0 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,0,0,0,0,0|1,0,0]=1 3 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [0,0,0,0,0,0|1,0,0]=1 4 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,0,0,0,0,0|1,1,1]=3 9 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [0,0,0,0,0,0|1,1,1]=3 10 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,0,0,0,0,0|1,0,2]=3 11 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [0,0,0,0,0,0|1,0,2]=3 12 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,0,0,0,0,0|2,0,0]=2 13 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [0,0,0,0,0,0|2,0,0]=2 14 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.5 NC(=O)C(F)F WXVL_AK0084SB0079 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 17 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 18 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 19 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 20 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 21 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 22 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|1,0,1]=3 23 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|1,0,1]=3 24 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|3,0,0]=4 25 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,0]=3 27 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|2,0,0]=3 28 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,0]=2 31 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,0]=2 32 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|3,0,0]=4 33 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|2,0,1]=4 35 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|2,0,1]=4 36 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|2,0,1]=4 37 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|2,0,1]=4 38 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 39 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 40 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,0]=3 41 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|2,0,0]=3 42 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|1,0,0]=2 43 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|1,0,0]=2 44 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|1,0,0]=2 45 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|1,0,0]=2 46 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|1,1,1]=4 49 B6R0.3 CNC(=O)C(C)S WXVL_AK00442SB2708 [0,1,0,0,0,0|1,1,1]=4 50 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|2,0,1]=4 51 B6R0.3 CNC(=O)C(F)F WXVL_AK00442SB0079 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|1,0,1]=3 53 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|1,0,1]=3 54 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|1,0,2]=4 55 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|1,0,2]=4 56 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,1,0,0,0,0|2,0,1]=4 57 B6R0.7 CC(C)(Br)C(=O)N WXVL_AK0084SB0432 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,1,0,0,0,0|2,0,1]=4 59 B6R0.7 CC(C)(C)C(=O)N WXVL_AK0084SB0078 [0,1,0,0,0,0|2,0,1]=4 60 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,1,0,0,0,0|2,0,1]=4 61 B6R0.7 CC(C)(F)C(=O)N WXVL_AK0084SB0199 [0,1,0,0,0,0|2,0,1]=4 62 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,1,0,0,0,0|1,0,2]=4 63 B6R0.7 CC(C)(O)C(=O)N WXVL_AK0084SB0125 [0,1,0,0,0,0|1,0,2]=4 64 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,1,0,0,0,0|2,0,1]=4 65 B6R0.7 CC(F)(F)C(=O)N WXVL_AK0084SB0197 [0,1,0,0,0,0|2,0,1]=4 66 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|2,0,1]=4 67 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|2,0,1]=4 68 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,0,0,0,0,1|2,0,0]=3 69 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,0,0,0,0,1|2,0,0]=3 70 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,0,0,0,0,1|2,0,1]=4 71 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,0,0,0,0,1|2,0,1]=4 72 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,0,0,0,0,1|2,0,1]=4 73 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,0,0,0,0,1|2,0,1]=4 74 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,0,0,0,0,1|1,0,2]=4 75 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,0,0,0,0,1|1,0,2]=4 76 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,0,0,0,0,1|3,0,0]=4 77 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,0,0,0,0,1|3,0,0]=4 78 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 79 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 80 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 81 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,1,0,0,0,0|1,0,0]=3 82 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,1]=4 83 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [1,1,0,0,0,0|1,0,1]=4 84 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|1,0,1]=4 85 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,1,0,0,0,0|1,0,1]=4 86 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|1,0,1]=4 87 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,1,0,0,0,0|1,0,1]=4 88 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|1,0,1]=4 89 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,1,0,0,0,0|1,0,1]=4 90 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,1]=4 91 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,1,0,0,0,0|1,0,1]=4 92 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,0,1]=4 93 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,1,0,0,0,0|1,0,1]=4 94 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|1,0,1]=4 95 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|1,0,1]=4 96 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 97 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 98 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|0,0,1]=3 99 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|0,0,1]=3 100 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,1,0,0,0,1|1,0,1]=4 101 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,1,0,0,0,1|1,0,1]=4 102 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,1,0,0,0,1|1,0,1]=4 103 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,1,0,0,0,1|1,0,1]=4 104 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,1,0,0,0,1|2,0,0]=4 105 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,1,0,0,0,1|2,0,0]=4 106 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,1,0,0,0,1|1,0,1]=4 107 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,1,0,0,0,1|1,0,1]=4 108 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,1,0,0,0,1|1,0,0]=3 109 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,1,0,0,0,1|1,0,0]=3 110 B7R0.9 CS(=O)(=O)CC(=O)N WXVL_AK0084SB0162 [0,1,0,0,0,1|2,0,0]=4 111 B7R0.9 CS(=O)(=O)CC(=O)N WXVL_AK0084SB0162 [0,1,0,0,0,1|2,0,0]=4 112 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|2,0,0]=4 113 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,2,0,0,0,0|2,0,0]=4 114 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|2,0,0]=4 115 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|2,0,0]=4 116 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|2,0,0]=4 117 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|2,0,0]=4 118 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,0]=3 119 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,0]=3 120 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,0]=3 121 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,0]=3 122 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 123 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 124 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,0]=3 125 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,0]=3 126 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|2,0,0]=4 127 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|2,0,0]=4 128 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 129 B7R0.5 C[C@H](NC=O)C(=O)N WXVL_AK0084SB5176 [0,2,0,0,0,0|1,0,1]=4 130 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|2,0,0]=4 131 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|2,0,0]=4 132 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,0]=3 133 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,0]=3 134 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|1,0,1]=4 135 B7R0.10 CC[C@H](O)C(=O)NC WXVL_AK00442SB3573 [0,2,0,0,0,0|1,0,1]=4 136 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 137 B7R0.10 CNC(=O)[C@@H](C)OC WXVL_AK00442SB2926 [0,2,0,0,0,0|1,0,1]=4 138 B7R0.14 CNC(=O)C(C)(C)O WXVL_AK00442SB0125 [0,2,0,0,0,0|1,0,1]=4 139 B7R0.14 CNC(=O)C(C)(C)O WXVL_AK00442SB0125 [0,2,0,0,0,0|1,0,1]=4 140 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,0,0,0,0,2|2,0,0]=4 141 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,0,0,0,0,2|2,0,0]=4 142 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,0,0,0,0,2|1,0,0]=3 143 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,0,0,0,0,2|1,0,0]=3 144 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,0,0,0,0,2|1,0,0]=3 145 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,0,0,0,0,2|1,0,0]=3 146 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,0,0,0,0,2|1,0,0]=3 147 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,0,0,0,0,2|1,0,0]=3 148 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,0,0,0,0,2|1,0,1]=4 149 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,0,0,0,0,2|1,0,1]=4 150 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,0,0,0,0,2|1,0,1]=4 151 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,0,0,0,0,2|1,0,1]=4 152 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,0,0,0,0,2|1,0,0]=3 153 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,0,0,0,0,2|1,0,0]=3 154 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,0,0,0,0,2|1,0,0]=3 155 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,0,0,0,0,2|1,0,0]=3 156 B7R0.6 NC(=O)C#CC(=O)O WXVL_AK0084SB1110 [0,0,0,0,0,2|1,0,0]=3 157 B7R0.6 NC(=O)C#CC(=O)O WXVL_AK0084SB1110 [0,0,0,0,0,2|1,0,0]=3 158 B7R0.6 NC(=O)CCC(=O)N WXVL_AK0084SB0358 [0,0,0,0,0,2|2,0,0]=4 159 B7R0.6 NC(=O)CCC(=O)N WXVL_AK0084SB0358 [0,0,0,0,0,2|2,0,0]=4 160 B7R0.6 NC(=O)CNC(=O)N WXVL_AK0084SB0746 [0,0,0,0,0,2|2,0,0]=4 161 B7R0.6 NC(=O)CNC(=O)N WXVL_AK0084SB0746 [0,0,0,0,0,2|2,0,0]=4