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