# generated using pymatgen data_Tm3Lu5(B6W)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.52348603 _cell_length_b 9.22070594 _cell_length_c 11.59255757 _cell_angle_alpha 89.99956890 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Lu5(B6W)4 _chemical_formula_sum 'Tm3 Lu5 B24 W4' _cell_volume 376.63093393 _cell_formula_units_Z 1 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 0.00000000 0.32021540 0.41392563 1.0 Tm Tm1 1 0.00000000 0.67976260 0.58612393 1.0 Tm Tm2 1 0.00000000 0.82018829 0.08610043 1.0 Lu Lu3 1 0.00000000 0.17989586 0.91396516 1.0 Lu Lu4 1 0.00000000 0.94409164 0.37236317 1.0 Lu Lu5 1 0.00000000 0.05602405 0.62766048 1.0 Lu Lu6 1 0.00000000 0.44393022 0.12739368 1.0 Lu Lu7 1 0.00000000 0.55589091 0.87254245 1.0 B B8 1 0.50000000 0.55164611 0.43522715 1.0 B B9 1 0.50000000 0.44821038 0.56490277 1.0 B B10 1 0.50000000 0.05200853 0.06433679 1.0 B B11 1 0.50000000 0.94864263 0.93521821 1.0 B B12 1 0.50000000 0.75288195 0.42198530 1.0 B B13 1 0.50000000 0.24714523 0.57814965 1.0 B B14 1 0.50000000 0.25269536 0.07732103 1.0 B B15 1 0.50000000 0.74716704 0.92200351 1.0 B B16 1 0.50000000 0.79558802 0.26309293 1.0 B B17 1 0.50000000 0.20430334 0.73736980 1.0 B B18 1 0.50000000 0.29557131 0.23659361 1.0 B B19 1 0.50000000 0.70442420 0.76329353 1.0 B B20 1 0.50000000 0.63085219 0.18194307 1.0 B B21 1 0.50000000 0.36870418 0.81835370 1.0 B B22 1 0.50000000 0.13096001 0.31785302 1.0 B B23 1 0.50000000 0.86915709 0.68208814 1.0 B B24 1 0.50000000 0.97800105 0.21267145 1.0 B B25 1 0.50000000 0.02248515 0.78759094 1.0 B B26 1 0.50000000 0.47787464 0.28705484 1.0 B B27 1 0.50000000 0.52200742 0.71297081 1.0 B B28 1 0.50000000 0.59998750 0.02776756 1.0 B B29 1 0.50000000 0.39949675 0.97205072 1.0 B B30 1 0.50000000 0.09999329 0.47226215 1.0 B B31 1 0.50000000 0.90012007 0.52780594 1.0 W W32 1 0.00000000 0.63987377 0.31992729 1.0 W W33 1 0.00000000 0.36000523 0.68030145 1.0 W W34 1 0.00000000 0.13991151 0.17978294 1.0 W W35 1 0.00000000 0.86028807 0.82000781 1.0