new index	atom name	original index
1	C	14
2	C	15
3	C	12
4	C	13
5	C	10
6	C	11
7	C	6
8	C	7
9	C	8
10	C	16
11	C	9
12	O	4
13	O	5
14	O	3
15	O	1
16	O	2
17	H	24
18	H	23
19	H	22
20	H	25
21	H	27
22	H	26
23	H	19
24	H	20
25	H	17
26	H	18
27	H	28
28	H	21