0  B5R0.5  B(C(C)C)(O)O BC000891 [0,0,0,0,0,0|2,0,2]=4
1  B4R0.1  B(CC)(O)O BC000397 [1,0,0,0,0,0|1,0,2]=4
2  B3R0.2  B(C)(O)O BC000741 [2,0,0,0,0,0|1,0,1]=4