0  B4R0.1  CC(=O)NN AC-24092 [0,1,0,0,0,0|1,0,0]=2
1  B4R0.1  CC(=O)NO AC-13161 [0,1,0,0,0,0|0,0,0]=1
2  B4R0.1  CCC(O)O AC-11575 [0,1,0,0,0,0|0,0,2]=3
3  B4R0.1  CCC(O)O AC-11576 [0,1,0,0,0,0|0,0,2]=3
4  B4R0.1  CNC(N)=S AC-31942 [0,1,0,0,0,0|1,1,0]=3
5  B4R0.1  C[C@H](N)CN AC-75237 [0,1,0,0,0,0|2,0,1]=4
6  B4R0.1  C[C@H](N)CO AC-14576 [0,1,0,0,0,0|1,0,1]=3
7  B4R0.1  NC(=O)CBr AC-13350 [0,1,0,0,0,0|1,0,0]=2
8  B4R0.1  NCC(N)=O AC-16143 [0,1,0,0,0,0|1,0,0]=2
9  B4R0.1  NCC(N)=O AC-65789 [0,1,0,0,0,0|1,0,0]=2
10  B4R0.1  O=C(O)CO AC-77042 [0,1,0,0,0,0|0,0,0]=1
11  B4R1.2  BrC1CC1 AC-17947 [0,0,0,1,0,0|2,0,1]=4
12  B4R1.2  C[C@@H]1CO1 AC-13228 [0,0,0,1,0,0|1,0,1]=3
13  B4R1.2  C[C@H]1CO1 AC-13231 [0,0,0,1,0,0|1,0,1]=3
14  B3R0.1  N#CCN AC-22471 [1,1,0,0,0,0|1,0,1]=4
15  B5R0.1  C[C@@H](N)CCO AC-68296 [0,2,0,0,0,0|1,0,1]=4
16  B5R0.1  N#CCC(N)=O AC-76913 [0,2,0,0,0,0|1,0,0]=3
17  B5R0.3  CCC(N)CO AC-76788 [0,2,0,0,0,0|1,0,1]=4
18  B5R0.3  NCC(O)CO AC-15144 [0,2,0,0,0,0|0,0,2]=4
19  B5R0.3  NC[C@@H](O)CO AC-12808 [0,2,0,0,0,0|0,0,2]=4
20  B5R0.3  NC[C@H](O)CO AC-74173 [0,2,0,0,0,0|0,0,2]=4
21  B5R0.3  OC[C@@H](O)CCl AC-11570 [0,2,0,0,0,0|0,0,2]=4
22  B5R0.4  CCS(N)(=O)=O AC-76829 [0,2,0,0,0,0|1,0,1]=4
23  B5R0.4  CNS(=O)(=O)O AC-93774 [0,2,0,0,0,0|1,0,0]=3
24  B5R0.4  CNS(C)(=O)=O AC-60010 [0,2,0,0,0,0|1,0,1]=4
25  B5R0.5  CC(C)B(O)O AC-75312 [0,2,0,0,0,0|1,0,1]=4
26  B5R0.5  CC(S)C(=O)O AC-65008 [0,2,0,0,0,0|0,0,0]=2
27  B5R0.5  C[C@@H](N)C(N)=O AC-77271 [0,2,0,0,0,0|1,0,0]=3
28  B5R0.5  C[C@H](N)C(=O)O AC-77155 [0,2,0,0,0,0|0,0,0]=2
29  B5R0.5  C[C@H](N)C(N)=O AC-11061 [0,2,0,0,0,0|1,0,0]=3
30  B5R0.5  O=C(O)C(F)F AC-18400 [0,2,0,0,0,0|0,0,0]=2
31  B5R1.2  O=C1CSC1 AC-80488 [0,1,0,1,0,0|0,1,0]=3