# generated using pymatgen data_HfZr6Tc12W5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.52262336 _cell_length_b 6.40350129 _cell_length_c 13.55802962 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00002421 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfZr6Tc12W5 _chemical_formula_sum 'Hf1 Zr6 Tc12 W5' _cell_volume 392.64900511 _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 0.00000051 0.50000000 0.00000425 1.0 Zr Zr1 1 0.00000027 0.00000000 0.00000669 1.0 Zr Zr2 1 0.49999646 0.50000000 0.16780572 1.0 Zr Zr3 1 0.99999654 0.00000000 0.33390400 1.0 Zr Zr4 1 0.49999995 0.50000000 0.49999447 1.0 Zr Zr5 1 0.00000320 0.00000000 0.66609044 1.0 Zr Zr6 1 0.50000461 0.50000000 0.83219805 1.0 Tc Tc7 1 0.50000041 0.24220639 0.00000682 1.0 Tc Tc8 1 0.50000041 0.75779361 0.00000682 1.0 Tc Tc9 1 0.99999423 0.24675185 0.17158138 1.0 Tc Tc10 1 0.99999423 0.75324815 0.17158138 1.0 Tc Tc11 1 0.49999563 0.25003266 0.33502885 1.0 Tc Tc12 1 0.49999563 0.74996734 0.33502885 1.0 Tc Tc13 1 0.99999987 0.25020368 0.49999494 1.0 Tc Tc14 1 0.99999987 0.74979632 0.49999494 1.0 Tc Tc15 1 0.50000435 0.25003443 0.66496576 1.0 Tc Tc16 1 0.50000435 0.74996557 0.66496576 1.0 Tc Tc17 1 0.00000652 0.24674957 0.82842273 1.0 Tc Tc18 1 0.00000652 0.75325043 0.82842273 1.0 W W19 1 0.49999791 0.00000000 0.16725744 1.0 W W20 1 0.99999814 0.50000000 0.33424801 1.0 W W21 1 0.49999991 0.00000000 0.49999604 1.0 W W22 1 0.00000214 0.50000000 0.66574884 1.0 W W23 1 0.50000234 0.00000000 0.83274608 1.0