0 B9R1.8 C\C=C\C1=CN=CC=N1 YMDB01512 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.8 NCCC1=CC=CC=C1 YMDB01558 [0,0,0,0,0,0|1,0,1]=2 2 B9R1.8 O=CCC1=CC=CC=C1 YMDB00116 [0,0,0,0,0,0|0,0,0]=0 3 B9R1.8 OCCC1=CC=CC=C1 YMDB01072 [0,0,0,0,0,0|0,0,2]=2 4 B8R1.2 O=CC1=CC=CC=C1 YMDB01326 [1,0,0,0,0,0|0,0,0]=1 5 B8R1.2 OCC1=CC=CC=C1 YMDB01426 [1,0,0,0,0,0|0,0,1]=2 6 B10R1.1 NCCC1=CC=C(O)C=C1 YMDB01797 [0,1,0,0,0,0|1,0,1]=3 7 B10R1.1 OCCC1=CC=C(O)C=C1 YMDB01798 [0,1,0,0,0,0|0,0,2]=3 8 B10R1.4 OCCC1=CC=CC=C1O YMDB02314 [0,1,0,0,0,0|0,0,2]=3 9 B10R1.15 N#CC(O)C1=CC=CC=C1 YMDB01642 [0,1,0,0,0,0|1,0,1]=3 10 B10R1.17 O=C\C=C\C1=CC=CC=C1 YMDB01654 [0,1,0,0,0,0|0,0,1]=2 11 B10R1.18 CC(=O)OC1=CC=CC=C1 YMDB00838 [0,1,0,0,0,0|1,0,0]=2 12 B10R1.18 O=C(O)CC1=CC=CC=C1 YMDB00891 [0,1,0,0,0,0|0,0,0]=1 13 B10R2.7 C1=CC=C2SC=NC2=C1 YMDB01432 [0,0,0,1,0,0|1,1,0]=3 14 B8R1.8 SCCC1=CC=CO1 YMDB01460 [0,0,0,0,1,0|1,1,1]=4 15 B7R1.3 CC1=NC=CC=C1 YMDB01458 [2,0,0,0,0,0|1,0,0]=3 16 B9R1.1 C=CC1=CC=C(O)C=C1 YMDB01627 [1,1,0,0,0,0|0,0,1]=3 17 B9R1.1 CCC1=CC=C(O)C=C1 YMDB01617 [1,1,0,0,0,0|0,0,1]=3 18 B9R1.6 CC(=O)C1=CC=CC=C1 YMDB01629 [1,1,0,0,0,0|0,0,0]=2 19 B9R1.6 NC(=O)C1=CC=CN=C1 YMDB00274 [1,1,0,0,0,0|1,0,0]=3 20 B9R1.6 NC(=O)C1=NC=CN=C1 YMDB00976 [1,1,0,0,0,0|2,0,0]=4 21 B9R1.6 O=C(O)C1=CC=CC=C1 YMDB02301 [1,1,0,0,0,0|0,0,0]=2 22 B9R1.6 O=C(O)C1=CN=CC=C1 YMDB00224 [1,1,0,0,0,0|1,0,0]=3 23 B9R1.15 COC1=CC=CC=C1O YMDB01430 [1,1,0,0,0,0|1,0,1]=4 24 B9R1.13 CC(=O)CC1=CC=CO1 YMDB01695 [0,1,0,0,1,0|1,0,0]=3 25 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 YMDB01486 [0,2,0,0,0,0|0,0,0]=2 26 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 YMDB01637 [0,2,0,0,0,0|1,0,1]=4 27 B11R1.12 CC=C(C=O)C1=CC=CC=C1 YMDB01440 [0,2,0,0,0,0|0,0,1]=3 28 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 YMDB01324 [0,2,0,0,0,0|0,0,1]=3 29 B11R2.20 C1=CC=C2C=CC=CC2=C1 YMDB01393 [0,1,0,1,0,0|1,0,1]=4 30 B7R1.1 CCC1=CC=CO1 YMDB01437 [1,0,0,0,1,0|1,0,1]=4 31 B7R1.1 O=CC1=CC=CO1 YMDB01459 [1,0,0,0,1,0|1,0,0]=3 32 B7R1.1 OCC1=CC=CS1 YMDB01447 [1,0,0,0,1,0|1,0,1]=4 33 B7R1.1 SCC1=CC=CO1 YMDB01433 [1,0,0,0,1,0|1,1,0]=4