0  B6R1.2  BrC1=CC=NO1 A51037 [0,0,0,0,0,0|2,0,0]=2
1  B6R1.2  BrC1=COC=N1 AT22646 [0,0,0,0,0,0|3,0,0]=3
2  B6R1.2  FC1=CSC=C1 T72274 [0,0,0,0,0,0|2,1,0]=3
3  B6R1.2  FC1=NC=CN1 F31129 [0,0,0,0,0,0|4,0,0]=4
4  B6R1.2  O=C1NN=CO1 D96956 [0,0,0,0,0,0|3,0,0]=3
5  B5R1.1  C1=NN=CO1 F13208 [1,0,0,0,0,0|3,0,0]=4
6  B7R1.1  NCC1=CON=C1 H10991 [0,1,0,0,0,0|3,0,0]=4
7  B7R1.1  OCC1=NSC=C1 AT21123 [0,1,0,0,0,0|1,1,1]=4
8  B7R1.2  C[C@@H]1COC(=O)C1 64712 [0,1,0,0,0,0|1,0,2]=4
9  B7R1.2  C[C@@H]1COC(=O)C1 69011 [0,1,0,0,0,0|1,0,2]=4
10  B7R1.2  ClC1=CC(Br)=CS1 AT16572 [0,1,0,0,0,0|2,1,0]=4
11  B7R1.2  FC1=CSC(Br)=C1 T70774 [0,1,0,0,0,0|2,1,0]=4
12  B7R1.2  NC1=NCC(=O)S1 C13281 [0,1,0,0,0,0|3,0,0]=4
13  B7R1.2  O=C1C=C[C@@H](O)C1 86273 [0,1,0,0,0,0|2,0,0]=3
14  B7R1.4  CN1CC=CC1=O N13365 [0,1,0,0,0,0|2,0,0]=3
15  B7R1.4  ClC1=C(I)SC=C1 P18106 [0,1,0,0,0,0|2,1,0]=4
16  B7R1.4  FC1=CNC=C1F P18993 [0,1,0,0,0,0|3,0,0]=4
17  B7R1.4  FC1=NNC=C1Br P15391 [0,1,0,0,0,0|3,0,0]=4
18  B5R0.3  C=C[C@@H](N)CO Y14326 [0,0,1,0,0,0|2,0,1]=4
19  B6R0.3  C=CC(=O)C(=O)O AC9460 [0,1,1,0,0,0|1,0,0]=3
20  B6R0.3  C=C[C@H](N)C(=O)O F31036 [0,1,1,0,0,0|1,0,1]=4
21  B6R0.4  O=C(O)\C=C\CF AT12709 [0,1,1,0,0,0|1,0,0]=3
22  B6R0.4  O=C(O)\C=C\CO AT11505 [0,1,1,0,0,0|0,0,0]=2
23  B8R1.3  O=C1C=CC(Br)=CO1 D86222 [0,1,0,0,0,1|1,0,0]=3
24  B8R1.4  CC1=CCCC(=O)C1 D79894 [0,1,0,0,0,1|2,0,0]=4
25  B8R1.4  NC1=CC(=O)NN=C1 20219 [0,1,0,0,0,1|2,0,0]=4
26  B8R1.4  O=C1C=COC(=O)C1 A11284 [0,1,0,0,0,1|1,0,0]=3
27  B8R1.5  NC1=CC=NNC1=O 36341 [0,1,0,0,0,1|2,0,0]=4
28  B8R1.1  N#CC1=CC(Br)=NO1 69277 [0,2,0,0,0,0|2,0,0]=4
29  B8R1.7  C[C@H](N)C1=CC=CO1 Y14798 [0,2,0,0,0,0|2,0,0]=4
30  B8R1.7  C[C@H](N)C1=COC=C1 D81573 [0,2,0,0,0,0|2,0,0]=4
31  B8R1.11  CC1=NOC=C1CN Y14820 [0,2,0,0,0,0|2,0,0]=4