# generated using pymatgen data_Ta2BeB2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.06471649 _cell_length_b 9.06471649 _cell_length_c 2.98258240 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2BeB2Ru5 _chemical_formula_sum 'Ta4 Be2 B4 Ru10' _cell_volume 245.07606670 _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 Ta Ta0 1 0.82327999 0.67672001 0.00000000 1.0 Ta Ta1 1 0.17672001 0.32327999 0.00000000 1.0 Ta Ta2 1 0.32327999 0.82327999 0.00000000 1.0 Ta Ta3 1 0.67672001 0.17672001 0.00000000 1.0 Be Be4 1 0.50000000 0.50000000 0.00000000 1.0 Be Be5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.62801150 0.87198850 0.00000000 1.0 B B7 1 0.37198850 0.12801150 0.00000000 1.0 B B8 1 0.12801150 0.62801150 0.00000000 1.0 B B9 1 0.87198850 0.37198850 0.00000000 1.0 Ru Ru10 1 0.56829620 0.70910396 0.50000000 1.0 Ru Ru11 1 0.43170380 0.29089604 0.50000000 1.0 Ru Ru12 1 0.06829620 0.79089604 0.50000000 1.0 Ru Ru13 1 0.93170380 0.20910396 0.50000000 1.0 Ru Ru14 1 0.29089604 0.56829620 0.50000000 1.0 Ru Ru15 1 0.70910396 0.43170380 0.50000000 1.0 Ru Ru16 1 0.20910396 0.06829620 0.50000000 1.0 Ru Ru17 1 0.79089604 0.93170380 0.50000000 1.0 Ru Ru18 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0