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