0 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O S3691 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O S4404 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O S4404 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O S5211 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)[O-] S4073 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)[O-] S4073 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 C1=CC(=C(C=C1O)O)C(=O)O S6293 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)O S4762 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)O S5173 [0,0,0,0,0,0|1,0,1]=2 9 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O S5519 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O S5157 [0,0,0,0,0,0|0,0,0]=0 11 B10R1.13 CC1=CC=C(C=C1)C(C)C S5598 [1,0,0,0,0,0|0,0,0]=1 12 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO S6067 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.61 C1=CC=C(C(=C1)C(=O)N)O S6404 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S4539 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.61 C1=CC=C(C(=C1)C(=O)O)O S4539 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.61 C1=CC=C(C(=C1)C(=O)[O-])O S3137 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.61 C1=CC=C(C(=C1)C(=O)[O-])O S3137 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.61 CC(=O)C1=CC=CC=C1O S9375 [1,0,0,0,0,0|1,0,1]=3 19 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C S4761 [0,1,0,0,0,0|0,0,1]=2 20 B12R1.452 CC(=O)C1=C(C=C(C=C1)OC)O S2339 [0,1,0,0,0,0|1,0,1]=3 21 B12R1.452 CC(=O)C1=C(C=C(C=C1)OC)O S2339 [0,1,0,0,0,0|1,0,1]=3 22 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)O S5160 [0,1,0,0,0,0|2,0,1]=4 23 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)O)O S4784 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.1000 CC1=CC(=C(C(=O)O1)C(=O)C)O S6235 [0,1,0,0,0,0|2,0,1]=4 25 B9R1.1 C1=CC(=CC=C1CO)O S3857 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.1 CCC1=CC=C(C=C1)O S6308 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.1 COC1=CC=C(C=C1)O S4077 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.1 COC1=CC=C(C=C1)O S4077 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.6 CC(=O)C1=CC=CC=C1 S5528 [2,0,0,0,0,0|1,0,1]=4 30 B9R1.6 CC(C1=CC=CC=C1)N S6260 [2,0,0,0,0,0|1,0,0]=3 31 B9R1.15 C1=CC=C(C(=C1)CO)O S5562 [2,0,0,0,0,0|1,0,0]=3 32 B9R1.15 COC1=CC=CC=C1O S3872 [2,0,0,0,0,0|1,0,0]=3 33 B9R1.69 CC1=CC(=C(C=C1)O)O S5616 [2,0,0,0,0,0|1,0,0]=3 34 B11R1.3 CC(C)C1=CC=C(C=C1)C=O S5089 [1,1,0,0,0,0|0,0,1]=3 35 B11R1.3 CC(C)C1=CC=C(C=C1)CO S5090 [1,1,0,0,0,0|0,0,0]=2 36 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O S3788 [1,1,0,0,0,0|0,0,0]=2 37 B11R1.22 C1=CC(=CC=C1C(CN)O)O S3188 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.22 C1=CC(=CC=C1C(CN)O)O S3188 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.279 COC1=C(C=C(C=C1)C=O)O S4943 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.279 COC1=CC(=C(C=C1)C=O)O S5156 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O S9374 [1,1,0,0,0,0|1,0,1]=4 42 B11R1.222 COC(=O)C1=CC=CC=C1O S3756 [1,1,0,0,0,0|1,0,1]=4 43 B11R1.222 COC(=O)C1=CC=CC=C1O S3756 [1,1,0,0,0,0|1,0,1]=4 44 B11R2.36 C1OC2=C(O1)C=C(C=C2)O S3626 [1,0,0,1,0,0|2,0,0]=4