# generated using pymatgen data_TmMgB6Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51019069 _cell_length_b 8.86837209 _cell_length_c 11.24261867 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmMgB6Rh _chemical_formula_sum 'Tm4 Mg4 B24 Rh4' _cell_volume 349.97908998 _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 0.50000000 0.31960294 0.41420466 1.0 Tm Tm1 1 0.50000000 0.68039706 0.58579534 1.0 Tm Tm2 1 0.50000000 0.18039706 0.91420466 1.0 Tm Tm3 1 0.50000000 0.81960294 0.08579534 1.0 Mg Mg4 1 0.50000000 0.44687795 0.12003244 1.0 Mg Mg5 1 0.50000000 0.55312205 0.87996756 1.0 Mg Mg6 1 0.50000000 0.05312205 0.62003244 1.0 Mg Mg7 1 0.50000000 0.94687795 0.37996756 1.0 B B8 1 0.00000000 0.10028057 0.47293233 1.0 B B9 1 0.00000000 0.89971943 0.52706767 1.0 B B10 1 0.00000000 0.39971943 0.97293233 1.0 B B11 1 0.00000000 0.60028057 0.02706767 1.0 B B12 1 0.00000000 0.12813457 0.31910972 1.0 B B13 1 0.00000000 0.87186543 0.68089028 1.0 B B14 1 0.00000000 0.37186543 0.81910972 1.0 B B15 1 0.00000000 0.62813457 0.18089028 1.0 B B16 1 0.00000000 0.05538040 0.06667891 1.0 B B17 1 0.00000000 0.94461960 0.93332109 1.0 B B18 1 0.00000000 0.44461960 0.56667891 1.0 B B19 1 0.00000000 0.55538040 0.43332109 1.0 B B20 1 0.00000000 0.48129033 0.28501099 1.0 B B21 1 0.00000000 0.51870967 0.71498901 1.0 B B22 1 0.00000000 0.01870967 0.78501099 1.0 B B23 1 0.00000000 0.98129033 0.21498901 1.0 B B24 1 0.00000000 0.25487130 0.07986707 1.0 B B25 1 0.00000000 0.74512870 0.92013293 1.0 B B26 1 0.00000000 0.24512870 0.57986707 1.0 B B27 1 0.00000000 0.75487130 0.42013293 1.0 B B28 1 0.00000000 0.29371785 0.23515861 1.0 B B29 1 0.00000000 0.70628215 0.76484139 1.0 B B30 1 0.00000000 0.20628215 0.73515861 1.0 B B31 1 0.00000000 0.79371785 0.26484139 1.0 Rh Rh32 1 0.50000000 0.14021944 0.18174937 1.0 Rh Rh33 1 0.50000000 0.85978056 0.81825063 1.0 Rh Rh34 1 0.50000000 0.35978056 0.68174937 1.0 Rh Rh35 1 0.50000000 0.64021944 0.31825063 1.0