0 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,0,0,0,0,0|2,0,0]=2 1 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [0,0,0,0,0,0|2,0,0]=2 2 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,0,0,0,0,0|2,0,0]=2 3 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [0,0,0,0,0,0|2,0,0]=2 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|1,0,0]=1 7 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [0,0,0,0,0,0|1,0,0]=1 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|2,0,0]=3 11 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,1,0,0,0,0|2,0,0]=3 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|2,0,0]=3 17 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,1,0,0,0,0|2,0,0]=3 18 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,1,0,0,0,0|2,0,0]=3 19 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,1,0,0,0,0|2,0,0]=3 20 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,1,0,0,0,0|2,0,0]=3 21 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,1,0,0,0,0|2,0,0]=3 22 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,1,0,0,0,0|1,0,0]=2 23 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,1,0,0,0,0|1,0,0]=2 24 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,1,0,0,0,0|1,1,0]=3 25 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,1,0,0,0,0|1,1,0]=3 26 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,1,0,0,0,0|2,0,0]=3 27 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,1,0,0,0,0|2,0,0]=3 28 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,1,0,0,0,0|2,0,0]=3 29 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,1,0,0,0,0|2,0,0]=3 30 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,1,0,0,0,0|2,0,0]=3 31 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,1,0,0,0,0|2,0,0]=3 32 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,1,0,0,0,0|1,0,0]=2 33 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,1,0,0,0,0|1,0,0]=2 34 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [0,1,0,0,0,0|3,0,0]=4 35 B5R0.4 CCS(=O)(=O)N WXVL_AK0084HU0028 [0,1,0,0,0,0|3,0,0]=4 36 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,1,0,0,0,0|2,0,0]=3 37 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,1,0,0,0,0|2,0,0]=3 38 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,1,0,0,0,0|1,0,1]=3 39 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,1,0,0,0,0|1,0,1]=3 40 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,1,0,0,0,0|2,0,0]=3 41 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,1,0,0,0,0|2,0,0]=3 42 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,1,0,0,0,0|2,0,0]=3 43 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,1,0,0,0,0|2,0,0]=3 44 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,1,0,0,0,0|1,1,0]=3 45 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,1,0,0,0,0|1,1,0]=3 46 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,1,0,0,0,0|1,0,0]=2 47 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,1,0,0,0,0|1,0,0]=2 48 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,1,0,0,0,0|1,0,1]=3 49 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,1,0,0,0,0|1,0,1]=3 50 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,1,0,0,0,0|2,0,0]=3 51 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,1,0,0,0,0|2,0,0]=3 52 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,2,0,0,0,0|2,0,0]=4 53 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,2,0,0,0,0|2,0,0]=4 54 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,2,0,0,0,0|2,0,0]=4 55 B6R0.1 C#CCC(=O)NC WXVL_AK00442SB3070 [0,2,0,0,0,0|2,0,0]=4 56 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,2,0,0,0,0|2,0,0]=4 57 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,2,0,0,0,0|2,0,0]=4 58 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,2,0,0,0,0|2,0,0]=4 59 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,2,0,0,0,0|2,0,0]=4 60 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,2,0,0,0,0|2,0,0]=4 61 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,2,0,0,0,0|2,0,0]=4 62 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,2,0,0,0,0|2,0,0]=4 63 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,2,0,0,0,0|2,0,0]=4 64 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,2,0,0,0,0|2,0,0]=4 65 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,2,0,0,0,0|2,0,0]=4 66 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,2,0,0,0,0|1,0,0]=3 67 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,2,0,0,0,0|1,0,0]=3 68 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,2,0,0,0,0|1,0,1]=4 69 B6R0.1 CNC(=O)CC#N WXVL_AK00442SB0057 [0,2,0,0,0,0|1,0,1]=4 70 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,2,0,0,0,0|1,0,0]=3 71 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,2,0,0,0,0|1,0,0]=3 72 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,2,0,0,0,0|1,1,0]=4 73 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,2,0,0,0,0|1,1,0]=4 74 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,2,0,0,0,0|2,0,0]=4 75 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,2,0,0,0,0|2,0,0]=4 76 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,2,0,0,0,0|2,0,0]=4 77 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,2,0,0,0,0|2,0,0]=4 78 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,2,0,0,0,0|2,0,0]=4 79 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,2,0,0,0,0|2,0,0]=4 80 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,2,0,0,0,0|1,0,0]=3 81 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,2,0,0,0,0|1,0,0]=3 82 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,2,0,0,0,0|1,0,0]=3 83 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,2,0,0,0,0|1,0,0]=3 84 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,2,0,0,0,0|2,0,0]=4 85 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,2,0,0,0,0|2,0,0]=4 86 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,2,0,0,0,0|2,0,0]=4 87 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,2,0,0,0,0|2,0,0]=4 88 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,2,0,0,0,0|2,0,0]=4 89 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,2,0,0,0,0|2,0,0]=4 90 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,2,0,0,0,0|1,0,1]=4 91 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,2,0,0,0,0|1,0,1]=4 92 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,2,0,0,0,0|2,0,0]=4 93 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,2,0,0,0,0|2,0,0]=4 94 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,2,0,0,0,0|2,0,0]=4 95 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,2,0,0,0,0|2,0,0]=4 96 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,2,0,0,0,0|2,0,0]=4 97 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,2,0,0,0,0|2,0,0]=4 98 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,2,0,0,0,0|1,0,0]=3 99 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,2,0,0,0,0|1,0,0]=3 100 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,2,0,0,0,0|1,0,0]=3 101 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,2,0,0,0,0|1,0,0]=3 102 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,2,0,0,0,0|1,0,1]=4 103 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,2,0,0,0,0|1,0,1]=4 104 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,2,0,0,0,0|1,0,0]=3 105 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,2,0,0,0,0|1,0,0]=3 106 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,2,0,0,0,0|2,0,0]=4 107 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,2,0,0,0,0|2,0,0]=4 108 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,2,0,0,0,0|1,1,0]=4 109 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,2,0,0,0,0|1,1,0]=4 110 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,2,0,0,0,0|2,0,0]=4 111 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,2,0,0,0,0|2,0,0]=4 112 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,2,0,0,0,0|1,0,0]=3 113 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,2,0,0,0,0|1,0,0]=3 114 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,2,0,0,0,0|1,0,0]=3 115 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,2,0,0,0,0|1,0,0]=3 116 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [0,2,0,0,0,0|2,0,0]=4 117 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [0,2,0,0,0,0|2,0,0]=4 118 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,2,0,0,0,0|2,0,0]=4 119 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,2,0,0,0,0|2,0,0]=4 120 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,2,0,0,0,0|2,0,0]=4 121 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,2,0,0,0,0|2,0,0]=4 122 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,2,0,0,0,0|2,0,0]=4 123 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,2,0,0,0,0|2,0,0]=4 124 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,2,0,0,0,0|2,0,0]=4 125 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,2,0,0,0,0|2,0,0]=4 126 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,2,0,0,0,0|2,0,0]=4 127 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,2,0,0,0,0|2,0,0]=4 128 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,2,0,0,0,0|1,0,0]=3 129 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,2,0,0,0,0|1,0,0]=3 130 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,2,0,0,0,0|1,1,0]=4 131 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,2,0,0,0,0|1,1,0]=4 132 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,2,0,0,0,0|1,0,0]=3 133 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,2,0,0,0,0|1,0,0]=3 134 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,2,0,0,0,0|1,1,0]=4 135 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,2,0,0,0,0|1,1,0]=4 136 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,2,0,0,0,0|2,0,0]=4 137 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,2,0,0,0,0|2,0,0]=4 138 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,2,0,0,0,0|2,0,0]=4 139 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,2,0,0,0,0|2,0,0]=4 140 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,2,0,0,0,0|2,0,0]=4 141 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,2,0,0,0,0|2,0,0]=4 142 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,2,0,0,0,0|2,0,0]=4 143 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,2,0,0,0,0|2,0,0]=4 144 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,2,0,0,0,0|1,0,0]=3 145 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,2,0,0,0,0|1,0,0]=3 146 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,2,0,0,0,0|2,0,0]=4 147 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,2,0,0,0,0|2,0,0]=4 148 B6R0.7 NC(=O)C(Cl)(Cl)Cl WXVL_AK0084SB0416 [0,2,0,0,0,0|2,0,0]=4 149 B6R0.7 NC(=O)C(Cl)(Cl)Cl WXVL_AK0084SB0416 [0,2,0,0,0,0|2,0,0]=4 150 B6R0.7 NC(=O)C(F)(F)Cl WXVL_AK0084SB3129 [0,2,0,0,0,0|2,0,0]=4 151 B6R0.7 NC(=O)C(F)(F)Cl WXVL_AK0084SB3129 [0,2,0,0,0,0|2,0,0]=4 152 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,1,0,1,0,0|2,0,0]=4 153 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,1,0,1,0,0|2,0,0]=4