# generated using pymatgen data_Zr6Ta3Al13Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.78510024 _cell_length_b 8.78510143 _cell_length_c 8.78510017 _cell_angle_alpha 59.89838628 _cell_angle_beta 59.89838125 _cell_angle_gamma 59.89838656 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Ta3Al13Ir7 _chemical_formula_sum 'Zr6 Ta3 Al13 Ir7' _cell_volume 478.32476712 _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 Zr Zr0 1 0.69084988 0.69084988 0.30614567 1.0 Zr Zr1 1 0.31251626 0.68594077 0.31251626 1.0 Zr Zr2 1 0.68594077 0.31251626 0.31251626 1.0 Zr Zr3 1 0.31251626 0.31251626 0.68594077 1.0 Zr Zr4 1 0.69084988 0.30614567 0.69084988 1.0 Zr Zr5 1 0.30614567 0.69084988 0.69084988 1.0 Ta Ta6 1 0.87842555 0.87842555 0.36210988 1.0 Ta Ta7 1 0.87842555 0.36210988 0.87842555 1.0 Ta Ta8 1 0.36210988 0.87842555 0.87842555 1.0 Al Al9 1 0.88073490 0.88073490 0.88073490 1.0 Al Al10 1 0.11973702 0.11973702 0.63560530 1.0 Al Al11 1 0.11973702 0.63560530 0.11973702 1.0 Al Al12 1 0.63560530 0.11973702 0.11973702 1.0 Al Al13 1 0.12271872 0.12271872 0.12271872 1.0 Al Al14 1 0.66480434 0.66480434 0.01465264 1.0 Al Al15 1 0.66480434 0.01465264 0.66480434 1.0 Al Al16 1 0.01465264 0.66480434 0.66480434 1.0 Al Al17 1 0.65731754 0.65731754 0.65731754 1.0 Al Al18 1 0.33762703 0.33762703 0.98931979 1.0 Al Al19 1 0.33762703 0.98931979 0.33762703 1.0 Al Al20 1 0.98931979 0.33762703 0.33762703 1.0 Al Al21 1 0.33658891 0.33658891 0.33658891 1.0 Ir Ir22 1 0.00217453 0.00217453 0.00217453 1.0 Ir Ir23 1 0.99871257 0.99871257 0.49600379 1.0 Ir Ir24 1 0.50426988 0.99680350 0.50426988 1.0 Ir Ir25 1 0.99680350 0.50426988 0.50426988 1.0 Ir Ir26 1 0.50426988 0.50426988 0.99680350 1.0 Ir Ir27 1 0.99871257 0.49600379 0.99871257 1.0 Ir Ir28 1 0.49600379 0.99871257 0.99871257 1.0