0 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|2,0,1]=4 3 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|2,0,1]=4 4 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|0,0,2]=3 5 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|0,0,2]=3 6 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 7 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|1,0,0]=2 8 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|0,0,0]=1 9 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|0,0,0]=1 10 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|1,0,0]=2 11 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|1,0,0]=2 12 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|1,0,0]=2 13 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|1,0,0]=2 14 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 16 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|2,0,1]=4 18 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,1]=4 19 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,1]=4 20 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 21 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 22 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 23 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 24 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,0]=2 25 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,0]=2 26 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,0]=3 27 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,0]=3 28 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,0]=3 29 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,0]=3 30 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,1,0,0,0,0|2,0,0]=4 31 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,1,0,0,0,0|2,0,0]=4 32 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|1,0,0]=3 33 B7R0.2 C#CC(=O)NC(C)C WXVL_AK0030SB0338 [0,2,0,0,0,0|1,0,0]=3 34 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,1]=4 35 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,2,0,0,0,0|1,0,1]=4 36 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,1]=4 37 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,2,0,0,0,0|1,0,1]=4 38 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,1]=4 39 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,2,0,0,0,0|1,0,1]=4 40 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 41 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,2,0,0,0,0|1,0,0]=3 42 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 43 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,0]=3 44 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 45 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,0]=3 46 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,0]=3 47 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,0]=3 48 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,0]=2 49 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,2,0,0,0,0|0,0,0]=2 50 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|1,0,0]=3 51 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,2,0,0,0,0|1,0,0]=3 52 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,0]=2 53 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,2,0,0,0,0|0,0,0]=2 54 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 55 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,2,0,0,0,0|1,0,0]=3 56 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,2]=4 57 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,2]=4 58 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|0,0,0]=2 59 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [0,2,0,0,0,0|0,0,0]=2 60 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,0]=3 61 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,0]=3 62 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|1,0,0]=3 63 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|1,0,0]=3 64 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|1,0,1]=4 65 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|1,0,1]=4 66 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|2,0,0]=4 67 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|2,0,0]=4 68 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 71 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [0,2,0,0,0,0|1,0,0]=3 72 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|0,0,0]=2 73 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [0,2,0,0,0,0|0,0,0]=2 74 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|0,0,0]=2 75 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [0,2,0,0,0,0|0,0,0]=2 76 B7R0.9 CC(C)CS(=O)(=O)N WXVL_AK0084HU0149 [0,2,0,0,0,0|1,0,0]=3 77 B7R0.9 CC(C)CS(=O)(=O)N WXVL_AK0084HU0149 [0,2,0,0,0,0|1,0,0]=3 78 B7R0.9 CS(=O)(=O)CC(=O)N WXVL_AK0084SB0162 [0,2,0,0,0,0|2,0,0]=4 79 B7R0.9 CS(=O)(=O)CC(=O)N WXVL_AK0084SB0162 [0,2,0,0,0,0|2,0,0]=4 80 B7R0.9 NC(=O)CC(F)(F)F WXVL_AK0084SB0177 [0,2,0,0,0,0|2,0,0]=4 81 B7R0.9 NC(=O)CC(F)(F)F WXVL_AK0084SB0177 [0,2,0,0,0,0|2,0,0]=4 82 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,1]=4 83 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|1,0,1]=4 84 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 85 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,2,0,0,0,0|1,0,0]=3 86 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|0,0,1]=3 87 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|0,0,1]=3 88 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|0,0,0]=2 89 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,2,0,0,0,0|0,0,0]=2 90 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|1,0,1]=4 91 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|1,0,1]=4 92 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|0,0,2]=4 93 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|0,0,2]=4 94 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 95 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 96 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 97 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 98 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 99 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 100 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|0,0,0]=2 101 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [0,2,0,0,0,0|0,0,0]=2 102 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,0]=3 103 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,0]=3 104 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [0,2,0,0,0,0|2,0,0]=4 105 B7R0.6 CC(=O)NCC(F)F WXVL_AK0136SB0150 [0,2,0,0,0,0|2,0,0]=4 106 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,0]=3 107 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,0]=3 108 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|1,0,1]=4 109 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|1,0,1]=4 110 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|1,0,1]=4 111 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|1,0,1]=4 112 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|0,0,1]=3 113 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|0,0,1]=3 114 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|0,0,0]=2 115 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|0,0,0]=2 116 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|0,0,0]=2 117 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [0,2,0,0,0,0|0,0,0]=2 118 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|1,0,0]=3 119 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|1,0,0]=3 120 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,0]=2 121 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,1,0,1,0,0|0,0,0]=2 122 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,1,0,1,0,0|1,0,0]=3 123 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,1,0,1,0,0|1,0,0]=3 124 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,1,0,1,0,0|1,0,0]=3 125 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,1,0,1,0,0|1,0,0]=3 126 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 127 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [0,1,0,1,0,0|1,0,0]=3 128 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|0,0,0]=2 129 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [0,1,0,1,0,0|0,0,0]=2