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