0  B6R0.2  B(CC(C)C)(O)O BC000817 [0,1,0,0,0,0|1,0,1]=3
1  B5R0.5  B(C(C)C)(O)O BC000891 [1,1,0,0,0,0|1,0,1]=4
2  B5R1.1  C1CCOC1 BC000906 [1,0,0,1,0,0|0,0,2]=4