0  B10R2.7  C1=CC2=C(C=C1)NC=C2 120-72-9 [0,0,0,0,0,0|0,0,0]=0
1  B10R2.7  C1=NC=NC2=C1NC=N2 120-73-0 [0,0,0,0,0,0|3,0,0]=3
2  B11R2.1  CC1=CNC2=C1C=CC=C2 83-34-1 [0,1,0,0,0,0|0,0,0]=1
3  B9R1.8  NCCc1ccccc1 64-04-0 [0,0,1,0,0,0|0,0,2]=3
4  B9R1.8  O=CCC1=CC=CC=C1 122-78-1 [0,0,1,0,0,0|1,0,1]=3
5  B9R1.15  COc1ccccc1O 90-05-1 [0,0,1,0,0,0|2,0,1]=4
6  B11R2.20  C1=CC=C2N=CC=CC2=C1 91-22-5 [0,0,0,0,0,1|0,0,1]=2
7  B8R1.2  NCC1=CC=CC=C1 100-46-9 [1,0,1,0,0,0|0,0,1]=3
8  B8R1.2  O=CC1=CC=CC=C1 100-52-7 [1,0,1,0,0,0|1,0,0]=3
9  B8R1.2  OCC1=CC=CC=C1 100-51-6 [1,0,1,0,0,0|1,0,1]=4
10  B8R1.5  Nc1ccccc1O 95-55-6 [1,0,1,0,0,0|1,0,0]=3
11  B8R1.5  OC1=CC=CC=C1O 120-80-9 [1,0,1,0,0,0|2,0,0]=4
12  B10R1.1  NCCc1ccc(O)cc1 51-67-2 [0,1,1,0,0,0|0,0,2]=4
13  B10R1.15  NCC(O)C1=CC=CC=C1 7568-93-6 [0,1,1,0,0,0|0,0,2]=4
14  B10R1.17  O=C\C=C\C1=CC=CC=C1 14371-10-9 [0,1,1,0,0,0|1,0,0]=3
15  B10R1.18  CC(=O)Oc1ccccc1 122-79-2 [0,1,1,0,0,0|1,0,1]=4
16  B10R1.18  O=C(O)CC1=CC=CC=C1 103-82-2 [0,1,1,0,0,0|1,0,1]=4
17  B10R1.66  O=C(O)\C=C\C1=CNC=N1 104-98-3 [0,1,1,0,0,0|2,0,0]=4
18  B10R1.61  NC(=O)C1=CC=CC=C1O 65-45-2 [0,1,1,0,0,0|2,0,0]=4
19  B10R1.61  O=C(O)c1ccccc1O 69-72-7 [0,1,1,0,0,0|2,0,0]=4
20  B12R2.18  CC1C(=O)Nc2ccccc21 1504-06-9 [0,2,0,0,0,0|0,0,1]=3
21  B12R2.100  CC1=CC2=C(C=C1C)NC=N2 582-60-5 [0,2,0,0,0,0|1,0,0]=3