echo start charge -1 geometry nocenter C 0.00000000 0.00000000 0.00000000 O 1.18337200 0.00000000 0.00000000 H -.63151821 0.94387462 0.00000000 end basis * library 6-31g end dft odft end property hyperfine 2 1 3 end task dft property