# generated using pymatgen data_MnBe6Si5Ir12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.07285971 _cell_length_b 5.76935882 _cell_length_c 12.23866268 _cell_angle_alpha 90.00007046 _cell_angle_beta 90.00097019 _cell_angle_gamma 89.99994479 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnBe6Si5Ir12 _chemical_formula_sum 'Mn1 Be6 Si5 Ir12' _cell_volume 287.58151454 _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 Mn Mn0 1 0.99997601 0.99997212 0.99999986 1.0 Be Be1 1 0.99996795 0.49995557 0.99999984 1.0 Be Be2 1 0.49993057 0.99998640 0.15707787 1.0 Be Be3 1 0.99997750 0.50000373 0.33255977 1.0 Be Be4 1 0.50001572 0.00001924 0.50000219 1.0 Be Be5 1 0.00003462 0.50000431 0.66744043 1.0 Be Be6 1 0.50006549 0.99998691 0.84292001 1.0 Si Si7 1 0.49993034 0.49998977 0.16672170 1.0 Si Si8 1 0.99995699 0.00000818 0.33360039 1.0 Si Si9 1 0.50001287 0.50002088 0.50000061 1.0 Si Si10 1 0.00006303 0.00001001 0.66640046 1.0 Si Si11 1 0.50006511 0.49999197 0.83327705 1.0 Ir Ir12 1 0.49998209 0.26066267 0.99999874 1.0 Ir Ir13 1 0.49998364 0.73927925 0.99999882 1.0 Ir Ir14 1 0.99993927 0.25367164 0.17398300 1.0 Ir Ir15 1 0.99993807 0.74630828 0.17398246 1.0 Ir Ir16 1 0.49996553 0.24970196 0.33658115 1.0 Ir Ir17 1 0.49996156 0.75033842 0.33658083 1.0 Ir Ir18 1 0.00001258 0.24989398 0.49999945 1.0 Ir Ir19 1 0.00001263 0.75016540 0.50000093 1.0 Ir Ir20 1 0.50005251 0.24970394 0.66342047 1.0 Ir Ir21 1 0.50005028 0.75033708 0.66342190 1.0 Ir Ir22 1 0.00005366 0.25367476 0.82601760 1.0 Ir Ir23 1 0.00005996 0.74631253 0.82601747 1.0