# generated using pymatgen data_Be17(NbNi)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52219379 _cell_length_b 7.52219493 _cell_length_c 7.52219422 _cell_angle_alpha 60.07080175 _cell_angle_beta 60.07080622 _cell_angle_gamma 60.07079893 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be17(NbNi)6 _chemical_formula_sum 'Be17 Nb6 Ni6' _cell_volume 301.44975385 _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 Be Be0 1 0.32467353 0.32467353 0.32467353 1.0 Be Be1 1 0.67532647 0.67532647 0.67532647 1.0 Be Be2 1 0.32648764 0.32648764 0.02310807 1.0 Be Be3 1 0.32648764 0.02310807 0.32648764 1.0 Be Be4 1 0.67351236 0.67351236 0.97689193 1.0 Be Be5 1 0.67351236 0.97689193 0.67351236 1.0 Be Be6 1 0.02310807 0.32648764 0.32648764 1.0 Be Be7 1 0.97689193 0.67351236 0.67351236 1.0 Be Be8 1 0.50000000 0.00000000 0.00000000 1.0 Be Be9 1 0.00000000 0.50000000 0.50000000 1.0 Be Be10 1 0.00000000 0.50000000 0.00000000 1.0 Be Be11 1 0.50000000 0.00000000 0.50000000 1.0 Be Be12 1 0.00000000 0.00000000 0.50000000 1.0 Be Be13 1 0.50000000 0.50000000 0.00000000 1.0 Be Be14 1 0.00000000 0.00000000 0.00000000 1.0 Be Be15 1 0.12165971 0.12165971 0.12165971 1.0 Be Be16 1 0.87834029 0.87834029 0.87834029 1.0 Nb Nb17 1 0.70260090 0.29591255 0.29591255 1.0 Nb Nb18 1 0.29739910 0.70408745 0.70408745 1.0 Nb Nb19 1 0.29591255 0.70260090 0.29591255 1.0 Nb Nb20 1 0.70408745 0.29739910 0.70408745 1.0 Nb Nb21 1 0.29591255 0.29591255 0.70260090 1.0 Nb Nb22 1 0.70408745 0.70408745 0.29739910 1.0 Ni Ni23 1 0.12023629 0.12023629 0.63542263 1.0 Ni Ni24 1 0.12023629 0.63542263 0.12023629 1.0 Ni Ni25 1 0.87976371 0.87976371 0.36457737 1.0 Ni Ni26 1 0.87976371 0.36457737 0.87976371 1.0 Ni Ni27 1 0.63542263 0.12023629 0.12023629 1.0 Ni Ni28 1 0.36457737 0.87976371 0.87976371 1.0