# generated using pymatgen data_Be46Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.18019966 _cell_length_b 4.18019966 _cell_length_c 32.84404200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999461 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be46Ru7 _chemical_formula_sum 'Be46 Ru7' _cell_volume 497.02851487 _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 0.33333300 0.66666700 0.87567400 1.0 Be Be1 1 0.33333300 0.66666700 0.54131500 1.0 Be Be2 1 0.33333300 0.66666700 0.20725500 1.0 Be Be3 1 0.33333300 0.66666700 0.79100100 1.0 Be Be4 1 0.33333300 0.66666700 0.45929200 1.0 Be Be5 1 0.33333300 0.66666700 0.12531100 1.0 Be Be6 1 0.00000000 0.00000000 0.88555200 1.0 Be Be7 1 0.00000000 0.00000000 0.55215200 1.0 Be Be8 1 0.00000000 0.00000000 0.21886300 1.0 Be Be9 1 0.00000000 0.00000000 0.78133000 1.0 Be Be10 1 0.00000000 0.00000000 0.44788800 1.0 Be Be11 1 0.00000000 0.00000000 0.11425500 1.0 Be Be12 1 0.16991600 0.83008400 0.93824400 1.0 Be Be13 1 0.16668700 0.83331300 0.60561000 1.0 Be Be14 1 0.17083600 0.82916400 0.27009400 1.0 Be Be15 1 0.16991600 0.33983200 0.93824400 1.0 Be Be16 1 0.16668700 0.33337500 0.60561000 1.0 Be Be17 1 0.17083600 0.34167300 0.27009400 1.0 Be Be18 1 0.66016800 0.83008400 0.93824400 1.0 Be Be19 1 0.66662500 0.83331300 0.60561000 1.0 Be Be20 1 0.65832700 0.82916400 0.27009400 1.0 Be Be21 1 0.16686000 0.83314000 0.72754700 1.0 Be Be22 1 0.17099800 0.82900200 0.39665600 1.0 Be Be23 1 0.16969000 0.83031000 0.06181900 1.0 Be Be24 1 0.16686000 0.33372000 0.72754700 1.0 Be Be25 1 0.17099800 0.34199600 0.39665600 1.0 Be Be26 1 0.16969000 0.33937900 0.06181900 1.0 Be Be27 1 0.66628000 0.83314000 0.72754700 1.0 Be Be28 1 0.65800400 0.82900200 0.39665600 1.0 Be Be29 1 0.66062100 0.83031000 0.06181900 1.0 Be Be30 1 0.66666700 0.33333300 0.96751500 1.0 Be Be31 1 0.66666700 0.33333300 0.63443100 1.0 Be Be32 1 0.66666700 0.33333300 0.30237200 1.0 Be Be33 1 0.66666700 0.33333300 0.69925900 1.0 Be Be34 1 0.66666700 0.33333300 0.36403300 1.0 Be Be35 1 0.66666700 0.33333300 0.03238600 1.0 Be Be36 1 0.82951700 0.17048300 0.83380600 1.0 Be Be37 1 0.82978100 0.17021900 0.49980800 1.0 Be Be38 1 0.82981300 0.17018700 0.16644500 1.0 Be Be39 1 0.82951700 0.65903300 0.83380600 1.0 Be Be40 1 0.82978100 0.65956100 0.49980800 1.0 Be Be41 1 0.82981300 0.65962700 0.16644500 1.0 Be Be42 1 0.34096700 0.17048300 0.83380600 1.0 Be Be43 1 0.34043900 0.17021900 0.49980800 1.0 Be Be44 1 0.34037300 0.17018700 0.16644500 1.0 Be Be45 1 0.00000000 0.00000000 0.66671900 1.0 Ru Ru46 1 0.66666700 0.33333300 0.89909000 1.0 Ru Ru47 1 0.66666700 0.33333300 0.56455400 1.0 Ru Ru48 1 0.66666700 0.33333300 0.23114600 1.0 Ru Ru49 1 0.66666700 0.33333300 0.76952900 1.0 Ru Ru50 1 0.66666700 0.33333300 0.43489300 1.0 Ru Ru51 1 0.66666700 0.33333300 0.10088300 1.0 Ru Ru52 1 0.33333300 0.66666700 0.33321500 1.0