0  B19R2.399296  CCN1C(=O)C=C(OCC(=O)O)C2=CC=CC=C21 BB01-0108 [1,0,1,0,0,0|1,0,0]=3
1  B19R2.399296  CCN1C(=O)C=C(SCC(=O)O)C2=CC=CC=C21 BB01-0104 [1,0,1,0,0,0|1,1,0]=4