# generated using pymatgen data_TbLuMnB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.50582919 _cell_length_b 9.06414451 _cell_length_c 11.44549390 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbLuMnB6 _chemical_formula_sum 'Tb4 Lu4 Mn4 B24' _cell_volume 363.70737825 _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 0.82222282 0.08485699 1.0 Tb Tb1 1 0.00000000 0.17777718 0.91514301 1.0 Tb Tb2 1 0.00000000 0.32222282 0.41514301 1.0 Tb Tb3 1 0.00000000 0.67777718 0.58485699 1.0 Lu Lu4 1 0.00000000 0.44322706 0.12974329 1.0 Lu Lu5 1 0.00000000 0.55677294 0.87025671 1.0 Lu Lu6 1 0.00000000 0.94322706 0.37025671 1.0 Lu Lu7 1 0.00000000 0.05677294 0.62974329 1.0 Mn Mn8 1 0.00000000 0.13999231 0.18105731 1.0 Mn Mn9 1 0.00000000 0.86000769 0.81894269 1.0 Mn Mn10 1 0.00000000 0.63999231 0.31894269 1.0 Mn Mn11 1 0.00000000 0.36000769 0.68105731 1.0 B B12 1 0.50000000 0.05507979 0.06870788 1.0 B B13 1 0.50000000 0.94492021 0.93129212 1.0 B B14 1 0.50000000 0.55507979 0.43129212 1.0 B B15 1 0.50000000 0.44492021 0.56870788 1.0 B B16 1 0.50000000 0.24951220 0.08238035 1.0 B B17 1 0.50000000 0.75048780 0.91761965 1.0 B B18 1 0.50000000 0.74951220 0.41761965 1.0 B B19 1 0.50000000 0.25048780 0.58238035 1.0 B B20 1 0.50000000 0.29106798 0.23471283 1.0 B B21 1 0.50000000 0.70893202 0.76528717 1.0 B B22 1 0.50000000 0.79106798 0.26528717 1.0 B B23 1 0.50000000 0.20893202 0.73471283 1.0 B B24 1 0.50000000 0.13049686 0.31505047 1.0 B B25 1 0.50000000 0.86950314 0.68494953 1.0 B B26 1 0.50000000 0.63049686 0.18494953 1.0 B B27 1 0.50000000 0.36950314 0.81505047 1.0 B B28 1 0.50000000 0.48397609 0.28733820 1.0 B B29 1 0.50000000 0.51602391 0.71266180 1.0 B B30 1 0.50000000 0.98397609 0.21266180 1.0 B B31 1 0.50000000 0.01602391 0.78733820 1.0 B B32 1 0.50000000 0.10174647 0.47219585 1.0 B B33 1 0.50000000 0.89825353 0.52780415 1.0 B B34 1 0.50000000 0.60174647 0.02780415 1.0 B B35 1 0.50000000 0.39825353 0.97219585 1.0