# generated using pymatgen data_Tm5Bi2Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.85774861 _cell_length_b 8.85951335 _cell_length_c 12.33310497 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Bi2Ru _chemical_formula_sum 'Tm20 Bi8 Ru4' _cell_volume 858.57932266 _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 Tm Tm0 1 0.84166965 0.75000000 0.79539585 1.0 Tm Tm1 1 0.15833035 0.25000000 0.20460415 1.0 Tm Tm2 1 0.34166965 0.25000000 0.70460415 1.0 Tm Tm3 1 0.65833035 0.75000000 0.29539585 1.0 Tm Tm4 1 0.37682728 0.75000000 0.68618706 1.0 Tm Tm5 1 0.62317272 0.25000000 0.31381294 1.0 Tm Tm6 1 0.87682728 0.25000000 0.81381294 1.0 Tm Tm7 1 0.12317272 0.75000000 0.18618706 1.0 Tm Tm8 1 0.94501879 0.75000000 0.50379824 1.0 Tm Tm9 1 0.05498121 0.25000000 0.49620176 1.0 Tm Tm10 1 0.44501879 0.25000000 0.99620176 1.0 Tm Tm11 1 0.55498121 0.75000000 0.00379824 1.0 Tm Tm12 1 0.67279931 0.03771926 0.56604016 1.0 Tm Tm13 1 0.32720069 0.96228074 0.43395984 1.0 Tm Tm14 1 0.17279931 0.96228074 0.93395984 1.0 Tm Tm15 1 0.32720069 0.53771926 0.43395984 1.0 Tm Tm16 1 0.82720069 0.03771926 0.06604016 1.0 Tm Tm17 1 0.67279931 0.46228074 0.56604016 1.0 Tm Tm18 1 0.82720069 0.46228074 0.06604016 1.0 Tm Tm19 1 0.17279931 0.53771926 0.93395984 1.0 Bi Bi20 1 0.56401391 0.49343756 0.82748893 1.0 Bi Bi21 1 0.43598609 0.50656244 0.17251107 1.0 Bi Bi22 1 0.06401391 0.50656244 0.67251107 1.0 Bi Bi23 1 0.43598609 0.99343756 0.17251107 1.0 Bi Bi24 1 0.93598609 0.49343756 0.32748893 1.0 Bi Bi25 1 0.56401391 0.00656244 0.82748893 1.0 Bi Bi26 1 0.93598609 0.00656244 0.32748893 1.0 Bi Bi27 1 0.06401391 0.99343756 0.67251107 1.0 Ru Ru28 1 0.56756666 0.75000000 0.50724353 1.0 Ru Ru29 1 0.43243334 0.25000000 0.49275647 1.0 Ru Ru30 1 0.06756666 0.25000000 0.99275647 1.0 Ru Ru31 1 0.93243334 0.75000000 0.00724353 1.0