0  B8R0.6  CCCCCC(=O)NN B014970 [0,0,0,0,0,0|2,0,0]=2
1  B8R0.6  CCNCCC(=O)NN B039571 [0,0,0,0,0,0|3,0,0]=3
2  B7R0.3  CNCCC(=O)NC B039605 [1,0,0,0,0,0|2,0,1]=4
3  B9R0.46  CCCCCCC(=O)NN B014971 [0,1,0,0,0,0|2,0,0]=3
4  B9R1.7  CCCN1C=CC(Br)=N1 B050959 [0,0,0,1,0,0|3,0,0]=4
5  B9R1.7  CCCN1C=CC(C)=N1 B030313 [0,0,0,1,0,0|3,0,0]=4
6  B9R1.7  CCCN1C=CC(I)=N1 B050974 [0,0,0,1,0,0|3,0,0]=4
7  B9R1.7  CCCN1C=CC(N)=N1 B021116 [0,0,0,1,0,0|3,0,0]=4
8  B9R1.11  COC(=O)C1CCCN1 B022514 [0,0,0,1,0,0|2,0,1]=4
9  B8R1.8  CCCC1=CC=CS1 B046363 [1,0,0,1,0,0|1,0,1]=4
10  B8R1.8  CCCN1C=CC=N1 B030577 [1,0,0,1,0,0|2,0,0]=4
11  B8R1.38  NNC(=O)C1CCC1 B039657 [1,0,0,1,0,0|2,0,0]=4
12  B10R1.19  O=C1CCCCCN1CO B048603 [0,1,0,1,0,0|1,0,1]=4
13  B10R1.21  CCCCNC1=NC=CS1 B029547 [0,1,0,1,0,0|1,1,0]=4
14  B10R1.29  CCCCN1N=CC=C1C B036124 [0,1,0,1,0,0|2,0,0]=4
15  B10R1.29  CCCCN1N=CC=C1N B063497 [0,1,0,1,0,0|2,0,0]=4
16  B10R1.96  CCCC1=CC=C(C=O)S1 B030362 [0,1,0,1,0,0|1,0,1]=4
17  B10R1.96  CCCN1C=CC(C=O)=N1 B021215 [0,1,0,1,0,0|2,0,0]=4
18  B10R1.15  NNC(=O)C1CCCCC1 B017809 [0,1,0,1,0,0|2,0,0]=4
19  B10R1.27  COC(=O)CC1CCCO1 B050354 [0,1,0,1,0,0|1,0,1]=4
20  B10R1.16  CCCCN1C=CC(C)=N1 B036123 [0,1,0,1,0,0|2,0,0]=4
21  B10R1.16  CCCCN1C=CC(N)=N1 B024249 [0,1,0,1,0,0|2,0,0]=4
22  B10R2.178  O=C1C=CC2COC1O2 B048502 [0,0,0,2,0,0|2,0,0]=4