# generated using pymatgen data_Tb7Yb(ScIr3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.73566108 _cell_length_b 10.75392964 _cell_length_c 6.25553125 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.25160296 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb7Yb(ScIr3)2 _chemical_formula_sum 'Tb14 Yb2 Sc4 Ir12' _cell_volume 722.19752216 _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 Tb Tb0 1 0.71268215 0.08424254 0.88031542 1.0 Tb Tb1 1 0.71268215 0.91575746 0.38031542 1.0 Tb Tb2 1 0.58372304 0.78863598 0.87830143 1.0 Tb Tb3 1 0.58372304 0.21136402 0.37830143 1.0 Tb Tb4 1 0.41284844 0.79093086 0.37822430 1.0 Tb Tb5 1 0.41284844 0.20906914 0.87822430 1.0 Tb Tb6 1 0.21341587 0.41420318 0.62430488 1.0 Tb Tb7 1 0.21341587 0.58579682 0.12430488 1.0 Tb Tb8 1 0.78671540 0.41407654 0.12135957 1.0 Tb Tb9 1 0.78671540 0.58592346 0.62135957 1.0 Tb Tb10 1 0.91385400 0.71324428 0.12416960 1.0 Tb Tb11 1 0.91385400 0.28675572 0.62416960 1.0 Tb Tb12 1 0.08672199 0.71332193 0.62401855 1.0 Tb Tb13 1 0.08672199 0.28667807 0.12401855 1.0 Yb Yb14 1 0.28698975 0.08521636 0.37507369 1.0 Yb Yb15 1 0.28698975 0.91478364 0.87507369 1.0 Sc Sc16 1 0.00270213 0.99978297 0.49720170 1.0 Sc Sc17 1 0.00270213 0.00021703 0.99720170 1.0 Sc Sc18 1 0.49921819 0.49959446 0.99694405 1.0 Sc Sc19 1 0.49921819 0.50040554 0.49694405 1.0 Ir Ir20 1 0.85537980 0.14758039 0.24959814 1.0 Ir Ir21 1 0.85537980 0.85241961 0.74959814 1.0 Ir Ir22 1 0.14419196 0.15185484 0.75028808 1.0 Ir Ir23 1 0.14419196 0.84814516 0.25028808 1.0 Ir Ir24 1 0.64557003 0.35154670 0.75029824 1.0 Ir Ir25 1 0.64557003 0.64845330 0.25029824 1.0 Ir Ir26 1 0.35289289 0.35557237 0.24546383 1.0 Ir Ir27 1 0.35289289 0.64442763 0.74546383 1.0 Ir Ir28 1 0.50302155 0.00035138 0.12326368 1.0 Ir Ir29 1 0.50302155 0.99964862 0.62326368 1.0 Ir Ir30 1 0.00007181 0.50025276 0.88117384 1.0 Ir Ir31 1 0.00007181 0.49974724 0.38117384 1.0