0  B4R0.1  C#CC(=O)O BBL011346 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.1  CC(=O)CCl BBL036265 [0,0,0,0,0,0|4,0,0]=4
2  B4R0.1  CC(=O)CO BBL011436 [0,0,0,0,0,0|3,0,1]=4
3  B4R0.1  CC(=O)NN BBL018600 [0,0,0,0,0,0|3,1,0]=4
4  B4R0.1  CC(C)C=O BBL034648 [0,0,0,0,0,0|4,0,0]=4
5  B4R0.1  CNC(N)=O BBL013131 [0,0,0,0,0,0|3,1,0]=4
6  B4R0.1  COC(=O)Cl BBL011482 [0,0,0,0,0,0|4,0,0]=4
7  B4R0.1  COC(N)=O BBL011430 [0,0,0,0,0,0|4,0,0]=4
8  B4R0.1  NC(=O)NO BBL009928 [0,0,0,0,0,0|2,1,1]=4
9  B4R0.1  NNC(N)=O BBL012207 [0,0,0,0,0,0|3,1,0]=4
10  B4R0.1  O=C(Br)CBr BBL027286 [0,0,0,0,0,0|4,0,0]=4
11  B4R0.1  O=C(Cl)CCl BBL013127 [0,0,0,0,0,0|4,0,0]=4
12  B4R0.1  O=C(O)CCl BBL037260 [0,0,0,0,0,0|3,0,1]=4
13  B3R0.1  CNC=O BBL027430 [1,0,0,0,0,0|2,1,0]=4
14  B3R0.1  O=CC=O BBL011519 [1,0,0,0,0,0|2,0,0]=3
15  B5R0.4  NCS(=O)(=O)O BBL027684 [0,1,0,0,0,0|3,0,0]=4
16  B5R0.4  NOS(=O)(=O)O BBL011058 [0,1,0,0,0,0|3,0,0]=4
17  B5R0.5  CC(=O)C(=O)O BBL027390 [0,1,0,0,0,0|2,0,1]=4
18  B5R0.5  O=C(Cl)C(=O)Cl BBL011493 [0,1,0,0,0,0|3,0,0]=4
19  B5R0.5  O=C(O)C(=O)O BBL003000 [0,1,0,0,0,0|2,0,1]=4
20  B4R0.3  NS(N)(=O)=O BBL019229 [1,1,0,0,0,0|1,1,0]=4
21  B6R0.5  O=C=NS(=O)(=O)Cl BBL027786 [0,2,0,0,0,0|1,1,0]=4