# generated using pymatgen data_Ti12Mn6Ir5Os _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.29405152 _cell_length_b 6.05556787 _cell_length_c 12.88149284 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99999455 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12Mn6Ir5Os _chemical_formula_sum 'Ti12 Mn6 Ir5 Os1' _cell_volume 334.95643271 _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 Ti Ti0 1 0.50000567 0.24877443 0.99843837 1.0 Ti Ti1 1 0.50000567 0.75122557 0.99843837 1.0 Ti Ti2 1 0.99986924 0.25003490 0.16628494 1.0 Ti Ti3 1 0.99986924 0.74996510 0.16628494 1.0 Ti Ti4 1 0.49986851 0.25018686 0.33332746 1.0 Ti Ti5 1 0.49986851 0.74981314 0.33332746 1.0 Ti Ti6 1 0.00000204 0.25003534 0.50037598 1.0 Ti Ti7 1 0.00000204 0.74996466 0.50037598 1.0 Ti Ti8 1 0.50013261 0.24876868 0.66822724 1.0 Ti Ti9 1 0.50013261 0.75123132 0.66822724 1.0 Ti Ti10 1 0.00012543 0.24762066 0.83333636 1.0 Ti Ti11 1 0.00012543 0.75237934 0.83333636 1.0 Mn Mn12 1 0.00000514 0.00000000 0.00141061 1.0 Mn Mn13 1 0.49990016 0.49999900 0.16739659 1.0 Mn Mn14 1 0.99989331 0.00000000 0.33332279 1.0 Mn Mn15 1 0.50000108 0.49999900 0.49925644 1.0 Mn Mn16 1 0.00009583 0.00000000 0.66530587 1.0 Mn Mn17 1 0.50009744 0.49999900 0.83333623 1.0 Ir Ir18 1 0.00000420 0.49999900 0.00036591 1.0 Ir Ir19 1 0.49986876 0.00000000 0.16692351 1.0 Ir Ir20 1 0.99987481 0.49999900 0.33333943 1.0 Ir Ir21 1 0.50000328 0.00000000 0.49973089 1.0 Ir Ir22 1 0.00013357 0.49999900 0.66628970 1.0 Os Os23 1 0.50011741 0.00000000 0.83333936 1.0