# generated using pymatgen data_Tm5Sc(Rh2Pb)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.45881744 _cell_length_b 7.26052774 _cell_length_c 13.38396901 _cell_angle_alpha 89.99958360 _cell_angle_beta 90.00014511 _cell_angle_gamma 90.00297326 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Sc(Rh2Pb)6 _chemical_formula_sum 'Tm5 Sc1 Rh12 Pb6' _cell_volume 433.28414963 _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 Tm Tm0 1 0.99997457 0.99997264 0.99791132 1.0 Tm Tm1 1 0.49991389 0.49993937 0.16567000 1.0 Tm Tm2 1 0.99992368 0.99997755 0.33333179 1.0 Tm Tm3 1 0.50002304 0.50004583 0.50100248 1.0 Tm Tm4 1 0.00007414 0.00009473 0.66877273 1.0 Sc Sc5 1 0.50007560 0.49994384 0.83331792 1.0 Rh Rh6 1 0.49996212 0.25553167 0.99625640 1.0 Rh Rh7 1 0.50000926 0.74438529 0.99626387 1.0 Rh Rh8 1 0.99989465 0.25003616 0.16536206 1.0 Rh Rh9 1 0.99990363 0.74986941 0.16535858 1.0 Rh Rh10 1 0.49990945 0.24988031 0.33333782 1.0 Rh Rh11 1 0.49992982 0.75007439 0.33334200 1.0 Rh Rh12 1 0.00001007 0.25001440 0.50131091 1.0 Rh Rh13 1 0.00001152 0.75008182 0.50130989 1.0 Rh Rh14 1 0.50008455 0.25567032 0.67041167 1.0 Rh Rh15 1 0.50012687 0.74447154 0.67039276 1.0 Rh Rh16 1 0.00003796 0.25850303 0.83331726 1.0 Rh Rh17 1 0.00012762 0.74151488 0.83332251 1.0 Pb Pb18 1 0.99998177 0.49998209 0.99814235 1.0 Pb Pb19 1 0.49990028 0.99992591 0.16448841 1.0 Pb Pb20 1 0.99994485 0.49998744 0.33336420 1.0 Pb Pb21 1 0.50000471 0.00003233 0.50220761 1.0 Pb Pb22 1 0.00011962 0.50010191 0.66847414 1.0 Pb Pb23 1 0.50005131 0.99996417 0.83333231 1.0