# generated using pymatgen data_Zr3Al3IrPt2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04167124 _cell_length_b 7.04167186 _cell_length_c 7.37804063 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000162 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Al3IrPt2 _chemical_formula_sum 'Zr6 Al6 Ir2 Pt4' _cell_volume 316.82773712 _cell_formula_units_Z 2 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 Zr Zr0 1 0.01412407 0.59914501 0.74264941 1.0 Zr Zr1 1 0.98587593 0.58502094 0.25735059 1.0 Zr Zr2 1 0.59914501 0.01412407 0.25735059 1.0 Zr Zr3 1 0.58502094 0.98587593 0.74264941 1.0 Zr Zr4 1 0.41497906 0.40085499 0.25735059 1.0 Zr Zr5 1 0.40085499 0.41497906 0.74264941 1.0 Al Al6 1 0.00000000 0.25379440 0.50000000 1.0 Al Al7 1 0.74317490 0.74317490 0.00000000 1.0 Al Al8 1 0.00000000 0.25682510 0.00000000 1.0 Al Al9 1 0.25379440 0.00000000 0.50000000 1.0 Al Al10 1 0.25682510 1.00000000 0.00000000 1.0 Al Al11 1 0.74620560 0.74620560 0.50000000 1.0 Ir Ir12 1 0.33333300 0.66666700 0.48194164 1.0 Ir Ir13 1 0.66666700 0.33333300 0.51805836 1.0 Pt Pt14 1 0.66666700 0.33333300 0.97721979 1.0 Pt Pt15 1 0.00000000 0.00000000 0.24840103 1.0 Pt Pt16 1 0.00000000 0.00000000 0.75159897 1.0 Pt Pt17 1 0.33333300 0.66666700 0.02278021 1.0