0  B12R0.234  CCCCCCCCCCC(N)=O Y14687 [0,0,0,0,0,0|1,0,2]=3
1  B11R0.3  CCCCCCCCSCCO A10652 [1,0,0,0,0,0|1,0,2]=4
2  B11R0.148  C#CCCCCCCCC(=O)O AT18721 [1,0,0,0,0,0|0,0,3]=4
3  B11R0.148  NCCCCCCCCC(=O)O D94864 [1,0,0,0,0,0|1,0,1]=3
4  B13R0.54  C=CCCCCCCCCCC(=O)O I12075 [0,1,0,0,0,0|0,0,3]=4
5  B13R0.54  O=C(O)CCCCCCCCCCCl D86287 [0,1,0,0,0,0|0,0,2]=3
6  B13R1.337  O=C(O)CCCCN1CCCCC1 D80932 [0,0,0,1,0,0|1,0,2]=4
7  B10R0.4  O=C(O)CCCCCCCO S10749 [2,0,0,0,0,0|1,0,0]=3
8  B12R0.4  CCCCCCC[C@H](O)CC(=O)O A10886 [1,1,0,0,0,0|0,0,1]=3
9  B12R0.119  CCCCCCCCOP(=O)(O)O N11880 [1,1,0,0,0,0|2,0,0]=4
10  B12R0.233  CCCCCC(=O)CCCC(=O)O Y13481 [1,1,0,0,0,0|0,0,2]=4
11  B12R0.251  CCCCCCCC[C@H](N)C(=O)O W18677 [1,1,0,0,0,0|0,0,1]=3
12  B12R0.268  CC(C)CCCCCCCC(=O)O A11263 [1,1,0,0,0,0|0,0,1]=3
13  B14R0.68  CC(C)CCCCCCC\C=C/C(=O)O D86952 [0,2,0,0,0,0|0,0,0]=2
14  B14R0.305  CCC(=O)CCCCCCCCC(=O)O D94101 [0,2,0,0,0,0|0,0,2]=4
15  B14R0.337  CCCCCC=CCCC=CC(=O)OC D94411 [0,2,0,0,0,0|0,0,1]=3
16  B12R1.252  O=C(O)\C=C\CN1CCCCC1 D83613 [1,0,0,1,0,0|1,0,0]=3
17  B12R1.1343  O=C(O)CCN1CCCCCC1 D82188 [1,0,0,1,0,0|1,0,1]=4
18  B14R1.122  CCCCCCCCC1=CC=C(Br)S1 T70419 [0,1,0,1,0,0|1,1,0]=4
19  B14R1.10072  N[C@@H](CC1CCCCCCC1)C(=O)O D79023 [0,1,0,1,0,0|0,0,2]=4
20  B14R1.10072  N[C@@H](CC1CCCCCCC1)C(=O)O P20262 [0,1,0,1,0,0|0,0,2]=4
21  B14R1.423  O=C(O)\C=C/C(=O)NC1CCCCC1 W18550 [0,1,0,1,0,0|1,0,1]=4
22  B14R2.31359  O=C(O)C1CCCC2CCCCC21 72708 [0,0,0,2,0,0|0,0,2]=4