0  B4R0.1  NC(=O)CS GK00437 [1,0,0,0,0,0|2,0,1]=4
1  B6R1.2  BrC1=CC=CO1 CC02010 [0,0,0,1,0,0|1,0,1]=3
2  B6R1.2  ClC1=NC=CS1 MO07794 [0,0,0,1,0,0|2,1,0]=4
3  B6R1.2  O=C1CCOC1 MO08444 [0,0,0,1,0,0|2,0,1]=4
4  B5R0.3  C#CC(=O)OC SB01817 [1,1,0,0,0,0|0,0,2]=4
5  B5R0.3  C\C(C=O)=C/N RH01431 [1,1,0,0,0,0|1,0,0]=3
6  B7R0.5  C=CC[C@H](N)C(=O)O MAY00253 [0,2,0,0,0,0|2,0,0]=4
7  B7R0.4  CC(C)=CCOC=O RDP00092 [0,2,0,0,0,0|2,0,0]=4
8  B7R1.1  NCC1=NC=CS1 CC09513 [0,1,0,1,0,0|1,1,0]=4
9  B7R1.1  O=CC1=CC=CN1 CC08704 [0,1,0,1,0,0|1,0,1]=4
10  B7R1.1  OCC1=NC=CN1 CC08909 [0,1,0,1,0,0|2,0,0]=4
11  B7R1.1  OCC1=NC=CS1 CC09509 [0,1,0,1,0,0|1,1,0]=4
12  B7R1.2  CC1=CC(C)=NO1 TL00573 [0,1,0,1,0,0|1,0,1]=4
13  B7R1.2  CC1=COC(N)=N1 KM08202 [0,1,0,1,0,0|2,0,0]=4
14  B7R1.2  CC1=NC(I)=CN1 MO00831 [0,1,0,1,0,0|2,0,0]=4
15  B7R1.2  NC1=NC(=O)CS1 RH00879 [0,1,0,1,0,0|2,0,0]=4
16  B7R1.4  CC1=C(I)C=NO1 CC26311 [0,1,0,1,0,0|2,0,0]=4