# generated using pymatgen data_Na5Mn2Si12Ir17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.78338935 _cell_length_b 12.68293840 _cell_length_c 3.96182465 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.26234457 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Mn2Si12Ir17 _chemical_formula_sum 'Na5 Mn2 Si12 Ir17' _cell_volume 554.80148850 _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 Na Na0 1 0.33535378 0.67139015 0.50000000 1.0 Na Na1 1 0.66396363 0.32860985 0.50000000 1.0 Na Na2 1 0.00046882 0.81876071 0.00000000 1.0 Na Na3 1 0.18170811 0.18123929 0.00000000 1.0 Na Na4 1 0.81489342 0.00000000 0.00000000 1.0 Mn Mn5 1 0.99992917 0.43775425 0.50000000 1.0 Mn Mn6 1 0.56217492 0.56224575 0.50000000 1.0 Si Si7 1 0.00088662 0.63202548 0.50000000 1.0 Si Si8 1 0.36886114 0.36797452 0.50000000 1.0 Si Si9 1 0.62541790 0.00000000 0.50000000 1.0 Si Si10 1 0.51907793 0.69271798 0.00000000 1.0 Si Si11 1 0.31186188 0.83261524 0.00000000 1.0 Si Si12 1 0.17731531 0.48439423 0.00000000 1.0 Si Si13 1 0.47924663 0.16738476 0.00000000 1.0 Si Si14 1 0.69292008 0.51560577 0.00000000 1.0 Si Si15 1 0.82635995 0.30728202 0.00000000 1.0 Si Si16 1 0.99946373 0.18342577 0.50000000 1.0 Si Si17 1 0.81603796 0.81657423 0.50000000 1.0 Si Si18 1 0.17940245 0.00000000 0.50000000 1.0 Ir Ir19 1 0.51277377 0.87580746 0.00000000 1.0 Ir Ir20 1 0.12612434 0.63738508 0.00000000 1.0 Ir Ir21 1 0.36514396 0.48637767 0.00000000 1.0 Ir Ir22 1 0.48874025 0.36261492 0.00000000 1.0 Ir Ir23 1 0.87876729 0.51362233 0.00000000 1.0 Ir Ir24 1 0.63696731 0.12419254 0.00000000 1.0 Ir Ir25 1 0.44308076 0.00000000 0.50000000 1.0 Ir Ir26 1 0.00110914 0.28450686 0.00000000 1.0 Ir Ir27 1 0.71660227 0.71549314 0.00000000 1.0 Ir Ir28 1 0.28052639 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62244460 0.80629586 0.50000000 1.0 Ir Ir30 1 0.19285926 0.81591759 0.50000000 1.0 Ir Ir31 1 0.18415704 0.37904956 0.50000000 1.0 Ir Ir32 1 0.37694167 0.18408241 0.50000000 1.0 Ir Ir33 1 0.80510748 0.62095044 0.50000000 1.0 Ir Ir34 1 0.81614675 0.19370414 0.50000000 1.0 Ir Ir35 1 0.99716028 0.00000000 0.50000000 1.0