# generated using pymatgen data_TbYB6Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.66712711 _cell_length_b 9.15772529 _cell_length_c 11.52028081 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbYB6Ru _chemical_formula_sum 'Tb4 Y4 B24 Ru4' _cell_volume 386.88032166 _cell_formula_units_Z 4 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 0.00000000 0.32296789 0.41415534 1.0 Tb Tb1 1 0.00000000 0.67703211 0.58584466 1.0 Tb Tb2 1 0.00000000 0.82296789 0.08584466 1.0 Tb Tb3 1 0.00000000 0.17703211 0.91415534 1.0 Y Y4 1 0.00000000 0.94400711 0.37286921 1.0 Y Y5 1 0.00000000 0.05599289 0.62713079 1.0 Y Y6 1 0.00000000 0.44400711 0.12713079 1.0 Y Y7 1 0.00000000 0.55599289 0.87286921 1.0 B B8 1 0.50000000 0.55407885 0.43228914 1.0 B B9 1 0.50000000 0.44592115 0.56771086 1.0 B B10 1 0.50000000 0.05407885 0.06771086 1.0 B B11 1 0.50000000 0.94592115 0.93228914 1.0 B B12 1 0.50000000 0.74731320 0.41961239 1.0 B B13 1 0.50000000 0.25268680 0.58038761 1.0 B B14 1 0.50000000 0.24731320 0.08038761 1.0 B B15 1 0.50000000 0.75268680 0.91961239 1.0 B B16 1 0.50000000 0.79018125 0.26682062 1.0 B B17 1 0.50000000 0.20981875 0.73317938 1.0 B B18 1 0.50000000 0.29018125 0.23317938 1.0 B B19 1 0.50000000 0.70981875 0.76682062 1.0 B B20 1 0.50000000 0.63217482 0.18572857 1.0 B B21 1 0.50000000 0.36782518 0.81427143 1.0 B B22 1 0.50000000 0.13217482 0.31427143 1.0 B B23 1 0.50000000 0.86782518 0.68572857 1.0 B B24 1 0.50000000 0.98436360 0.21280583 1.0 B B25 1 0.50000000 0.01563640 0.78719417 1.0 B B26 1 0.50000000 0.48436360 0.28719417 1.0 B B27 1 0.50000000 0.51563640 0.71280583 1.0 B B28 1 0.50000000 0.61154200 0.03079424 1.0 B B29 1 0.50000000 0.38845800 0.96920576 1.0 B B30 1 0.50000000 0.11154200 0.46920576 1.0 B B31 1 0.50000000 0.88845800 0.53079424 1.0 Ru Ru32 1 0.00000000 0.63797472 0.32116056 1.0 Ru Ru33 1 0.00000000 0.36202528 0.67883944 1.0 Ru Ru34 1 0.00000000 0.13797472 0.17883944 1.0 Ru Ru35 1 0.00000000 0.86202528 0.82116056 1.0