# generated using pymatgen data_Nd2NbSi3Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.16004747 _cell_length_b 4.16004747 _cell_length_c 10.37002063 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2NbSi3Ir4 _chemical_formula_sum 'Nd2 Nb1 Si3 Ir4' _cell_volume 179.46352452 _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 Nd Nd0 1 0.00000000 0.50000000 0.24165947 1.0 Nd Nd1 1 0.50000000 0.00000000 0.75834053 1.0 Nb Nb2 1 0.00000000 0.00000000 0.50000000 1.0 Si Si3 1 0.50000000 0.50000000 0.50000000 1.0 Si Si4 1 0.00000000 0.50000000 0.87646247 1.0 Si Si5 1 0.50000000 0.00000000 0.12353753 1.0 Ir Ir6 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir7 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir8 1 0.00000000 0.50000000 0.64242638 1.0 Ir Ir9 1 0.50000000 0.00000000 0.35757362 1.0