0 B13R2.3122 CC1(CCCc2c1cccc2)C Molport-046-682-102 [0,0,0,1,0,0|2,0,1]=4 1 B14R2.2950 CC1CC(CO1)(C)c2ccccc2 Molport-006-139-490 [0,1,0,1,0,0|1,0,1]=4