# generated using pymatgen data_Be4Nb2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.12592955 _cell_length_b 8.56690405 _cell_length_c 10.03889487 _cell_angle_alpha 90.00079218 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be4Nb2Ru5 _chemical_formula_sum 'Be8 Nb4 Ru10' _cell_volume 268.83697173 _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 0.50000000 0.96415483 0.59447962 1.0 Be Be1 1 0.50000000 0.03584517 0.40552038 1.0 Be Be2 1 0.50000000 0.84436718 0.90459662 1.0 Be Be3 1 0.50000000 0.15563282 0.09540338 1.0 Be Be4 1 0.50000000 0.65560987 0.40456955 1.0 Be Be5 1 0.50000000 0.34439013 0.59543045 1.0 Be Be6 1 0.50000000 0.46418032 0.90555439 1.0 Be Be7 1 0.50000000 0.53581968 0.09444561 1.0 Nb Nb8 1 0.50000000 0.84202587 0.18237248 1.0 Nb Nb9 1 0.50000000 0.15797413 0.81762752 1.0 Nb Nb10 1 0.50000000 0.65794368 0.68245378 1.0 Nb Nb11 1 0.50000000 0.34205632 0.31754622 1.0 Ru Ru12 1 0.00000000 0.66055166 0.95165680 1.0 Ru Ru13 1 0.00000000 0.33944834 0.04834320 1.0 Ru Ru14 1 0.00000000 0.83944141 0.45162021 1.0 Ru Ru15 1 0.00000000 0.16055859 0.54837979 1.0 Ru Ru16 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru17 1 0.00000000 0.40094475 0.75835724 1.0 Ru Ru18 1 0.00000000 0.59905525 0.24164276 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru20 1 0.00000000 0.90095514 0.74170771 1.0 Ru Ru21 1 0.00000000 0.09904486 0.25829229 1.0