0 B13R2.3122 CC1(CCCc2c1cccc2)C Molport-046-682-102 [0,0,0,1,0,0|3,0,0]=4 1 B13R2.3122 CC1(CCNc2c1nccc2)C Molport-047-588-089 [0,0,0,1,0,0|2,0,0]=3