new index atom name original index 1 C 9 2 C 10 3 C 11 4 C 8 5 C 12 6 C 7 7 O 4 8 O 5 9 O 6 10 S 1 11 Si 2 12 H 18 13 H 17 14 H 19 15 H 22 16 H 20 17 H 21 18 H 25 19 H 23 20 H 24 21 H 15 22 H 16 23 H 26 24 H 27 25 H 13 26 H 14 27 Na 3