# generated using pymatgen data_NdFe5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24211710 _cell_length_b 5.24220455 _cell_length_c 3.91783096 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99661358 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdFe5 _chemical_formula_sum 'Nd1 Fe5' _cell_volume 93.24205273 _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 0.00000000 0.00000000 1.0 Fe Fe1 1 0.33331939 0.66665318 -0.00000000 1.0 Fe Fe2 1 0.66668061 0.33334682 -0.00000000 1.0 Fe Fe3 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe4 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe5 1 -0.00000000 0.50000000 0.50000000 1.0