# generated using pymatgen data_Hf4Tc5B8Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.06310008 _cell_length_b 8.54303257 _cell_length_c 9.93986601 _cell_angle_alpha 89.89350678 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4Tc5B8Ru5 _chemical_formula_sum 'Hf4 Tc5 B8 Ru5' _cell_volume 260.10759212 _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 0.50000000 0.83916350 0.18131960 1.0 Hf Hf1 1 0.50000000 0.16282113 0.81728882 1.0 Hf Hf2 1 0.50000000 0.65791836 0.68453924 1.0 Hf Hf3 1 0.50000000 0.33868366 0.31984605 1.0 Tc Tc4 1 0.00000000 0.66225188 0.95444433 1.0 Tc Tc5 1 0.00000000 0.33945442 0.04915524 1.0 Tc Tc6 1 0.00000000 0.83839607 0.45195812 1.0 Tc Tc7 1 0.00000000 0.16006660 0.54468808 1.0 Tc Tc8 1 0.00000000 0.40780896 0.76026716 1.0 B B9 1 0.50000000 0.96690243 0.58678113 1.0 B B10 1 0.50000000 0.03302465 0.41182467 1.0 B B11 1 0.50000000 0.84869438 0.90080627 1.0 B B12 1 0.50000000 0.15203269 0.09810852 1.0 B B13 1 0.50000000 0.65081507 0.40172153 1.0 B B14 1 0.50000000 0.34872520 0.60151622 1.0 B B15 1 0.50000000 0.46632379 0.91240477 1.0 B B16 1 0.50000000 0.53368262 0.08769951 1.0 Ru Ru17 1 0.00000000 0.99994647 0.99993289 1.0 Ru Ru18 1 0.00000000 0.59336042 0.23897789 1.0 Ru Ru19 1 0.00000000 0.50025237 0.49796680 1.0 Ru Ru20 1 0.00000000 0.90732056 0.73884623 1.0 Ru Ru21 1 0.00000000 0.09235374 0.25990896 1.0