# generated using pymatgen data_NdAl10TcIr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.87467083 _cell_length_b 6.85451567 _cell_length_c 9.16349281 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 96.86792367 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdAl10TcIr _chemical_formula_sum 'Nd2 Al20 Tc2 Ir2' _cell_volume 428.70859065 _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 Nd Nd0 1 0.86969945 0.11984048 0.75000000 1.0 Nd Nd1 1 0.13030055 0.88015952 0.25000000 1.0 Al Al2 1 0.59262251 0.86116534 0.25000000 1.0 Al Al3 1 0.78075713 0.51903354 0.25000000 1.0 Al Al4 1 0.16115273 0.83943684 0.89818502 1.0 Al Al5 1 0.40737749 0.13883466 0.75000000 1.0 Al Al6 1 0.61953716 0.37611092 0.95038332 1.0 Al Al7 1 0.83884727 0.16056316 0.39818502 1.0 Al Al8 1 0.77187950 0.77430759 0.99956950 1.0 Al Al9 1 0.86008019 0.59422205 0.75000000 1.0 Al Al10 1 0.83884727 0.16056316 0.10181498 1.0 Al Al11 1 0.21924287 0.48096646 0.75000000 1.0 Al Al12 1 0.16115273 0.83943684 0.60181498 1.0 Al Al13 1 0.77187950 0.77430759 0.50043050 1.0 Al Al14 1 0.48358520 0.22174821 0.25000000 1.0 Al Al15 1 0.61953716 0.37611092 0.54961668 1.0 Al Al16 1 0.22812050 0.22569241 0.49956950 1.0 Al Al17 1 0.38046284 0.62388908 0.45038332 1.0 Al Al18 1 0.13991981 0.40577795 0.25000000 1.0 Al Al19 1 0.51641480 0.77825179 0.75000000 1.0 Al Al20 1 0.38046284 0.62388908 0.04961668 1.0 Al Al21 1 0.22812050 0.22569241 0.00043050 1.0 Tc Tc22 1 0.50000000 0.00000000 0.00000000 1.0 Tc Tc23 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir24 1 0.00000000 0.50000000 0.00000000 1.0 Ir Ir25 1 0.00000000 0.50000000 0.50000000 1.0