# generated using pymatgen data_Er2Al17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.43256309 _cell_length_b 9.43256309 _cell_length_c 8.83843900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999364 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er2Al17 _chemical_formula_sum 'Er4 Al34' _cell_volume 681.02909471 _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 Er Er0 1 0.00000000 0.00000000 0.25000000 1.0 Er Er1 1 0.00000000 0.00000000 0.75000000 1.0 Er Er2 1 0.33333300 0.66666700 0.75000000 1.0 Er Er3 1 0.66666700 0.33333300 0.25000000 1.0 Al Al4 1 0.33333300 0.66666700 0.39866400 1.0 Al Al5 1 0.66666700 0.33333300 0.60133600 1.0 Al Al6 1 0.66666700 0.33333300 0.89866400 1.0 Al Al7 1 0.33333300 0.66666700 0.10133600 1.0 Al Al8 1 0.50000000 0.50000000 0.50000000 1.0 Al Al9 1 0.50000000 0.00000000 0.50000000 1.0 Al Al10 1 0.00000000 0.50000000 0.50000000 1.0 Al Al11 1 0.50000000 0.50000000 0.00000000 1.0 Al Al12 1 0.50000000 0.00000000 0.00000000 1.0 Al Al13 1 0.00000000 0.50000000 0.00000000 1.0 Al Al14 1 0.32847600 0.36075300 0.25000000 1.0 Al Al15 1 0.63924700 0.96772300 0.25000000 1.0 Al Al16 1 0.03227700 0.67152400 0.25000000 1.0 Al Al17 1 0.63924700 0.67152400 0.25000000 1.0 Al Al18 1 0.03227700 0.36075300 0.25000000 1.0 Al Al19 1 0.32847600 0.96772300 0.25000000 1.0 Al Al20 1 0.67152400 0.63924700 0.75000000 1.0 Al Al21 1 0.36075300 0.03227700 0.75000000 1.0 Al Al22 1 0.96772300 0.32847600 0.75000000 1.0 Al Al23 1 0.36075300 0.32847600 0.75000000 1.0 Al Al24 1 0.96772300 0.63924700 0.75000000 1.0 Al Al25 1 0.67152400 0.03227700 0.75000000 1.0 Al Al26 1 0.16317000 0.83683000 0.52243800 1.0 Al Al27 1 0.16317000 0.32633900 0.52243800 1.0 Al Al28 1 0.67366100 0.83683000 0.52243800 1.0 Al Al29 1 0.83683000 0.16317000 0.47756200 1.0 Al Al30 1 0.83683000 0.67366100 0.47756200 1.0 Al Al31 1 0.32633900 0.16317000 0.47756200 1.0 Al Al32 1 0.83683000 0.16317000 0.02243800 1.0 Al Al33 1 0.83683000 0.67366100 0.02243800 1.0 Al Al34 1 0.32633900 0.16317000 0.02243800 1.0 Al Al35 1 0.16317000 0.83683000 0.97756200 1.0 Al Al36 1 0.16317000 0.32633900 0.97756200 1.0 Al Al37 1 0.67366100 0.83683000 0.97756200 1.0