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