0 B7R0.1 NCCC\C=C\CO AT22200 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.1 CCOC(=O)\C=C\CO AT14907 [0,1,0,0,0,0|1,0,0]=2 2 B8R1.2 CCC1=NC=CC=N1 D86044 [0,0,0,1,0,0|2,0,1]=4 3 B8R1.2 C[13CH2]C1=CC=CC=C1 D98792 [0,0,0,1,0,0|1,0,1]=3 4 B8R1.2 OCC1=CCCOC1 AT26645 [0,0,0,1,0,0|1,0,2]=4 5 B8R1.2 OC[C@H]1CCC=CO1 AC9028 [0,0,0,1,0,0|1,0,1]=3 6 B8R1.8 NCCC1=CC=NO1 E73131 [0,0,0,1,0,0|2,0,1]=4 7 B8R1.11 CC1=NOC=C1CO AT19017 [0,0,0,1,0,0|2,0,1]=4 8 B8R1.11 CN1N=NC=C1CO 92410 [0,0,0,1,0,0|3,0,0]=4 9 B8R1.11 OCC1=C(F)C=CS1 AT22758 [0,0,0,1,0,0|2,0,1]=4 10 B8R1.11 OC[C@H]1CC=C[C@H]1O 52549 [0,0,0,1,0,0|1,0,2]=4 11 B8R1.11 OC[C@H]1CC=C[C@H]1O D77369 [0,0,0,1,0,0|1,0,2]=4 12 B8R1.22 NC1CCC=CCC1 E73311 [0,0,0,1,0,0|1,0,2]=4 13 B7R0.3 CCONC(=O)CO AT24923 [1,1,0,0,0,0|2,0,0]=4 14 B7R0.3 C\C=C(/C)CCCC T72329 [1,1,0,0,0,0|0,0,2]=4 15 B9R0.34 CCOC(=O)CC(=O)CO D75487 [0,2,0,0,0,0|1,0,1]=4 16 B7R1.1 C#CC1=CC=CO1 AC9158 [1,0,0,1,0,0|0,0,2]=4 17 B7R1.1 CCC1=NNC=C1 D77034 [1,0,0,1,0,0|2,0,0]=4 18 B7R1.1 NCC1=CN=CO1 P10824 [1,0,0,1,0,0|2,0,0]=4 19 B7R1.1 NC[C@@H]1C=CCC1 E73245 [1,0,0,1,0,0|1,0,1]=4 20 B7R1.1 O=CC1=CC=NO1 C73163 [1,0,0,1,0,0|2,0,0]=4 21 B7R1.1 OCC1=NOCC1 92945 [1,0,0,1,0,0|2,0,0]=4 22 B7R1.3 N[C@@H]1CC=CCC1 AT10535 [1,0,0,1,0,0|1,0,1]=4 23 B7R1.3 N[C@@H]1CC=CCC1 AT10537 [1,0,0,1,0,0|1,0,1]=4 24 B7R1.4 CC1=C(O)C=CS1 AT26691 [1,0,0,1,0,0|1,0,1]=4 25 B9R1.8 CCOC1=CN=CC=C1 F31361 [0,1,0,1,0,0|2,0,0]=4 26 B9R1.8 ClCCC1=CN=CC=C1 D87792 [0,1,0,1,0,0|2,0,0]=4 27 B9R1.8 SCCC1=CN=CC=C1 F18092 [0,1,0,1,0,0|2,0,0]=4 28 B9R1.15 CC1=C(CO)C=NN=C1 F30427 [0,1,0,1,0,0|1,0,1]=4 29 B9R1.15 CC1=CC=NN=C1CO F50171 [0,1,0,1,0,0|1,0,1]=4 30 B9R1.33 [C-]#[N+]CC1=CC=CN1C AT23899 [0,1,0,1,0,0|2,0,0]=4 31 B9R1.14 COC1=CSC=C1CN C92311 [0,1,0,1,0,0|2,0,0]=4 32 B9R1.1 CCC1=CC=C(N)N=N1 AT21731 [0,1,0,1,0,0|2,0,0]=4 33 B9R1.1 CCC1=NC=C(O)C=C1 D76529 [0,1,0,1,0,0|1,0,1]=4 34 B9R1.1 CC[C@@H]1C=CC(=O)CC1 AT12677 [0,1,0,1,0,0|1,0,1]=4 35 B9R1.1 NC1=CN=C(CO)C=C1 D77165 [0,1,0,1,0,0|1,0,1]=4 36 B9R1.6 C[C@H](O)C1=NN=CC=C1 P14065 [0,1,0,1,0,0|2,0,0]=4