0  B21R0.81  BrCCCCCCCCCCCCCCCCCCC(=O)O 1P008OAP [1,0,0,0,0,0|3,0,0]=4
1  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)C 1P007OOA [1,0,0,0,0,0|3,0,0]=4
2  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)N 1P0037MC [1,0,0,0,0,0|3,0,0]=4
3  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)O 1P0036OO [1,0,0,0,0,0|2,0,0]=3
4  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)[O-] 1P0011BO [1,0,0,0,0,0|2,0,1]=4
5  B21R0.81  OCCCCCCCCCCCCCCCCCCC(=O)O 1P01XDAX [1,0,0,0,0,0|3,0,0]=4
6  B21R0.36399  CCCCCCCCCCCCCCCCCCP(=O)(O)O 1P0035VC [1,0,0,0,0,0|0,0,0]=1
7  B21R0.36399  CCCCCCCCCCCCCCCCCCS(=O)(=O)[O-] 1P001ACC [1,0,0,0,0,0|1,0,2]=4
8  B20R0.2932  CCCCCCCCCCCCCCCCCCCC=O 1P00BISG [2,0,0,0,0,0|2,0,0]=4
9  B20R0.31940  BrCCCCCCCCCCCCCCCCCC(=O)O 1P01G86X [2,0,0,0,0,0|2,0,0]=4
10  B20R0.31940  CCCCCCCCCCCCCCCCCCC(=O)N 1P0037XV [2,0,0,0,0,0|2,0,0]=4
11  B20R0.31940  CCCCCCCCCCCCCCCCCCC(=O)O 1P00E9WU [2,0,0,0,0,0|1,0,0]=3
12  B20R0.31940  OCCCCCCCCCCCCCCCCCC(=O)O 1P01KKQC [2,0,0,0,0,0|2,0,0]=4
13  B20R0.31940  SCCCCCCCCCCCCCCCCCC(=O)O 1P01IQ7D [2,0,0,0,0,0|2,0,0]=4
14  B20R0.32509  CCCCCCCCCCCCCCCCOP(=O)(O)[O-] 1P002EZA [2,0,0,0,0,0|1,0,1]=4
15  B22R0.2907  BrCCCCCCCCCCCCCCCCCCCC(=O)O 1P01XDS9 [1,1,0,0,0,0|2,0,0]=4
16  B22R0.2907  CCCCCCCCCCCCCCCCCCCCC(=O)O 1P002OF7 [1,1,0,0,0,0|2,0,0]=4
17  B22R0.2907  OCCCCCCCCCCCCCCCCCCCC(=O)O 1P01EQN8 [1,1,0,0,0,0|2,0,0]=4
18  B22R0.25844  CCCCCC(CCCCCCCCCCCCCC(=O)O)O 1P00FTBL [1,1,0,0,0,0|2,0,0]=4
19  B22R0.31744  CCC(CCCCCCCCCCCCCCCCC(=O)O)C 1P00C1CL [1,1,0,0,0,0|2,0,0]=4
20  B22R0.37964  CCCCCCCCCCCCCCCCCCCC(=O)OC 1P003ODY [1,1,0,0,0,0|2,0,0]=4
21  B22R0.37967  CCCCCCCCCCCCCCCCCCC(C(=O)O)O 1P001XV5 [1,1,0,0,0,0|2,0,0]=4
22  B24R0.25756  CCCCCCCCCCCCCCCC(C(COP(=O)(O)O)N)O 1P002BNJ [0,2,0,0,0,0|2,0,0]=4