0 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,0,0,0,0,0|2,0,1]=3 3 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,0,0,0,0,0|2,0,1]=3 4 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [0,0,0,0,0,0|2,0,0]=2 5 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [0,0,0,0,0,0|2,0,0]=2 6 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [0,0,0,0,0,0|1,0,2]=3 7 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [0,0,0,0,0,0|1,0,2]=3 8 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [1,0,0,0,0,0|1,0,0]=2 9 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [1,0,0,0,0,0|1,0,0]=2 10 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,1,0,0,0,0|2,0,1]=4 11 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,1,0,0,0,0|2,0,1]=4 12 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,1,0,0,0,0|2,0,0]=3 13 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,1,0,0,0,0|2,0,0]=3 14 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,1,0,0,0,0|2,0,0]=3 15 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,1,0,0,0,0|2,0,0]=3 16 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,1,0,0,0,0|2,0,1]=4 17 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,1,0,0,0,0|2,0,1]=4 18 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,1,0,0,0,0|2,0,1]=4 19 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,1,0,0,0,0|2,0,1]=4 20 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,1,0,0,0,0|1,0,1]=3 21 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,1,0,0,0,0|1,0,1]=3 22 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,1,0,0,0,0|1,0,2]=4 23 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,1,0,0,0,0|1,0,2]=4 24 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,1,0,0,0,0|1,1,1]=4 25 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,1,0,0,0,0|1,1,1]=4 26 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,1,0,0,0,0|2,0,1]=4 27 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,1,0,0,0,0|2,0,1]=4 28 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,1,0,0,0,0|1,0,1]=3 29 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,1,0,0,0,0|1,0,1]=3 30 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,1,0,0,0,0|1,0,1]=3 31 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,1,0,0,0,0|1,0,1]=3 32 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,1,0,0,0,0|0,0,2]=3 33 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,1,0,0,0,0|0,0,2]=3 34 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,1,0,0,0,0|1,0,1]=3 35 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,1,0,0,0,0|1,0,1]=3 36 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,1,0,0,0,0|0,0,0]=1 37 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,1,0,0,0,0|0,0,0]=1 38 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,1,0,0,0,0|2,0,0]=3 39 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,1,0,0,0,0|2,0,0]=3 40 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,1,0,0,0,0|1,0,1]=3 41 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,1,0,0,0,0|1,0,1]=3 42 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,1,0,0,0,0|0,1,1]=3 43 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,1,0,0,0,0|0,1,1]=3 44 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,1,0,0,0,0|0,0,2]=3 45 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,1,0,0,0,0|0,0,2]=3 46 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,1,0,0,0,0|1,0,0]=2 47 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,1,0,0,0,0|1,0,0]=2 48 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,1,0,0,0,0|2,0,1]=4 49 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,2,0,0,0,0|1,0,1]=4 51 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,2,0,0,0,0|1,0,1]=4 52 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,2,0,0,0,0|1,0,1]=4 53 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,2,0,0,0,0|1,0,1]=4 54 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,2,0,0,0,0|1,0,0]=3 55 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,2,0,0,0,0|1,0,0]=3 56 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,2,0,0,0,0|1,0,0]=3 57 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,2,0,0,0,0|1,0,0]=3 58 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,2,0,0,0,0|1,0,1]=4 59 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,2,0,0,0,0|1,0,1]=4 60 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,2,0,0,0,0|1,0,1]=4 61 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,2,0,0,0,0|1,0,1]=4 62 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,2,0,0,0,0|1,0,1]=4 63 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,2,0,0,0,0|1,0,1]=4 64 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,2,0,0,0,0|0,0,2]=4 65 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,2,0,0,0,0|0,0,2]=4 66 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,2,0,0,0,0|1,0,1]=4 67 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,2,0,0,0,0|1,0,1]=4 68 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,2,0,0,0,0|0,0,2]=4 69 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,2,0,0,0,0|0,0,2]=4 70 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,2,0,0,0,0|0,1,1]=4 71 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,2,0,0,0,0|0,1,1]=4 72 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,2,0,0,0,0|1,0,0]=3 73 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,2,0,0,0,0|1,0,0]=3 74 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,2,0,0,0,0|1,0,1]=4 75 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,2,0,0,0,0|1,0,1]=4 76 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,2,0,0,0,0|1,0,1]=4 77 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,2,0,0,0,0|1,0,1]=4 78 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,2,0,0,0,0|0,0,2]=4 79 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,2,0,0,0,0|0,0,2]=4 80 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,2,0,0,0,0|2,0,0]=4 81 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,2,0,0,0,0|2,0,0]=4 82 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,2,0,0,0,0|1,0,1]=4 83 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,2,0,0,0,0|1,0,1]=4 84 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,2,0,0,0,0|1,0,0]=3 85 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,2,0,0,0,0|1,0,0]=3 86 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,2,0,0,0,0|1,0,0]=3 87 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,2,0,0,0,0|1,0,0]=3 88 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,2,0,0,0,0|0,0,0]=2 89 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,2,0,0,0,0|0,0,0]=2 90 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,2,0,0,0,0|1,0,1]=4 91 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,2,0,0,0,0|1,0,1]=4 92 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,2,0,0,0,0|1,0,1]=4 93 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,2,0,0,0,0|1,0,1]=4 94 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,2,0,0,0,0|1,0,1]=4 95 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,2,0,0,0,0|1,0,1]=4 96 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,2,0,0,0,0|0,0,2]=4 97 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,2,0,0,0,0|0,0,2]=4 98 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,2,0,0,0,0|0,0,2]=4 99 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,2,0,0,0,0|0,0,2]=4 100 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,2,0,0,0,0|0,0,0]=2 101 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,2,0,0,0,0|0,0,0]=2 102 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,2,0,0,0,0|0,0,0]=2 103 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,2,0,0,0,0|0,0,0]=2 104 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,2,0,0,0,0|1,0,1]=4 105 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,2,0,0,0,0|1,0,1]=4 106 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,2,0,0,0,0|0,1,1]=4 107 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,2,0,0,0,0|0,1,1]=4 108 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,2,0,0,0,0|1,0,1]=4 109 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,2,0,0,0,0|1,0,1]=4 110 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,2,0,0,0,0|0,0,2]=4 111 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,2,0,0,0,0|0,0,2]=4 112 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,2,0,0,0,0|0,0,2]=4 113 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,2,0,0,0,0|0,0,2]=4 114 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,2,0,0,0,0|2,0,0]=4 115 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,2,0,0,0,0|2,0,0]=4 116 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,2,0,0,0,0|1,0,0]=3 117 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,2,0,0,0,0|1,0,0]=3 118 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,2,0,0,0,0|1,0,1]=4 119 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,2,0,0,0,0|1,0,1]=4 120 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,2,0,0,0,0|1,0,1]=4 121 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,2,0,0,0,0|1,0,1]=4 122 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,2,0,0,0,0|1,0,1]=4 123 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,2,0,0,0,0|1,0,1]=4 124 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,2,0,0,0,0|2,0,0]=4 125 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,2,0,0,0,0|2,0,0]=4 126 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,2,0,0,0,0|1,0,1]=4 127 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,2,0,0,0,0|1,0,1]=4 128 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,2,0,0,0,0|1,0,1]=4 129 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,2,0,0,0,0|1,0,1]=4 130 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,2,0,0,0,0|1,0,1]=4 131 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,2,0,0,0,0|1,0,1]=4 132 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,2,0,0,0,0|0,0,2]=4 133 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,2,0,0,0,0|0,0,2]=4 134 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,2,0,0,0,0|1,0,1]=4 135 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,2,0,0,0,0|1,0,1]=4 136 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,1,0,1,0,0|1,0,1]=4 137 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,1,0,1,0,0|1,0,1]=4