# generated using pymatgen data_Be22W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.18146849 _cell_length_b 8.18146688 _cell_length_c 8.18135182 _cell_angle_alpha 60.00046928 _cell_angle_beta 60.00047577 _cell_angle_gamma 60.00093446 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be22W _chemical_formula_sum 'Be44 W2' _cell_volume 387.23863342 _cell_formula_units_Z 2 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 0.00000000 -0.00000000 -0.00000000 1.0 Be Be1 1 0.00000000 -0.00000000 0.50000000 1.0 Be Be2 1 0.50000000 -0.00000000 -0.00000000 1.0 Be Be3 1 0.00000000 0.50000000 -0.00000000 1.0 Be Be4 1 0.50000000 0.50000000 0.50000000 1.0 Be Be5 1 0.50000000 0.50000000 -0.00000000 1.0 Be Be6 1 0.00000000 0.50000000 0.50000000 1.0 Be Be7 1 0.50000000 -0.00000000 0.50000000 1.0 Be Be8 1 0.74043587 0.00956743 0.00958513 1.0 Be Be9 1 0.99042490 0.99042490 0.25957510 1.0 Be Be10 1 0.25957743 0.25957743 0.99042257 1.0 Be Be11 1 0.99043257 0.25956413 0.25958844 1.0 Be Be12 1 0.99043257 0.25956413 0.99041487 1.0 Be Be13 1 0.25956413 0.99043257 0.25958844 1.0 Be Be14 1 0.00956743 0.74043587 0.00958513 1.0 Be Be15 1 0.00957510 0.00957510 0.74042490 1.0 Be Be16 1 0.74042257 0.74042257 0.00957743 1.0 Be Be17 1 0.74043587 0.00956743 0.74041156 1.0 Be Be18 1 0.25956413 0.99043257 0.99041487 1.0 Be Be19 1 0.00956743 0.74043587 0.74041156 1.0 Be Be20 1 0.17628970 0.17628970 0.70405499 1.0 Be Be21 1 0.82369993 0.29595326 0.55664351 1.0 Be Be22 1 0.55663199 0.82371466 0.82371770 1.0 Be Be23 1 0.82371466 0.55663199 0.82371770 1.0 Be Be24 1 0.29595326 0.82369993 0.55664351 1.0 Be Be25 1 0.29594392 0.55664068 0.82370820 1.0 Be Be26 1 0.55664068 0.29594392 0.82370820 1.0 Be Be27 1 0.70404674 0.17630007 0.17629670 1.0 Be Be28 1 0.17630007 0.70404674 0.17629670 1.0 Be Be29 1 0.44336801 0.17628534 0.70406435 1.0 Be Be30 1 0.17628534 0.44336801 0.70406435 1.0 Be Be31 1 0.44336801 0.17628534 0.17628230 1.0 Be Be32 1 0.70404674 0.17630007 0.44335649 1.0 Be Be33 1 0.17630007 0.70404674 0.44335649 1.0 Be Be34 1 0.17628534 0.44336801 0.17628230 1.0 Be Be35 1 0.55663199 0.82371466 0.29593565 1.0 Be Be36 1 0.82371466 0.55663199 0.29593565 1.0 Be Be37 1 0.82371030 0.82371030 0.55663539 1.0 Be Be38 1 0.82371030 0.82371030 0.29594501 1.0 Be Be39 1 0.29595326 0.82369993 0.82370330 1.0 Be Be40 1 0.82369993 0.29595326 0.82370330 1.0 Be Be41 1 0.70405608 0.44335932 0.17629180 1.0 Be Be42 1 0.44335932 0.70405608 0.17629180 1.0 Be Be43 1 0.17628970 0.17628970 0.44336461 1.0 W W44 1 0.37499916 0.37500016 0.37500084 1.0 W W45 1 0.62500084 0.62499984 0.62499916 1.0