# generated using pymatgen data_HfTa11(BOs)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.10702347 _cell_length_b 9.05574010 _cell_length_c 15.76498626 _cell_angle_alpha 89.92141208 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTa11(BOs)12 _chemical_formula_sum 'Hf1 Ta11 B12 Os12' _cell_volume 443.56949601 _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 Hf Hf0 1 0.00000000 0.81600666 0.70621571 1.0 Ta Ta1 1 0.00000000 0.79851723 0.49452836 1.0 Ta Ta2 1 0.00000000 0.19974406 0.50419526 1.0 Ta Ta3 1 0.00000000 0.29894758 0.00442614 1.0 Ta Ta4 1 0.00000000 0.70110201 0.99649685 1.0 Ta Ta5 1 0.00000000 0.51527332 0.59320522 1.0 Ta Ta6 1 0.00000000 0.48337227 0.40653104 1.0 Ta Ta7 1 0.00000000 0.01627751 0.90670161 1.0 Ta Ta8 1 0.00000000 0.98404238 0.09348319 1.0 Ta Ta9 1 0.00000000 0.68758907 0.20262964 1.0 Ta Ta10 1 0.00000000 0.31454524 0.79667107 1.0 Ta Ta11 1 0.00000000 0.18731580 0.29681622 1.0 B B12 1 0.50000000 0.60375433 0.49647816 1.0 B B13 1 0.50000000 0.39457004 0.50310142 1.0 B B14 1 0.50000000 0.10465186 0.00290506 1.0 B B15 1 0.50000000 0.89590354 0.99747560 1.0 B B16 1 0.00000000 0.60955476 0.83273246 1.0 B B17 1 0.00000000 0.39035709 0.16757188 1.0 B B18 1 0.00000000 0.10920324 0.66696231 1.0 B B19 1 0.00000000 0.89017830 0.33216177 1.0 B B20 1 0.50000000 0.71340620 0.59517248 1.0 B B21 1 0.50000000 0.28373589 0.40122757 1.0 B B22 1 0.50000000 0.21561125 0.90206273 1.0 B B23 1 0.50000000 0.78479272 0.09861959 1.0 Os Os24 1 0.50000000 0.71886207 0.35487444 1.0 Os Os25 1 0.50000000 0.28032103 0.64334027 1.0 Os Os26 1 0.50000000 0.21947746 0.14436940 1.0 Os Os27 1 0.50000000 0.77986647 0.85847075 1.0 Os Os28 1 0.50000000 0.51570994 0.09444965 1.0 Os Os29 1 0.50000000 0.48364778 0.90623108 1.0 Os Os30 1 0.50000000 0.01589915 0.40506652 1.0 Os Os31 1 0.50000000 0.98403526 0.59365229 1.0 Os Os32 1 0.50000000 0.56078589 0.73471615 1.0 Os Os33 1 0.50000000 0.43792417 0.26584984 1.0 Os Os34 1 0.50000000 0.06645651 0.76657544 1.0 Os Os35 1 0.50000000 0.93856390 0.23403084 1.0