0  B13R0.54  CCCCCCCCCCCC(=O)O 2121-1-42 [0,0,0,0,0,0|2,0,0]=2
1  B12R0.5  C=CCCCCCCCCCCC 1300-1-17 [1,0,0,0,0,0|1,0,1]=3
2  B12R0.5  CCCCCCCCCCCC=O 2115-1-09 [1,0,0,0,0,0|1,0,0]=2
3  B12R0.5  CCCCCCCCCCCCBr 1100-9-38 [1,0,0,0,0,0|2,0,1]=4
4  B12R0.5  CCCCCCCCCCOCC 2107-1-16 [1,0,0,0,0,0|0,0,1]=2
5  B12R0.5  CCCCCCNCCCCCC 3131-1-12 [1,0,0,0,0,0|2,0,1]=4
6  B12R0.234  C#CCCCCCCCCC(=O)O 2521-1-14 [1,0,0,0,0,0|1,0,2]=4
7  B12R0.234  C=C(Br)CCCCCCCCCC 1300-9-03 [1,0,0,0,0,0|1,0,1]=3
8  B12R0.234  C=C(C)CCCCCCCCCC 1300-1-31 [1,0,0,0,0,0|1,0,0]=2
9  B12R0.234  C=C(Cl)CCCCCCCCCC 1300-5-22 [1,0,0,0,0,0|1,0,1]=3
10  B12R0.234  CCCCCCCCCCB(O)O 6160-1-11 [1,0,0,0,0,0|2,0,1]=4
11  B12R0.234  CCCCCCCCCCC(=O)O 2121-1-22 [1,0,0,0,0,0|1,0,0]=2
12  B12R0.234  CCCCCCCCCCN(C)C 3132-1-01 [1,0,0,0,0,0|2,0,0]=3
13  B12R0.234  O=C(O)COCCCCCCCO 2129-1-15 [1,0,0,0,0,0|3,0,0]=4
14  B14R0.337  C=CC(=O)OCCCCCCCCCC 2323-1-22 [0,1,0,0,0,0|0,0,1]=2
15  B14R0.337  CCCCCCCCCCCC(=O)NN 4156-1-61 [0,1,0,0,0,0|2,0,0]=3
16  B14R0.337  CCCCCCCCCCCC(=O)OC 2123-1-31 [0,1,0,0,0,0|1,0,0]=2
17  B14R0.344  CCCCCCCCS(=O)CCC(=O)O 6165-1-09 [0,1,0,0,0,0|3,0,0]=4
18  B14R0.394  C=CCCCCCCCCCCC(=O)O 2321-1-20 [0,1,0,0,0,0|2,0,1]=4
19  B14R1.122  CCCCCCCCC1CCC(=O)O1 2H25-1-19 [0,0,0,1,0,0|2,0,0]=3
20  B14R1.122  CCCCCCOCC1COC(=O)O1 2H28-1-20 [0,0,0,1,0,0|2,0,0]=3
21  B14R1.4408  O=C1CCCCCCCCCCCC1 2217-1-17 [0,0,0,1,0,0|1,0,0]=2
22  B11R0.3  C=CCCCCCCCCCCl 1300-5-09 [2,0,0,0,0,0|1,0,1]=4
23  B11R0.3  CCCCCCCCCCCBr 1100-9-25 [2,0,0,0,0,0|1,0,1]=4
24  B11R0.3  CCCCCCCCCCCC 1100-1-34 [2,0,0,0,0,0|0,0,1]=3
25  B11R0.148  C=C(Br)CCCCCCCCC 1300-9-05 [2,0,0,0,0,0|1,0,1]=4
26  B11R0.148  C=C(C)CCCCCCCCC 1300-1-32 [2,0,0,0,0,0|1,0,0]=3
27  B11R0.148  C=C(Cl)CCCCCCCCC 1300-5-23 [2,0,0,0,0,0|1,0,1]=4
28  B11R0.148  O=C(O)CCCCCCCCO 2129-1-50 [2,0,0,0,0,0|2,0,0]=4
29  B13R0.336  CCCCCCCCCCCCCN 3130-1-04 [1,1,0,0,0,0|1,0,1]=4
30  B13R0.280  CCCCCCCCCCP(=O)(O)O 6177-1-93 [1,1,0,0,0,0|2,0,0]=4
31  B15R0.81  COC(=O)CCCCCCCCCCCBr 2123-9-38 [0,2,0,0,0,0|1,0,0]=3
32  B15R0.366  CCCCCCCCCCCC(=O)NCC 4148-1-42 [0,2,0,0,0,0|1,0,0]=3
33  B15R0.366  CCCCCCCCCCOC(=O)CCCl 2123-5-10 [0,2,0,0,0,0|0,0,0]=2
34  B15R0.164  CCCCCCCCSCCCCC(=O)O 6166-1-09 [0,2,0,0,0,0|2,0,0]=4
35  B13R1.279  C=C1CCCCCCCCCCC1 1300-1-18 [1,0,0,1,0,0|1,0,1]=4
36  B13R1.654  CCCCCCCC1CCCC1=O 2217-1-26 [1,0,0,1,0,0|1,0,0]=3