# generated using pymatgen data_Ta5Mn(AlRu2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.33234349 _cell_length_b 6.12348613 _cell_length_c 12.97669981 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00031957 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta5Mn(AlRu2)6 _chemical_formula_sum 'Ta5 Mn1 Al6 Ru12' _cell_volume 344.25945602 _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 Ta Ta0 1 0.00000325 0.50000100 0.99687931 1.0 Ta Ta1 1 0.49991553 0.00000000 0.16465377 1.0 Ta Ta2 1 0.99990381 0.50000100 0.33333513 1.0 Ta Ta3 1 0.49998429 0.00000000 0.50201732 1.0 Ta Ta4 1 0.00010346 0.50000100 0.66974684 1.0 Mn Mn5 1 0.50010818 0.00000000 0.83333482 1.0 Al Al6 1 0.99998316 0.00000000 0.99792539 1.0 Al Al7 1 0.49993111 0.50000100 0.16450549 1.0 Al Al8 1 0.99986926 0.00000000 0.33333807 1.0 Al Al9 1 0.49998719 0.50000100 0.50210662 1.0 Al Al10 1 0.00009214 0.00000000 0.66886293 1.0 Al Al11 1 0.50012930 0.50000100 0.83334413 1.0 Ru Ru12 1 0.50000092 0.24716241 0.99698471 1.0 Ru Ru13 1 0.50000092 0.75283759 0.99698471 1.0 Ru Ru14 1 0.99991656 0.25025310 0.16565002 1.0 Ru Ru15 1 0.99991656 0.74974690 0.16565002 1.0 Ru Ru16 1 0.49989234 0.24983025 0.33330901 1.0 Ru Ru17 1 0.49989234 0.75016975 0.33330901 1.0 Ru Ru18 1 0.99998609 0.25023302 0.50098982 1.0 Ru Ru19 1 0.99998609 0.74976598 0.50098982 1.0 Ru Ru20 1 0.50009442 0.24718582 0.66968507 1.0 Ru Ru21 1 0.50009442 0.75281418 0.66968507 1.0 Ru Ru22 1 0.00010235 0.24436961 0.83335595 1.0 Ru Ru23 1 0.00010235 0.75563039 0.83335595 1.0