0 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 7 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 8 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 9 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 10 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,0]=2 11 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|1,0,0]=2 12 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 13 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|3,0,0]=4 15 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|3,0,0]=4 16 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|3,0,0]=4 17 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|3,0,0]=4 18 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|0,0,0]=1 19 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|0,0,0]=1 20 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|3,0,0]=4 21 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|3,0,0]=4 22 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,1]=3 23 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,1]=3 24 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|0,0,2]=3 25 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|0,0,2]=3 26 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|0,0,2]=3 27 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|0,0,2]=3 28 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 29 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 30 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 33 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 34 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|1,0,1]=3 35 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|1,0,1]=3 36 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 37 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 38 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 39 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 40 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,1]=4 41 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,1]=4 42 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|1,0,1]=4 43 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|1,0,1]=4 44 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|1,0,1]=4 45 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|1,0,1]=4 46 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|0,0,1]=3 47 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|0,0,1]=3 48 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,1]=4 49 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,1]=4 50 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,0,1]=4 51 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,0,1]=4 52 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 53 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 54 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 55 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 56 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 57 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 58 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,1]=3 59 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,1]=3 60 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,1]=4 61 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,1]=4 62 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,1]=4 63 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,1]=4 64 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 65 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 66 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|0,0,2]=4 67 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|0,0,2]=4 68 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,2]=4 69 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,2]=4 70 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,2]=4 71 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,2]=4 72 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|0,0,2]=4 73 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|0,0,2]=4 74 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|2,0,0]=4 75 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|2,0,0]=4 76 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 77 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 78 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|0,0,0]=2 79 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|0,0,0]=2 80 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|0,0,2]=4 81 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,2,0,0,0,0|0,0,2]=4 82 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 83 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 84 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 85 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 86 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,1]=4 87 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,1]=4 88 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 89 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 90 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|0,0,0]=2 91 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|0,0,0]=2 92 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 93 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 94 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|0,0,2]=4 95 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,2,0,0,0,0|0,0,2]=4 96 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|0,0,2]=4 97 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,2,0,0,0,0|0,0,2]=4 98 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 99 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 100 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,2,0,0,0,0|0,0,2]=4 101 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,2,0,0,0,0|0,0,2]=4 102 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,2,0,0,0,0|0,0,2]=4 103 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,2,0,0,0,0|0,0,2]=4 104 B7R0.13 COC(C)(C)C(=O)N WXVL_AK0084SB0207 [0,2,0,0,0,0|1,0,1]=4 105 B7R0.13 COC(C)(C)C(=O)N WXVL_AK0084SB0207 [0,2,0,0,0,0|1,0,1]=4 106 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,2,0,0,0,0|0,0,2]=4 107 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,2,0,0,0,0|0,0,2]=4 108 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,2,0,0,0,0|1,0,1]=4 109 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,2,0,0,0,0|1,0,1]=4 110 B7R0.15 COC(OC)C(=O)N WXVL_AK0084SB8546 [0,2,0,0,0,0|1,0,1]=4 111 B7R0.15 COC(OC)C(=O)N WXVL_AK0084SB8546 [0,2,0,0,0,0|1,0,1]=4 112 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 113 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 114 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,1]=4 115 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,1]=4 116 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,1]=4 117 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,1]=4 118 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 119 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 120 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,2]=4 121 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,2]=4 122 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|0,0,2]=4 123 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,1,0,1,0,0|0,0,2]=4 124 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,1,0,1,0,0|0,0,2]=4 125 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,1,0,1,0,0|0,0,2]=4