0 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [0,0,0,0,0,0|0,0,0]=0 1 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [0,0,0,0,0,0|0,0,0]=0 2 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,1,0,0,0,0|0,0,1]=2 3 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,1,0,0,0,0|0,0,1]=2 4 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,1,0,0,0,0|0,0,0]=1 5 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,1,0,0,0,0|0,0,0]=1 6 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [0,1,0,0,0,0|0,0,0]=1 7 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [0,1,0,0,0,0|0,0,0]=1 8 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [0,1,0,0,0,0|0,0,0]=1 9 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [0,1,0,0,0,0|0,0,0]=1 10 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,2,0,0,0,0|0,0,0]=2 11 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,2,0,0,0,0|0,0,0]=2 12 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,2,0,0,0,0|0,0,0]=2 13 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,2,0,0,0,0|0,0,0]=2 14 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,2,0,0,0,0|0,0,0]=2 15 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,2,0,0,0,0|0,0,0]=2 16 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,2,0,0,0,0|0,0,0]=2 17 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,2,0,0,0,0|0,0,0]=2 18 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,2,0,0,0,0|0,0,0]=2 19 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,2,0,0,0,0|0,0,0]=2 20 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,2,0,0,0,0|0,0,0]=2 21 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,2,0,0,0,0|0,0,0]=2 22 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,2,0,0,0,0|0,0,0]=2 23 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,2,0,0,0,0|0,0,0]=2 24 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,2,0,0,0,0|0,0,0]=2 25 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,2,0,0,0,0|0,0,0]=2 26 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,2,0,0,0,0|0,0,0]=2 27 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,2,0,0,0,0|0,0,0]=2 28 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,2,0,0,0,0|0,0,1]=3 29 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,2,0,0,0,0|0,0,1]=3 30 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,2,0,0,0,0|0,0,0]=2 31 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,2,0,0,0,0|0,0,0]=2 32 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,2,0,0,0,0|0,0,0]=2 33 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,2,0,0,0,0|0,0,0]=2 34 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [0,2,0,0,0,0|1,0,0]=3 35 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [0,2,0,0,0,0|1,0,0]=3 36 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,2,0,0,0,0|0,0,1]=3 37 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,2,0,0,0,0|0,0,1]=3 38 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,2,0,0,0,0|0,0,0]=2 39 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,2,0,0,0,0|0,0,0]=2 40 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,2,0,0,0,0|0,0,0]=2 41 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,2,0,0,0,0|0,0,0]=2 42 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,2,0,0,0,0|0,0,0]=2 43 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,2,0,0,0,0|0,0,0]=2 44 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,2,0,0,0,0|0,0,0]=2 45 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,2,0,0,0,0|0,0,0]=2 46 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,2,0,0,0,0|0,0,0]=2 47 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,2,0,0,0,0|0,0,0]=2 48 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,2,0,0,0,0|0,0,1]=3 49 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,2,0,0,0,0|0,0,1]=3 50 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,2,0,0,0,0|0,0,0]=2 51 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,2,0,0,0,0|0,0,0]=2