# generated using pymatgen data_Ta2Ni20B6W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.40932333 _cell_length_b 7.40919298 _cell_length_c 7.40919548 _cell_angle_alpha 60.00519161 _cell_angle_beta 60.00529726 _cell_angle_gamma 60.00643523 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2Ni20B6W _chemical_formula_sum 'Ta2 Ni20 B6 W1' _cell_volume 287.64779621 _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 Ta Ta0 1 0.25001323 0.25000770 0.24999108 1.0 Ta Ta1 1 0.74998677 0.74999230 0.75000892 1.0 Ni Ni2 1 0.34226919 0.00003470 0.00001332 1.0 Ni Ni3 1 0.65773081 0.99996530 0.99998668 1.0 Ni Ni4 1 0.00001273 0.34229446 0.65769973 1.0 Ni Ni5 1 0.99998727 0.65770554 0.34230027 1.0 Ni Ni6 1 0.00002295 0.34228544 0.00000228 1.0 Ni Ni7 1 0.65771293 0.99997663 0.34231569 1.0 Ni Ni8 1 0.99997705 0.65771456 0.99999772 1.0 Ni Ni9 1 0.34228707 0.00002337 0.65768431 1.0 Ni Ni10 1 0.00000859 0.00001228 0.34226248 1.0 Ni Ni11 1 0.99999141 0.99998772 0.65773752 1.0 Ni Ni12 1 0.65772168 0.34230135 0.99999107 1.0 Ni Ni13 1 0.34227832 0.65769865 0.00000893 1.0 Ni Ni14 1 0.38436413 0.38435782 0.38437398 1.0 Ni Ni15 1 0.61563587 0.61564218 0.61562602 1.0 Ni Ni16 1 0.38434482 0.38435469 0.84692870 1.0 Ni Ni17 1 0.38437053 0.84693270 0.38434757 1.0 Ni Ni18 1 0.61565518 0.61564531 0.15307130 1.0 Ni Ni19 1 0.61562947 0.15306730 0.61565243 1.0 Ni Ni20 1 0.84694888 0.38436754 0.38433313 1.0 Ni Ni21 1 0.15305112 0.61563246 0.61566687 1.0 B B22 1 0.73173146 0.26826663 0.26826097 1.0 B B23 1 0.26826854 0.73173337 0.73173903 1.0 B B24 1 0.26827428 0.73172851 0.26826241 1.0 B B25 1 0.73172572 0.26827149 0.73173759 1.0 B B26 1 0.26826663 0.26826049 0.73173586 1.0 B B27 1 0.73173337 0.73173951 0.26826414 1.0 W W28 1 0.00000000 0.00000000 0.00000000 1.0