0 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,0,0,0,0,0|2,0,2]=4 9 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,0,0,0,0,0|1,0,1]=3 11 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [1,0,0,0,0,0|1,0,1]=3 12 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,0,0,0,0,0|1,0,2]=4 13 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [1,0,0,0,0,0|1,0,2]=4 14 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,0,0,0,0,0|1,0,1]=3 15 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [1,0,0,0,0,0|1,0,1]=3 16 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,0,0,0,0,0|1,0,0]=2 17 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [1,0,0,0,0,0|1,0,0]=2 18 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,0,0,0,0,0|2,0,1]=4 19 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [1,0,0,0,0,0|2,0,1]=4 20 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,0,0,0,0,0|2,0,1]=4 21 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,0,0,0,0,0|3,0,0]=4 23 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,0,0,0,0,0|3,0,0]=4 24 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,1,0,0,0,0|3,0,0]=4 25 B7R0.5 C=C(F)C(=O)NCC WXVL_AK00476SB1376 [0,1,0,0,0,0|3,0,0]=4 26 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|2,0,1]=4 27 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|2,0,1]=4 28 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,1,0,0,0,0|0,0,0]=1 29 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,1,0,0,0,0|0,0,0]=1 30 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|0,0,2]=3 31 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|0,0,2]=3 32 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,1,0,0,0,0|1,0,2]=4 33 B7R0.5 CCC[C@H](O)C(=O)N WXVL_AK0084SB3627 [0,1,0,0,0,0|1,0,2]=4 34 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,1,0,0,0,0|2,0,0]=3 35 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,1,0,0,0,0|2,0,0]=3 36 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,1,0,0,0,0|2,0,0]=3 37 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,1,0,0,0,0|2,0,0]=3 38 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,1,0,0,0,0|2,0,0]=3 39 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,1,0,0,0,0|2,0,0]=3 40 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,1,0,0,0,0|3,0,0]=4 41 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,1,0,0,0,0|3,0,0]=4 42 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,1,0,0,0,0|3,0,0]=4 43 B7R0.7 C=CCC(=O)NCC WXVL_AK00476SB2732 [0,1,0,0,0,0|3,0,0]=4 44 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,1,0,0,0,0|2,0,0]=3 45 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,1,0,0,0,0|2,0,0]=3 46 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,1,0,0,0,0|3,0,0]=4 47 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,1,0,0,0,0|3,0,0]=4 48 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [2,0,0,0,0,0|1,0,0]=3 49 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [2,0,0,0,0,0|1,0,0]=3 50 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [2,0,0,0,0,0|1,0,0]=3 51 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [2,0,0,0,0,0|1,0,0]=3 52 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [2,0,0,0,0,0|2,0,0]=4 53 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [1,1,0,0,0,0|1,0,1]=4 55 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [1,1,0,0,0,0|1,0,1]=4 56 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,1,0,0,0,0|1,0,0]=3 57 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,1,0,0,0,0|1,0,0]=3 58 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|1,0,1]=4 59 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|1,0,1]=4 60 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,1,0,0,0,0|1,0,1]=4 61 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,1,0,0,0,0|1,0,1]=4 62 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [1,1,0,0,0,0|1,0,1]=4 63 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [1,1,0,0,0,0|1,0,1]=4 64 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [1,1,0,0,0,0|2,0,0]=4 65 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [1,1,0,0,0,0|2,0,0]=4 66 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,1,0,0,0,0|1,0,0]=3 67 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [1,1,0,0,0,0|1,0,0]=3 68 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [1,1,0,0,0,0|1,0,1]=4 69 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [1,1,0,0,0,0|1,0,1]=4 70 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,1,0,0,0,0|1,0,1]=4 71 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [1,1,0,0,0,0|1,0,1]=4 72 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,1,0,0,0,0|1,0,1]=4 73 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [1,1,0,0,0,0|1,0,1]=4 74 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,1,0,0,0,0|1,0,1]=4 75 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [1,1,0,0,0,0|1,0,1]=4 76 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [1,1,0,0,0,0|1,0,0]=3 77 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [1,1,0,0,0,0|1,0,0]=3 78 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [1,1,0,0,0,0|2,0,0]=4 79 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [1,1,0,0,0,0|2,0,0]=4 80 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [1,1,0,0,0,0|1,0,1]=4 81 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [1,1,0,0,0,0|1,0,1]=4 82 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [1,1,0,0,0,0|1,0,1]=4 83 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [1,1,0,0,0,0|1,0,1]=4 84 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,1,0,0,0,0|1,0,0]=3 85 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,1,0,0,0,0|1,0,0]=3 86 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,1,0,0,0,0|0,0,1]=3 87 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,1,0,0,0,0|0,0,1]=3 88 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,1,0,0,0,0|1,0,1]=4 89 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,1,0,0,0,0|1,0,1]=4 90 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,1,0,0,0,0|1,0,1]=4 91 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,1,0,0,0,0|1,0,1]=4 92 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,1,0,0,0,0|1,0,1]=4 93 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,1,0,0,0,0|1,0,1]=4 94 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,1,0,0,0,0|1,0,1]=4 95 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,1,0,0,0,0|1,0,1]=4 96 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [1,1,0,0,0,0|1,0,1]=4 97 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [1,1,0,0,0,0|1,0,1]=4 98 B8R0.2 C/C=C(\C)/C(=O)N(C)C WXVL_AN0032SB0343 [0,2,0,0,0,0|2,0,0]=4 99 B8R0.2 C/C=C(\C)/C(=O)N(C)C WXVL_AN0032SB0343 [0,2,0,0,0,0|2,0,0]=4 100 B8R0.2 COC(=O)C(C)C(=O)N WXVL_AK0084SB5708 [0,2,0,0,0,0|1,0,1]=4 101 B8R0.2 COC(=O)C(C)C(=O)N WXVL_AK0084SB5708 [0,2,0,0,0,0|1,0,1]=4 102 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,2,0,0,0,0|0,0,2]=4 103 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,2,0,0,0,0|0,0,2]=4 104 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,2,0,0,0,0|2,0,0]=4 105 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,2,0,0,0,0|2,0,0]=4 106 B8R0.19 C=CC(C)NC(=O)CC WXVL_AK00769SB0064 [0,2,0,0,0,0|1,0,1]=4 107 B8R0.19 C=CC(C)NC(=O)CC WXVL_AK00769SB0064 [0,2,0,0,0,0|1,0,1]=4 108 B8R0.23 C/C(=C/C(=O)N)/C(=O)O WXVL_AK0084SB2187 [0,2,0,0,0,0|1,0,1]=4 109 B8R0.23 C/C(=C/C(=O)N)/C(=O)O WXVL_AK0084SB2187 [0,2,0,0,0,0|1,0,1]=4 110 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,2,0,0,0,0|2,0,0]=4 111 B8R0.23 CC(=O)C(=O)NC(C)C WXVL_AK0030SB0051 [0,2,0,0,0,0|2,0,0]=4 112 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,2,0,0,0,0|2,0,0]=4 113 B8R0.23 CC(C)NC(=O)C(=O)N WXVL_AK0030SB0128 [0,2,0,0,0,0|2,0,0]=4 114 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [0,2,0,0,0,0|1,0,0]=3 115 B8R0.3 C/C=C(\C)/C(=O)NCC WXVL_AK00476SB0343 [0,2,0,0,0,0|1,0,0]=3 116 B8R0.3 CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,2,0,0,0,0|0,0,0]=2 117 B8R0.3 CC/C=C(\C)/C(=O)NC WXVL_AK00442SB0037 [0,2,0,0,0,0|0,0,0]=2 118 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,2,0,0,0,0|0,0,2]=4 119 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,2,0,0,0,0|0,0,2]=4 120 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,2,0,0,0,0|2,0,0]=4 121 B8R0.3 CCNC(=O)C(=O)CC WXVL_AK00476SB0344 [0,2,0,0,0,0|2,0,0]=4 122 B8R0.3 CCOC(=O)C(=O)NC WXVL_AK00442SB4144 [0,2,0,0,0,0|2,0,0]=4 123 B8R0.3 CCOC(=O)C(=O)NC WXVL_AK00442SB4144 [0,2,0,0,0,0|2,0,0]=4 124 B8R0.3 CNC(=O)[C@H](C)NC=O WXVL_AK00442SB5176 [0,2,0,0,0,0|1,0,1]=4 125 B8R0.3 CNC(=O)[C@H](C)NC=O WXVL_AK00442SB5176 [0,2,0,0,0,0|1,0,1]=4 126 B8R0.8 CC(=O)C(=O)NCCF WXVL_AK00466SB0051 [0,2,0,0,0,0|2,0,0]=4 127 B8R0.8 CC(=O)C(=O)NCCF WXVL_AK00466SB0051 [0,2,0,0,0,0|2,0,0]=4 128 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [0,2,0,0,0,0|1,0,1]=4 129 B8R0.8 CCCNC(=O)C(=O)C WXVL_AK00504SB0051 [0,2,0,0,0,0|1,0,1]=4 130 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [0,2,0,0,0,0|1,0,1]=4 131 B8R0.8 CCCNC(=O)C(=O)N WXVL_AK00504SB0128 [0,2,0,0,0,0|1,0,1]=4 132 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,2,0,0,0,0|1,0,1]=4 133 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,2,0,0,0,0|1,0,1]=4 134 B8R0.8 NC(=O)C(=O)NCCF WXVL_AK00466SB0128 [0,2,0,0,0,0|2,0,0]=4 135 B8R0.8 NC(=O)C(=O)NCCF WXVL_AK00466SB0128 [0,2,0,0,0,0|2,0,0]=4 136 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [0,2,0,0,0,0|0,0,2]=4 137 B8R0.12 CCCC(C)(C)C(=O)N WXVL_AK0084SB0372 [0,2,0,0,0,0|0,0,2]=4 138 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [1,0,0,1,0,0|1,0,1]=4 139 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [1,0,0,1,0,0|1,0,1]=4 140 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [0,1,0,1,0,0|1,0,1]=4 141 B8R1.7 CC(=O)N1CCCC1 WXVL_AN0008SB0150 [0,1,0,1,0,0|1,0,1]=4 142 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [0,1,0,1,0,0|0,0,2]=4 143 B8R1.7 NC(=O)C1CCCC1 WXVL_AK0084SB0043 [0,1,0,1,0,0|0,0,2]=4 144 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [0,1,0,1,0,0|1,0,1]=4 145 B8R1.7 NC(=O)C1CCCO1 WXVL_AK0084SB1033 [0,1,0,1,0,0|1,0,1]=4 146 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [0,1,0,1,0,0|1,0,1]=4 147 B8R1.7 NC(=O)C1CCCS1 WXVL_AK0084SB0022 [0,1,0,1,0,0|1,0,1]=4 148 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [0,1,0,1,0,0|1,0,1]=4 149 B8R1.7 NC(=O)[C@H]1CCCO1 WXVL_AK0084SB00043 [0,1,0,1,0,0|1,0,1]=4 150 B8R1.23 CC(=O)N1CC(C1)C WXVL_AN0291SB0150 [0,1,0,1,0,0|1,0,1]=4 151 B8R1.23 CC(=O)N1CC(C1)C WXVL_AN0291SB0150 [0,1,0,1,0,0|1,0,1]=4 152 B8R1.54 CC(=O)N(C)C1CC1 WXVL_AN0276SB0150 [0,1,0,1,0,0|1,0,1]=4 153 B8R1.54 CC(=O)N(C)C1CC1 WXVL_AN0276SB0150 [0,1,0,1,0,0|1,0,1]=4 154 B8R1.54 NC(=O)C(=O)C1CC1 WXVL_AK0084SB3659 [0,1,0,1,0,0|1,0,1]=4 155 B8R1.54 NC(=O)C(=O)C1CC1 WXVL_AK0084SB3659 [0,1,0,1,0,0|1,0,1]=4 156 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [0,1,0,1,0,0|0,0,2]=4 157 B8R1.78 CC1(CCC1)C(=O)N WXVL_AK0084SB0805 [0,1,0,1,0,0|0,0,2]=4