0  B13R1.142  CC(C)CC1=CC=C(CC#N)C=C1 19325 [2,0,0,0,0,0|1,0,1]=4
1  B13R1.585  CC(=O)C1=CC=C(CC(C)C)C=C1 102258 [2,0,0,0,0,0|0,0,1]=3
2  B13R1.585  CC(C)CC1=CC=C(C(=O)O)C=C1 13750 [2,0,0,0,0,0|1,0,1]=4
3  B15R1.317  CC(C)CC1=CC=C(C(C)(F)C#N)C=C1 102317 [1,1,0,0,0,0|1,0,1]=4