0  B4R0.1  CC(O)C#N ALBB-027949 [0,1,0,0,0,0|3,0,0]=4
1  B4R0.1  CCS(=O)[O-] ALBB-026504 [0,1,0,0,0,0|2,0,0]=3
2  B4R0.1  COC(=S)[S-] ALBB-016495 [0,1,0,0,0,0|1,2,0]=4
3  B4R0.1  COC(C)=N ALBB-033133 [0,1,0,0,0,0|3,0,0]=4
4  B4R0.1  NC(=O)CO ALBB-031510 [0,1,0,0,0,0|2,0,0]=3
5  B4R0.1  NC(=O)NO ALBB-028465 [0,1,0,0,0,0|2,0,0]=3
6  B4R0.1  O=[N+]([O-])CBr ALBB-025772 [0,1,0,0,0,0|1,0,0]=2
7  B4R0.3  NS(N)(=O)=O ALBB-008927 [0,1,0,0,0,0|2,0,1]=4
8  B3R0.1  CN=C=O ALBB-007556 [1,1,0,0,0,0|1,0,1]=4
9  B3R0.1  N\C=N/O ALBB-016431 [1,1,0,0,0,0|1,0,1]=4
10  B5R0.3  C#CC(=O)OC ALBB-008926 [0,2,0,0,0,0|2,0,0]=4
11  B5R0.3  CNC(=O)CO ALBB-026669 [0,2,0,0,0,0|2,0,0]=4
12  B5R0.3  COC(=O)C#N ALBB-036369 [0,2,0,0,0,0|2,0,0]=4
13  B5R0.3  NNC(=O)CO ALBB-016554 [0,2,0,0,0,0|2,0,0]=4
14  B5R0.4  O=S(=O)([O-])CI ALBB-031674 [0,2,0,0,0,0|1,0,1]=4