new index atom name original index 1 C 5 2 C 6 3 C 7 4 C 8 5 C 9 6 C 10 7 C 3 8 C 4 9 C 11 10 C 12 11 O 1 12 O 2 13 H 16 14 H 14 15 H 15 16 H 19 17 H 18 18 H 17 19 H 20 20 H 21 21 H 22 22 H 23 23 H 13 24 H 24