# generated using pymatgen data_Zr6Al16Co3Cu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53470421 _cell_length_b 8.51592982 _cell_length_c 8.53470417 _cell_angle_alpha 60.07273483 _cell_angle_beta 59.85452822 _cell_angle_gamma 60.07273689 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Al16Co3Cu4 _chemical_formula_sum 'Zr6 Al16 Co3 Cu4' _cell_volume 438.62141218 _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 0.69086240 0.69086240 0.30913760 1.0 Zr Zr1 1 0.30171874 0.69828126 0.30171874 1.0 Zr Zr2 1 0.69086240 0.30913760 0.30913760 1.0 Zr Zr3 1 0.30913760 0.30913760 0.69086240 1.0 Zr Zr4 1 0.69828126 0.30171874 0.69828126 1.0 Zr Zr5 1 0.30913760 0.69086240 0.69086240 1.0 Al Al6 1 0.87476881 0.88649670 0.35223879 1.0 Al Al7 1 0.88649670 0.35223879 0.88649670 1.0 Al Al8 1 0.35223879 0.88649670 0.87476881 1.0 Al Al9 1 0.88649670 0.87476881 0.88649670 1.0 Al Al10 1 0.12523119 0.11350330 0.64776121 1.0 Al Al11 1 0.11350330 0.64776121 0.11350330 1.0 Al Al12 1 0.64776121 0.11350330 0.12523119 1.0 Al Al13 1 0.11350330 0.12523119 0.11350330 1.0 Al Al14 1 0.67212997 0.66475117 0.99836868 1.0 Al Al15 1 0.66475117 0.99836868 0.66475117 1.0 Al Al16 1 0.99836868 0.66475117 0.67212997 1.0 Al Al17 1 0.66475117 0.67212997 0.66475117 1.0 Al Al18 1 0.32787003 0.33524883 0.00163132 1.0 Al Al19 1 0.33524883 0.00163132 0.33524883 1.0 Al Al20 1 0.00163132 0.33524883 0.32787003 1.0 Al Al21 1 0.33524883 0.32787003 0.33524883 1.0 Co Co22 1 0.00000000 0.00000000 0.00000000 1.0 Co Co23 1 0.50000000 0.00000000 0.50000000 1.0 Co Co24 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu25 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu26 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu27 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu28 1 0.50000000 0.00000000 0.00000000 1.0