0.24927600 1.0 Pb Pb20 1 0.28376671 0.03167384 0.04128709 1.0 Pb Pb21 1 0.78175101 0.46775760 0.45487142 1.0 Pb Pb22 1 0.72021204 0.96760452 0.54609326 1.0 Pb Pb23 1 0.21970105 0.54112994 0.95252967 1.0 Pb Pb24 1 0.70927491 0.96279972 0.95436009 1.0 Pb Pb25 1 0.21784504 0.53196540 0.54647997 1.0 Pb Pb26 1 0.28087844 0.03258643 0.45453235 1.0 Pb Pb27 1 0.78575438 0.46535973 0.04595311 1.0 Pb Pb28 1 0.56001968 0.62963498 0.75306123 1.0 Pb Pb29 1 0.06608207 0.87357869 0.75180754 1.0 Pb Pb30 1 0.43756028 0.37399563 0.25008757 1.0 Pb Pb31 1 0.93715072 0.12667040 0.24911545 1.0 Pb Pb32 1 0.35080511 0.15907747 0.75178994 1.0 Pb Pb33 1 0.84837194 0.33912556 0.75098863 1.0 Pb Pb34 1 0.64900032 0.83788565 0.24929973 1.0 Pb Pb35 1 0.15074333 0.66030679 0.24866723 1.0