# generated using pymatgen data_Tb2P4RuRh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92010082 _cell_length_b 11.17933876 _cell_length_c 12.56950427 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2P4RuRh5 _chemical_formula_sum 'Tb6 P12 Ru3 Rh15' _cell_volume 550.84765329 _cell_formula_units_Z 3 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 0.50000000 0.52074481 1.0 Tb Tb1 1 0.50000000 0.00000000 0.47913571 1.0 Tb Tb2 1 0.50000000 0.81841189 0.20528957 1.0 Tb Tb3 1 0.50000000 0.18158811 0.20528957 1.0 Tb Tb4 1 0.00000000 0.67969650 0.79528805 1.0 Tb Tb5 1 0.00000000 0.32030350 0.79528805 1.0 P P6 1 0.50000000 0.50000000 0.88187943 1.0 P P7 1 0.00000000 0.00000000 0.11622802 1.0 P P8 1 0.50000000 0.50000000 0.34775536 1.0 P P9 1 0.00000000 0.00000000 0.65111078 1.0 P P10 1 0.50000000 0.31386844 0.61905728 1.0 P P11 1 0.50000000 0.68613156 0.61905728 1.0 P P12 1 0.00000000 0.18639788 0.38097483 1.0 P P13 1 0.00000000 0.81360212 0.38097483 1.0 P P14 1 0.50000000 0.84474787 0.89327890 1.0 P P15 1 0.50000000 0.15525213 0.89327890 1.0 P P16 1 0.00000000 0.65328705 0.10802294 1.0 P P17 1 0.00000000 0.34671295 0.10802294 1.0 Ru Ru18 1 0.50000000 0.50000000 0.16300819 1.0 Ru Ru19 1 0.00000000 0.50000000 0.99080762 1.0 Ru Ru20 1 0.50000000 0.00000000 0.01082747 1.0 Rh Rh21 1 0.00000000 0.00000000 0.83583822 1.0 Rh Rh22 1 0.50000000 0.50000000 0.69986190 1.0 Rh Rh23 1 0.00000000 0.00000000 0.29881459 1.0 Rh Rh24 1 0.50000000 0.33256466 0.99089512 1.0 Rh Rh25 1 0.50000000 0.66743534 0.99089512 1.0 Rh Rh26 1 0.00000000 0.16904581 0.00915753 1.0 Rh Rh27 1 0.00000000 0.83095419 0.00915753 1.0 Rh Rh28 1 0.50000000 0.29507296 0.43022476 1.0 Rh Rh29 1 0.50000000 0.70492704 0.43022476 1.0 Rh Rh30 1 0.00000000 0.20364662 0.56904010 1.0 Rh Rh31 1 0.00000000 0.79635338 0.56904010 1.0 Rh Rh32 1 0.50000000 0.87235656 0.71192392 1.0 Rh Rh33 1 0.50000000 0.12764344 0.71192392 1.0 Rh Rh34 1 0.00000000 0.62558120 0.28883995 1.0 Rh Rh35 1 0.00000000 0.37441880 0.28883995 1.0