# generated using pymatgen data_Ti12Mo6IrPt5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.42834980 _cell_length_b 6.24654827 _cell_length_c 13.28411626 _cell_angle_alpha 90.00005163 _cell_angle_beta 90.00014376 _cell_angle_gamma 89.99996521 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12Mo6IrPt5 _chemical_formula_sum 'Ti12 Mo6 Ir1 Pt5' _cell_volume 367.46390628 _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 0.49999455 0.24794821 0.99727533 1.0 Ti Ti1 1 0.49999112 0.75205094 0.99727518 1.0 Ti Ti2 1 0.00005454 0.25038364 0.16618974 1.0 Ti Ti3 1 0.00005422 0.74961247 0.16618979 1.0 Ti Ti4 1 0.50005861 0.24995403 0.33336121 1.0 Ti Ti5 1 0.50006077 0.75004162 0.33336091 1.0 Ti Ti6 1 0.99999954 0.25035131 0.50050405 1.0 Ti Ti7 1 0.99999868 0.74964576 0.50050367 1.0 Ti Ti8 1 0.49994081 0.24797476 0.66935709 1.0 Ti Ti9 1 0.49993781 0.75202405 0.66935755 1.0 Ti Ti10 1 0.99994862 0.24534721 0.83330141 1.0 Ti Ti11 1 0.99994514 0.75465120 0.83330201 1.0 Mo Mo12 1 0.99999704 0.99998754 0.00081020 1.0 Mo Mo13 1 0.50005241 0.50001020 0.16655910 1.0 Mo Mo14 1 0.00005419 0.99998471 0.33336098 1.0 Mo Mo15 1 0.50000195 0.50001075 0.50014072 1.0 Mo Mo16 1 0.99994541 0.99998873 0.66583070 1.0 Mo Mo17 1 0.49994802 0.50001044 0.83330249 1.0 Ir Ir18 1 0.49994608 0.99999066 0.83330376 1.0 Pt Pt19 1 0.99999249 0.50000907 0.99967259 1.0 Pt Pt20 1 0.50005961 0.99999568 0.16660356 1.0 Pt Pt21 1 0.00007171 0.50000335 0.33337794 1.0 Pt Pt22 1 0.49999873 0.99999702 0.50010349 1.0 Pt Pt23 1 0.99994896 0.50001666 0.66695653 1.0