# generated using pymatgen data_HfZr7(Si4W3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.59608806 _cell_length_b 6.76434364 _cell_length_c 12.55641893 _cell_angle_alpha 89.97312823 _cell_angle_beta 89.97546018 _cell_angle_gamma 90.02145997 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfZr7(Si4W3)4 _chemical_formula_sum 'Hf1 Zr7 Si16 W12' _cell_volume 560.24473857 _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 0.50803294 0.66913379 0.59276105 1.0 Zr Zr1 1 0.99339548 0.16934737 0.09306928 1.0 Zr Zr2 1 0.00690217 0.83046727 0.90665740 1.0 Zr Zr3 1 0.50666176 0.66934386 0.90746079 1.0 Zr Zr4 1 0.00709082 0.83033066 0.59298424 1.0 Zr Zr5 1 0.49356382 0.33030686 0.09276047 1.0 Zr Zr6 1 0.99381858 0.16985814 0.40723448 1.0 Zr Zr7 1 0.49353591 0.33089517 0.40767543 1.0 Si Si8 1 0.03356878 0.12075735 0.74963025 1.0 Si Si9 1 0.96584225 0.87929412 0.25036830 1.0 Si Si10 1 0.46621467 0.62004291 0.24988104 1.0 Si Si11 1 0.53301891 0.38075364 0.74978588 1.0 Si Si12 1 0.29986810 0.86088362 0.74934196 1.0 Si Si13 1 0.70102068 0.13854816 0.25043912 1.0 Si Si14 1 0.20159589 0.36122051 0.25010432 1.0 Si Si15 1 0.79800609 0.63879019 0.74961988 1.0 Si Si16 1 0.16661466 0.45913491 0.54349153 1.0 Si Si17 1 0.83447001 0.54171767 0.45712188 1.0 Si Si18 1 0.33427132 0.95823357 0.45739832 1.0 Si Si19 1 0.83453742 0.54162002 0.04312611 1.0 Si Si20 1 0.66550217 0.04051186 0.54345022 1.0 Si Si21 1 0.16533124 0.45831046 0.95655557 1.0 Si Si22 1 0.66570112 0.04149908 0.95658645 1.0 Si Si23 1 0.33427206 0.95863456 0.04308004 1.0 W W24 1 0.16606178 0.51012204 0.74932826 1.0 W W25 1 0.83454556 0.49080154 0.25023744 1.0 W W26 1 0.33413237 0.00908038 0.25026480 1.0 W W27 1 0.66569964 0.99018312 0.74933702 1.0 W W28 1 0.33110763 0.16420426 0.62397055 1.0 W W29 1 0.66755617 0.83469013 0.37689882 1.0 W W30 1 0.16972371 0.66389962 0.37622040 1.0 W W31 1 0.66859520 0.83613845 0.12412680 1.0 W W32 1 0.82891987 0.33708120 0.62378668 1.0 W W33 1 0.33136226 0.16402049 0.87557327 1.0 W W34 1 0.83043837 0.33644761 0.87563353 1.0 W W35 1 0.16902458 0.66369839 0.12404141 1.0