0  B9R1.15  COc1ccccc1O 90-05-1 [0,0,0,0,0,0|2,0,0]=2
1  B8R1.2  NCC1=CC=CC=C1 100-46-9 [1,0,0,0,0,0|1,0,1]=3
2  B8R1.2  O=CC1=CC=CC=C1 100-52-7 [1,0,0,0,0,0|0,0,0]=1
3  B8R1.2  OCC1=CC=CC=C1 100-51-6 [1,0,0,0,0,0|0,0,2]=3
4  B8R1.5  Nc1ccccc1O 95-55-6 [1,0,0,0,0,0|1,0,0]=2
5  B8R1.5  OC1=CC=CC=C1O 120-80-9 [1,0,0,0,0,0|0,0,1]=2
6  B10R1.61  NC(=O)C1=CC=CC=C1O 65-45-2 [0,1,0,0,0,0|0,0,0]=1
7  B10R1.61  O=C(O)c1ccccc1O 69-72-7 [0,1,0,0,0,0|0,0,0]=1
8  B10R2.7  C1=CC2=C(C=C1)NC=C2 120-72-9 [0,0,0,1,0,0|2,0,0]=3
9  B7R1.3  NC1=CC=CC=C1 62-53-3 [2,0,0,0,0,0|1,0,0]=3
10  B7R1.3  OC1=CC=CC=C1 108-95-2 [2,0,0,0,0,0|0,0,0]=2
11  B7R1.3  OC1=CC=CC=N1 142-08-5 [2,0,0,0,0,0|1,0,0]=3
12  B9R1.1  O=CC1=CC=C(O)C=C1 123-08-0 [1,1,0,0,0,0|0,0,0]=2
13  B9R1.2  O=Cc1cccc(O)c1 100-83-4 [1,1,0,0,0,0|0,0,0]=2
14  B9R1.2  OCC1=CC=CC(O)=C1 620-24-6 [1,1,0,0,0,0|0,0,2]=4
15  B9R1.6  C[C@H](O)c1ccccc1 1445-91-6 [1,1,0,0,0,0|0,0,2]=4
16  B9R1.6  NC(=O)C1=CN=CC=C1 98-92-0 [1,1,0,0,0,0|1,0,0]=3
17  B9R1.6  O=C(O)C1=CC=CC=N1 98-98-6 [1,1,0,0,0,0|1,0,0]=3
18  B9R1.6  O=C(O)c1ccccc1 65-85-0 [1,1,0,0,0,0|0,0,0]=2
19  B9R1.6  O=C(O)c1cccnc1 59-67-6 [1,1,0,0,0,0|1,0,0]=3
20  B9R1.8  NCCc1ccccc1 64-04-0 [1,1,0,0,0,0|1,0,1]=4
21  B9R1.8  O=CCC1=CC=CC=C1 122-78-1 [1,1,0,0,0,0|0,0,0]=2
22  B9R1.69  CC1=CC=C(O)C(O)=C1 452-86-8 [1,1,0,0,0,0|0,0,1]=3
23  B11R1.159  NC1=C(O)C=CC=C1C(=O)O 548-93-6 [0,2,0,0,0,0|1,0,0]=3
24  B11R1.159  O=C(O)C1=C(O)C(O)=CC=C1 303-38-8 [0,2,0,0,0,0|0,0,0]=2
25  B11R1.86  O=C(O)CC1=CC=CC=C1O 614-75-5 [0,2,0,0,0,0|0,0,0]=2
26  B11R1.166  CC(=O)C1=C(O)C=C(O)C=C1 89-84-9 [0,2,0,0,0,0|0,0,0]=2
27  B11R1.166  O=C(O)c1cnc(O)nc1O 23945-44-0 [0,2,0,0,0,0|2,0,0]=4
28  B11R1.167  O=C(O)c1cc(O)ccc1O 490-79-9 [0,2,0,0,0,0|0,0,0]=2
29  B11R1.87  Nc1ccccc1S(=O)(=O)O 88-21-1 [0,2,0,0,0,0|2,0,0]=4
30  B11R2.20  C1=CC=C2N=CC=CC2=C1 91-22-5 [0,1,0,1,0,0|2,0,0]=4
31  B11R2.1  CC1=CNC2=C1C=CC=C2 83-34-1 [0,1,0,1,0,0|2,0,0]=4