0  B4R0.1  C#CC(=O)N WXVL_AK0084SB0338 [0,1,0,0,0,0|1,0,2]=4
1  B4R0.1  C#CC(=O)N WXVL_AK0084SB0338 [0,1,0,0,0,0|1,0,2]=4
2  B4R0.1  CCC(=O)N WXVL_AK0084SB0064 [0,1,0,0,0,0|1,0,1]=3
3  B4R0.1  CCC(=O)N WXVL_AK0084SB0064 [0,1,0,0,0,0|1,0,1]=3
4  B4R0.1  NC(=O)CO WXVL_AK0084SB2706 [0,1,0,0,0,0|0,1,1]=3
5  B4R0.1  NC(=O)CO WXVL_AK0084SB2706 [0,1,0,0,0,0|0,1,1]=3
6  B3R0.2  CC(=O)N WXVL_AK0084SB0150 [1,1,0,0,0,0|0,0,1]=3
7  B3R0.2  CC(=O)N WXVL_AK0084SB0150 [1,1,0,0,0,0|0,0,1]=3
8  B5R0.1  C#CCC(=O)N WXVL_AK0084SB3070 [0,2,0,0,0,0|1,0,1]=4
9  B5R0.1  C#CCC(=O)N WXVL_AK0084SB3070 [0,2,0,0,0,0|1,0,1]=4
10  B5R0.1  C=CCC(=O)N WXVL_AK0084SB2732 [0,2,0,0,0,0|1,0,1]=4
11  B5R0.1  C=CCC(=O)N WXVL_AK0084SB2732 [0,2,0,0,0,0|1,0,1]=4
12  B5R0.1  CCCC(=O)N WXVL_AK0084SB0073 [0,2,0,0,0,0|1,0,0]=3
13  B5R0.1  CCCC(=O)N WXVL_AK0084SB0073 [0,2,0,0,0,0|1,0,0]=3
14  B5R0.1  COCC(=O)N WXVL_AK0084SB0090 [0,2,0,0,0,0|0,1,1]=4
15  B5R0.1  COCC(=O)N WXVL_AK0084SB0090 [0,2,0,0,0,0|0,1,1]=4
16  B5R0.1  CSCC(=O)N WXVL_AK0084SB1267 [0,2,0,0,0,0|0,0,1]=3
17  B5R0.1  CSCC(=O)N WXVL_AK0084SB1267 [0,2,0,0,0,0|0,0,1]=3
18  B5R0.1  N#CCC(=O)N WXVL_AK0084SB0057 [0,2,0,0,0,0|1,0,1]=4
19  B5R0.1  N#CCC(=O)N WXVL_AK0084SB0057 [0,2,0,0,0,0|1,0,1]=4
20  B5R0.3  CCC(=O)NC WXVL_AK00442SB0064 [0,2,0,0,0,0|1,0,1]=4
21  B5R0.3  CCC(=O)NC WXVL_AK00442SB0064 [0,2,0,0,0,0|1,0,1]=4
22  B5R0.3  CNC(=O)CO WXVL_AK00442SB2706 [0,2,0,0,0,0|0,1,1]=4
23  B5R0.3  CNC(=O)CO WXVL_AK00442SB2706 [0,2,0,0,0,0|0,1,1]=4
24  B5R0.4  CCS(=O)(=O)N WXVL_AK0084HU0028 [0,2,0,0,0,0|2,0,0]=4
25  B5R0.4  CCS(=O)(=O)N WXVL_AK0084HU0028 [0,2,0,0,0,0|2,0,0]=4
26  B5R0.5  CC(C)C(=O)N WXVL_AK0084SB0052 [0,2,0,0,0,0|1,0,1]=4
27  B5R0.5  CC(C)C(=O)N WXVL_AK0084SB0052 [0,2,0,0,0,0|1,0,1]=4
28  B5R0.5  CC(S)C(=O)N WXVL_AK0084SB2708 [0,2,0,0,0,0|0,0,1]=3
29  B5R0.5  CC(S)C(=O)N WXVL_AK0084SB2708 [0,2,0,0,0,0|0,0,1]=3
30  B5R0.5  C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,2,0,0,0,0|0,1,1]=4
31  B5R0.5  C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,2,0,0,0,0|0,1,1]=4
32  B5R0.5  NC(=O)C(F)F WXVL_AK0084SB0079 [0,2,0,0,0,0|1,0,1]=4
33  B5R0.5  NC(=O)C(F)F WXVL_AK0084SB0079 [0,2,0,0,0,0|1,0,1]=4