0 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,0,0,0,0,0|3,0,0]=3 4 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,0,0,0,0,0|3,0,0]=3 8 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,0,0,0,0,0|4,0,0]=4 9 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,0,0,0,0,0|4,0,0]=4 10 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,0,0,0,0,0|2,0,0]=3 15 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,0,0,0,0,0|2,0,0]=3 16 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,0,0,0,0,0|3,0,0]=4 17 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,0,0,0,0,0|3,0,0]=4 18 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,0,0,0,0,0|3,0,0]=4 19 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,0,0,0,0,0|3,0,0]=4 20 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,0,0,0,0,0|3,0,0]=4 21 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,0,0,0,0,0|3,0,0]=4 22 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,0,0,0,0,0|1,0,2]=4 25 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,0,0,0,0,0|1,0,2]=4 26 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,0,0,0,0,0|3,0,0]=4 27 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,0,0,0,0,0|3,0,0]=4 28 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,0,0,0,0,0|2,0,0]=3 29 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,0,0,0,0,0|2,0,0]=3 30 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,0,0,0,0,0|2,0,0]=3 31 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,0,0,0,0,0|2,0,0]=3 32 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,0,0,0,0,0|2,0,0]=3 33 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,0,0,0,0,0|2,0,0]=3 34 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,0,0,0,0,0|1,0,2]=4 35 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,0,0,0,0,0|1,0,2]=4 36 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,0,0,0,0,0|3,0,0]=4 37 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [1,0,0,0,0,0|3,0,0]=4 38 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|3,0,0]=4 39 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|3,0,0]=4 40 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|3,0,0]=4 41 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|3,0,0]=4 42 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,1,0,0,0,0|3,0,0]=4 43 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,1,0,0,0,0|3,0,0]=4 44 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,1,0,0,0,0|3,0,0]=4 45 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,1,0,0,0,0|3,0,0]=4 46 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,1,0,0,0,0|3,0,0]=4 47 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,1,0,0,0,0|3,0,0]=4 48 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,1,0,0,0,0|3,0,0]=4 49 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,1,0,0,0,0|3,0,0]=4 50 B7R0.13 CC(C)(CCl)C(=O)N WXVL_AK0084SB3392 [0,1,0,0,0,0|3,0,0]=4 51 B7R0.13 CC(C)(CCl)C(=O)N WXVL_AK0084SB3392 [0,1,0,0,0,0|3,0,0]=4 52 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,1,0,0,0,0|3,0,0]=4 53 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,1,0,0,0,0|3,0,0]=4 54 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,1,0,0,0,0|3,0,0]=4 55 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,1,0,0,0,0|3,0,0]=4 56 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,1,0,0,0,0|3,0,0]=4 57 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,1,0,0,0,0|3,0,0]=4 58 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,1,0,0,0,0|3,0,0]=4 59 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,1,0,0,0,0|3,0,0]=4 60 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,0,0,1,0,0|3,0,0]=4 61 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [0,0,0,1,0,0|3,0,0]=4 62 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,0,0,1,0,0|3,0,0]=4 63 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [0,0,0,1,0,0|3,0,0]=4 64 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,0,0,1,0,0|3,0,0]=4 65 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [0,0,0,1,0,0|3,0,0]=4 66 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,0,0,1,0,0|3,0,0]=4 67 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [0,0,0,1,0,0|3,0,0]=4 68 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,0,0,1,0,0|3,0,0]=4 69 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,0,0,1,0,0|3,0,0]=4 70 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,0,0,1,0,0|3,0,0]=4 72 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,0,0,1,0,0|3,0,0]=4 73 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,0,0,1,0,0|3,0,0]=4 74 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,0,0,1,0,0|3,0,0]=4 75 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,0,0,1,0,0|3,0,0]=4 76 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,0,0,0,0,1|3,0,0]=4 77 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,0,0,0,0,1|3,0,0]=4 78 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,0,0,0,0,1|2,0,0]=3 79 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,0,0,0,0,1|2,0,0]=3 80 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,0,0,0,0,1|3,0,0]=4 81 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,0,0,0,0,1|3,0,0]=4 82 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,0,0,0,0,1|3,0,0]=4 83 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,0,0,0,0,1|3,0,0]=4 84 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,0,0,0,0,1|3,0,0]=4 85 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,0,0,0,0,1|3,0,0]=4 86 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,0,0,0,0,1|3,0,0]=4 87 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,0,0,0,0,1|3,0,0]=4 88 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [2,0,0,0,0,0|1,0,0]=3 89 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [2,0,0,0,0,0|1,0,0]=3 90 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [2,0,0,0,0,0|2,0,0]=4 91 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [2,0,0,0,0,0|2,0,0]=4 92 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [2,0,0,0,0,0|0,0,1]=3 93 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [2,0,0,0,0,0|0,0,1]=3 94 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [1,1,0,0,0,0|2,0,0]=4 95 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [1,1,0,0,0,0|2,0,0]=4 96 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [1,1,0,0,0,0|2,0,0]=4 97 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [1,1,0,0,0,0|2,0,0]=4 98 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|2,0,0]=4 99 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|2,0,0]=4 100 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,1,0,0,0,0|1,0,0]=3 101 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,1,0,0,0,0|1,0,0]=3 102 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [1,1,0,0,0,0|2,0,0]=4 103 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [1,1,0,0,0,0|2,0,0]=4 104 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [1,1,0,0,0,0|2,0,0]=4 105 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [1,1,0,0,0,0|2,0,0]=4 106 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,1,0,0,0,0|2,0,0]=4 107 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,1,0,0,0,0|2,0,0]=4 108 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,1,0,0,0,0|2,0,0]=4 109 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,1,0,0,0,0|2,0,0]=4 110 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,1,0,0,0,0|2,0,0]=4 111 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,1,0,0,0,0|2,0,0]=4 112 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,1,0,0,0,0|2,0,0]=4 113 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,1,0,0,0,0|2,0,0]=4 114 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,1,0,0,0,0|1,0,0]=3 115 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,1,0,0,0,0|1,0,0]=3 116 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,1,0,0,0,0|1,1,0]=4 117 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,1,0,0,0,0|1,1,0]=4 118 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [1,1,0,0,0,0|2,0,0]=4 119 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [1,1,0,0,0,0|2,0,0]=4 120 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [1,1,0,0,0,0|2,0,0]=4 121 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [1,1,0,0,0,0|2,0,0]=4 122 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [1,1,0,0,0,0|2,0,0]=4 123 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [1,1,0,0,0,0|2,0,0]=4 124 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [1,1,0,0,0,0|2,0,0]=4 125 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [1,1,0,0,0,0|2,0,0]=4 126 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [1,1,0,0,0,0|2,0,0]=4 127 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [1,1,0,0,0,0|2,0,0]=4 128 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,1,0,0,0,1|2,0,0]=4 129 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,1,0,0,0,1|2,0,0]=4 130 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,1,0,0,0,1|2,0,0]=4 131 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,1,0,0,0,1|2,0,0]=4 132 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,1,0,0,0,1|2,0,0]=4 133 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,1,0,0,0,1|2,0,0]=4 134 B8R0.16 C=C[C@@H](CO)NC(=O)C WXVL_AK00581SB0150 [0,1,0,0,0,1|2,0,0]=4 135 B8R0.16 C=C[C@@H](CO)NC(=O)C WXVL_AK00581SB0150 [0,1,0,0,0,1|2,0,0]=4 136 B8R0.16 CC(=O)NC(CO)CO WXVL_AK0741SB0150 [0,1,0,0,0,1|2,0,0]=4 137 B8R0.16 CC(=O)NC(CO)CO WXVL_AK0741SB0150 [0,1,0,0,0,1|2,0,0]=4 138 B8R0.16 CC[C@H](CO)NC(=O)C WXVL_AK0111SB0150 [0,1,0,0,0,1|2,0,0]=4 139 B8R0.16 CC[C@H](CO)NC(=O)C WXVL_AK0111SB0150 [0,1,0,0,0,1|2,0,0]=4 140 B8R0.19 C#CC(=O)N[C@@H](C)CO WXVL_AK0109SB0338 [0,1,0,0,0,1|2,0,0]=4 141 B8R0.19 C#CC(=O)N[C@@H](C)CO WXVL_AK0109SB0338 [0,1,0,0,0,1|2,0,0]=4 142 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,1,0,0,0,1|2,0,0]=4 143 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,1,0,0,0,1|2,0,0]=4 144 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,1,0,0,0,1|2,0,0]=4 145 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,1,0,0,0,1|2,0,0]=4 146 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,1,0,0,0,1|2,0,0]=4 147 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,1,0,0,0,1|2,0,0]=4 148 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,1,0,0,0,1|1,0,0]=3 149 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,1,0,0,0,1|1,0,0]=3 150 B8R0.34 CC(=O)NC(C)(C)CO WXVL_AK0025SB0150 [0,1,0,0,0,1|2,0,0]=4 151 B8R0.34 CC(=O)NC(C)(C)CO WXVL_AK0025SB0150 [0,1,0,0,0,1|2,0,0]=4 152 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,2,0,0,0,0|2,0,0]=4 153 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,2,0,0,0,0|2,0,0]=4 154 B8R0.36 CC(CO)(CO)C(=O)N WXVL_AK0084SB1605 [0,2,0,0,0,0|2,0,0]=4 155 B8R0.36 CC(CO)(CO)C(=O)N WXVL_AK0084SB1605 [0,2,0,0,0,0|2,0,0]=4 156 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [1,0,0,1,0,0|2,0,0]=4 157 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [1,0,0,1,0,0|2,0,0]=4 158 B8R1.23 NC(=O)C1CC(=O)N1 WXVL_AK0084SB3574 [0,1,0,1,0,0|1,0,1]=4 159 B8R1.23 NC(=O)C1CC(=O)N1 WXVL_AK0084SB3574 [0,1,0,1,0,0|1,0,1]=4 160 B8R1.23 NC(=O)[C@H]1C[C@@H](C1)O WXVL_AK0084SB3648 [0,1,0,1,0,0|2,0,0]=4 161 B8R1.23 NC(=O)[C@H]1C[C@@H](C1)O WXVL_AK0084SB3648 [0,1,0,1,0,0|2,0,0]=4 162 B8R1.23 NC(=O)[C@H]1C[C@H](C1)O WXVL_AK0084SB0837 [0,1,0,1,0,0|2,0,0]=4 163 B8R1.23 NC(=O)[C@H]1C[C@H](C1)O WXVL_AK0084SB0837 [0,1,0,1,0,0|2,0,0]=4 164 B8R1.78 CC1(COC1)C(=O)N WXVL_AK0084SB0214 [0,1,0,1,0,0|2,0,0]=4 165 B8R1.78 CC1(COC1)C(=O)N WXVL_AK0084SB0214 [0,1,0,1,0,0|2,0,0]=4 166 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [0,0,0,0,0,2|2,0,0]=4 167 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [0,0,0,0,0,2|2,0,0]=4 168 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [0,0,0,0,0,2|2,0,0]=4 169 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [0,0,0,0,0,2|2,0,0]=4