0 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,0,0,0,0,0|3,0,0]=4 7 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,0,0,0,0,0|3,0,0]=4 8 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,0,0,0,0,0|2,0,0]=3 9 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,0,0,0,0,0|2,0,0]=3 10 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,0,0,0,0,0|1,0,0]=2 11 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,0,0,0,0,0|1,0,0]=2 12 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [1,0,0,0,0,0|3,0,0]=4 14 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,0,0,0,0,0|2,0,1]=4 16 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,0,0,0,0,0|2,0,0]=3 17 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,0,0,0,0,0|2,0,0]=3 18 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,0,0,0,0,0|2,0,0]=3 20 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,0,0,0,0,0|2,0,0]=3 21 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [1,0,0,0,0,0|3,0,0]=4 23 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [1,0,0,0,0,0|3,0,0]=4 24 B8R0.2 CC(C)N(C)C(=O)CO WXVL_AN0073SB2706 [0,1,0,0,0,0|3,0,0]=4 25 B8R0.2 CC(C)N(C)C(=O)CO WXVL_AN0073SB2706 [0,1,0,0,0,0|3,0,0]=4 26 B8R0.2 CNC(=O)C(O)C(C)C WXVL_AK00442SB1147 [0,1,0,0,0,0|3,0,0]=4 27 B8R0.2 CNC(=O)C(O)C(C)C WXVL_AK00442SB1147 [0,1,0,0,0,0|3,0,0]=4 28 B8R0.27 CC(C)(C)[C@H](O)C(=O)N WXVL_AK0084SB3694 [0,1,0,0,0,0|3,0,0]=4 29 B8R0.27 CC(C)(C)[C@H](O)C(=O)N WXVL_AK0084SB3694 [0,1,0,0,0,0|3,0,0]=4 30 B8R1.77 CC1(CC1C(=O)N)C WXVL_AK0084SB0012 [0,0,0,1,0,0|3,0,0]=4 31 B8R1.77 CC1(CC1C(=O)N)C WXVL_AK0084SB0012 [0,0,0,1,0,0|3,0,0]=4 32 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,0,0,0,0,1|3,0,0]=4 33 B8R0.23 CC(C)CC(O)C(=O)N WXVL_AK0084SB4281 [0,0,0,0,0,1|3,0,0]=4 34 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 35 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 36 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|2,0,0]=4 37 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|2,0,0]=4 38 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 39 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 40 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 41 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 42 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [2,0,0,0,0,0|1,0,1]=4 43 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [2,0,0,0,0,0|1,0,1]=4 44 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [2,0,0,0,0,0|0,1,1]=4 45 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [2,0,0,0,0,0|0,1,1]=4 46 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [2,0,0,0,0,0|0,0,1]=3 47 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [2,0,0,0,0,0|0,0,1]=3 48 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [1,1,0,0,0,0|2,0,0]=4 49 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [1,1,0,0,0,0|2,0,0]=4 50 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [1,1,0,0,0,0|2,0,0]=4 51 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [1,1,0,0,0,0|2,0,0]=4 52 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [1,1,0,0,0,0|2,0,0]=4 53 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [1,1,0,0,0,0|2,0,0]=4 54 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [1,1,0,0,0,0|1,0,0]=3 55 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [1,1,0,0,0,0|1,0,0]=3 56 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [1,1,0,0,0,0|2,0,0]=4 57 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [1,1,0,0,0,0|2,0,0]=4 58 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [1,1,0,0,0,0|2,0,0]=4 59 B7R0.2 CNC(=O)CC(C)C WXVL_AK00442SB0063 [1,1,0,0,0,0|2,0,0]=4 60 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [1,1,0,0,0,0|1,0,0]=3 61 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [1,1,0,0,0,0|1,0,0]=3 62 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [1,1,0,0,0,0|2,0,0]=4 63 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [1,1,0,0,0,0|2,0,0]=4 64 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [1,1,0,0,0,0|1,0,0]=3 65 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [1,1,0,0,0,0|1,0,0]=3 66 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [1,1,0,0,0,0|2,0,0]=4 67 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [1,1,0,0,0,0|2,0,0]=4 68 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [1,1,0,0,0,0|2,0,0]=4 69 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [1,1,0,0,0,0|2,0,0]=4 70 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [1,1,0,0,0,0|2,0,0]=4 71 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [1,1,0,0,0,0|2,0,0]=4 72 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [1,1,0,0,0,0|2,0,0]=4 73 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [1,1,0,0,0,0|2,0,0]=4 74 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [1,1,0,0,0,0|2,0,0]=4 75 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [1,1,0,0,0,0|2,0,0]=4 76 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [1,1,0,0,0,0|2,0,0]=4 77 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [1,1,0,0,0,0|2,0,0]=4 78 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [1,1,0,0,0,0|2,0,0]=4 79 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [1,1,0,0,0,0|2,0,0]=4 80 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [1,1,0,0,0,0|2,0,0]=4 81 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [1,1,0,0,0,0|2,0,0]=4 82 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O WXVL_AK0126SB0150 [0,1,0,0,0,1|2,0,0]=4 83 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O WXVL_AK0126SB0150 [0,1,0,0,0,1|2,0,0]=4 84 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O WXVL_AK00602SB0150 [0,1,0,0,0,1|2,0,0]=4 85 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O WXVL_AK00602SB0150 [0,1,0,0,0,1|2,0,0]=4 86 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [1,0,0,1,0,0|2,0,0]=4 87 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [1,0,0,1,0,0|2,0,0]=4 88 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [1,0,0,1,0,0|2,0,0]=4 89 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [1,0,0,1,0,0|2,0,0]=4 90 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [1,0,0,1,0,0|2,0,0]=4 91 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [1,0,0,1,0,0|2,0,0]=4 92 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|2,0,0]=4 93 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|2,0,0]=4 94 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [1,0,0,1,0,0|2,0,0]=4 95 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [1,0,0,1,0,0|2,0,0]=4 96 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [1,0,0,1,0,0|2,0,0]=4 97 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [1,0,0,1,0,0|2,0,0]=4 98 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [1,0,0,1,0,0|2,0,0]=4 99 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [1,0,0,1,0,0|2,0,0]=4 100 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [1,0,0,1,0,0|2,0,0]=4 101 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [1,0,0,1,0,0|2,0,0]=4 102 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [1,0,0,1,0,0|2,0,0]=4 103 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [1,0,0,1,0,0|2,0,0]=4 104 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK0084SB00007 [0,0,0,1,0,1|1,0,0]=3 105 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK0084SB00007 [0,0,0,1,0,1|1,0,0]=3 106 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,0,0,0,0,1|2,0,0]=4 107 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,0,0,0,0,1|2,0,0]=4 108 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,0,0,0,0,1|1,0,0]=3 109 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,0,0,0,0,1|1,0,0]=3 110 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,0,0,0,0,1|1,0,0]=3 111 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,0,0,0,0,1|1,0,0]=3 112 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,0,0,0,0,1|2,0,0]=4 113 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,0,0,0,0,1|2,0,0]=4 114 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,0,0,0,0,1|2,0,0]=4 115 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,0,0,0,0,1|2,0,0]=4