0  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)O 6492AF [0,0,0,0,0,0|0,0,0]=0
1  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)[O-] V0107 [0,0,0,0,0,0|0,0,1]=1
2  B19R0.149  CCCCCCCCCSCCCCCCCC(=O)O 1587AH [0,0,0,0,0,0|1,0,0]=1
3  B19R0.149  CCCCCCCC\C=C/CCCCCCCC(=O)O 6480AF [0,0,0,0,0,0|0,0,2]=2
4  B19R0.149  CCCCCCCC\C=C/CCCCCCCC(=O)[O-] 6474AF [0,0,0,0,0,0|0,0,3]=3
5  B19R0.149  CCCCCCC\C=C\CCCCCCCCC(=O)O Z6194 [0,0,0,0,0,0|0,0,2]=2
6  B20R0.90  CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)[O-] 6477AF [0,1,0,0,0,0|0,0,3]=4
7  B20R1.31096  O=C(O)CCCCCCCCCCCC[C@@H]1C=CCC1 6472AF [0,0,0,1,0,0|0,0,2]=3
8  B17R0.43  CCCCCCCCCCCCCCCC(=O)[O-] 6364AF [2,0,0,0,0,0|0,0,1]=3
9  B17R0.43  CCCCCCCCCCCCCCOC(=O)Cl 8293AB [2,0,0,0,0,0|2,0,0]=4
10  B19R0.148  CCCCCCCCCCCCCCCC[C@H](O)CO N797 [1,1,0,0,0,0|0,0,2]=4
11  B19R0.36  CCCCCCCCCCCCCCCCCC[Mg]Cl 8953AJ [1,1,0,0,0,0|1,0,1]=4
12  B21R0.9111  CCCCC\C=C/C[C@@H](O)[C@H](O)CCCCCCCC(=O)O 1057AH [0,2,0,0,0,0|0,0,2]=4
13  B21R0.21192  CCCCCCC(O)CCCCCCCCCCC(=O)OC 6528AF [0,2,0,0,0,0|0,0,0]=2
14  B21R0.37067  CCCCCC(O)C(O)C\C=C/CCCCCCCC(=O)O 1021AH [0,2,0,0,0,0|0,0,2]=4
15  B21R0.36393  CCCCCCCCCCCCCCCC(=O)CC(=O)OC X7163 [0,2,0,0,0,0|0,0,1]=3
16  B21R0.2907  CCCCCCCCCCCCCCCCCC(=O)NCO 3959AB [0,2,0,0,0,0|0,0,0]=2
17  B21R0.81  CCCCCCCCC#CCC#CCCCCCCC(=O)O 1507AH [0,2,0,0,0,0|0,0,2]=4
18  B21R0.81  CCCCCCCCCCCCCCCCCCOC(=O)Cl 7212AB [0,2,0,0,0,0|1,0,0]=3
19  B21R1.17805  CCCCC\C=C/CC1OC1CCCCCCCC(=O)O 1049AH [0,1,0,1,0,0|0,0,2]=4
20  B21R1.79126  CCCCCCCCCCCC(=O)N1CCC[C@H]1C(=O)O R655 [0,1,0,1,0,0|1,0,1]=4
21  B21R1.290332  [C@H]1(CCCCCC)CCC(O)[C@@H]1CCCCCCC(=O)O C735 [0,1,0,1,0,0|0,0,0]=2