0  B12R0.1  CCCCCCC#CC(=O)OCC 7850AL [0,0,0,0,0,0|0,0,2]=2
1  B12R0.1  CCCCCCCOC(=O)CC#N Z3204 [0,0,0,0,0,0|3,0,1]=4
2  B11R0.3  CCCCCCCC\C=C\CO 9215AL [1,0,0,0,0,0|2,0,0]=3
3  B11R0.40  CCCCCCCC[C@H](O)CO O031 [1,0,0,0,0,0|1,0,2]=4
4  B13R0.2  CCCCC\C=C\CCC(=O)OCC 7896AL [0,1,0,0,0,0|0,0,1]=2
5  B13R1.42  CCOC(=O)CCC1COCCN1 2366AJ [0,0,0,1,0,0|2,0,0]=3
6  B13R1.279  BrC1CCCCCCCCCCC1 Y4078 [0,0,0,1,0,0|2,0,1]=4
7  B13R1.279  NC1CCCCCCCCCCC1 7506AL [0,0,0,1,0,0|2,0,1]=4
8  B13R1.404  CCOC(=O)CCCC1OCCO1 Y8932 [0,0,0,1,0,0|2,0,0]=3
9  B13R1.654  CCCCCC\C=C1/CCCC1=O X3213 [0,0,0,1,0,0|1,0,2]=4
10  B10R0.74  CCCCC\C=C\C(=O)OC 8253AL [2,0,0,0,0,0|0,0,2]=4
11  B10R0.74  COC(=O)CCCCCCN X5538 [2,0,0,0,0,0|1,0,0]=3
12  B12R0.5  CCCCCCCCCCCCF 0557AE [1,1,0,0,0,0|1,0,1]=4
13  B12R0.248  CCCCCCCCOC(=O)CC 5906AF [1,1,0,0,0,0|2,0,0]=4
14  B12R0.4  CCCCCCOC(=O)CC(C)C S215 [1,1,0,0,0,0|2,0,0]=4
15  B12R0.239  CCCCOC(=O)CC(=O)OCC 8968AA [1,1,0,0,0,0|1,0,1]=4
16  B12R0.285  CCCC(=O)OCCC(S)CCC U387 [1,1,0,0,0,0|2,0,0]=4
17  B12R0.184  CC(C)CCCCCOC(=O)CS O807 [1,1,0,0,0,0|2,0,0]=4
18  B14R0.1  CCOC(=O)CCCSCC(=O)OCC Y9684 [0,2,0,0,0,0|1,0,1]=4
19  B14R0.393  CCCCCCCCCNC(=O)CCS 0480AQ [0,2,0,0,0,0|2,0,0]=4
20  B12R1.32  CCOC(=O)CC1=CCCCC1 5740AF [1,0,0,1,0,0|0,0,2]=4
21  B12R1.51  CCOC(=O)CCC1CCNC1 1645AC [1,0,0,1,0,0|1,0,0]=3
22  B12R1.51  CCOC(=O)CCC1OCCO1 Y4362 [1,0,0,1,0,0|2,0,0]=4
23  B12R1.27  COC(=O)CCC1CNCCN1 2393AJ [1,0,0,1,0,0|2,0,0]=4
24  B12R1.27  COC(=O)CCC1COCCN1 2367AJ [1,0,0,1,0,0|2,0,0]=4
25  B12R1.27  COC(=O)CCN1CCCCC1 8096AD [1,0,0,1,0,0|1,0,0]=3
26  B12R1.27  COC(=O)COC1CCNCC1 8915AH [1,0,0,1,0,0|2,0,0]=4
27  B14R1.965  CCOC(=O)CN1CCCCC1CC 3485AF [0,1,0,1,0,0|0,0,0]=2
28  B14R1.29  CCOC(=O)CC(=O)C1CCNCC1 Z3592 [0,1,0,1,0,0|1,0,1]=4