new index atom name original index 1 C 8 2 C 6 3 C 9 4 C 7 5 C 5 6 C 11 7 C 10 8 O 2 9 O 4 10 O 1 11 O 3 12 H 17 13 H 18 14 H 19 15 H 13 16 H 14 17 H 20 18 H 21 19 H 15 20 H 16 21 H 12 22 H 23 23 H 22