0 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.1 C#CCC(=O)N WXVL_AK0084SB3070 [0,0,0,0,0,0|1,0,3]=4 2 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|1,0,0]=1 3 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|1,0,0]=1 4 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|1,0,2]=3 5 B5R0.1 C=CCC(=O)N WXVL_AK0084SB2732 [0,0,0,0,0,0|1,0,2]=3 6 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,0,0,0,0,0|1,0,2]=3 7 B5R0.1 CC#CC(=O)N WXVL_AK0084SB1240 [0,0,0,0,0,0|1,0,2]=3 8 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|1,0,2]=3 9 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|1,0,2]=3 10 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|2,0,1]=3 11 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|2,0,1]=3 12 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,0,0,0,0,0|2,0,1]=3 13 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [0,0,0,0,0,0|2,0,1]=3 14 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,0,0,0,0,0|2,0,1]=3 15 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,0,0,0,0,0|2,0,2]=4 17 B5R0.1 N#CCC(=O)N WXVL_AK0084SB0057 [0,0,0,0,0,0|2,0,2]=4 18 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 19 B4R0.1 C#CC(=O)N WXVL_AK0084SB0338 [1,0,0,0,0,0|1,0,2]=4 20 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 21 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|1,0,1]=3 22 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 23 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 24 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 25 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.1 C#CC(=O)NCC WXVL_AK00476SB0338 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,0]=2 29 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|1,0,0]=2 30 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,2]=4 31 B6R0.1 C=CCC(=O)NC WXVL_AK00442SB2732 [0,1,0,0,0,0|1,0,2]=4 32 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 CC#CC(=O)NC WXVL_AK00442SB1240 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,2]=4 35 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|1,0,2]=4 36 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|2,0,1]=4 37 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|2,0,1]=4 38 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,1]=3 39 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|1,0,1]=3 40 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|2,0,1]=4 41 B6R0.1 CNC(=O)COC WXVL_AK00442SB0090 [0,1,0,0,0,0|2,0,1]=4 42 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.1 CNC(=O)CSC WXVL_AK00442SB1267 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|1,0,0]=2 45 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|1,0,0]=2 46 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,2]=4 49 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,2]=4 50 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|1,0,2]=4 51 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|1,0,2]=4 52 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|2,0,1]=4 53 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|2,0,1]=4 54 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|1,0,0]=2 55 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,1,0,0,0,0|1,0,0]=2 56 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.3 C=C(F)C(=O)NC WXVL_AK00442SB1376 [0,1,0,0,0,0|3,0,0]=4 58 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,1]=3 59 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|1,0,1]=3 60 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|1,0,2]=4 61 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,1,0,0,0,0|1,0,2]=4 62 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|1,0,2]=4 63 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,1,0,0,0,0|1,0,2]=4 64 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 65 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,1,0,0,0,0|1,0,2]=4 66 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 67 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|2,0,0]=3 68 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 69 B6R0.3 CNC(=O)C(=O)N WXVL_AK00442SB0128 [0,1,0,0,0,0|2,0,0]=3 70 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|2,0,1]=4 71 B6R0.3 CNC(=O)[C@@H](C)O WXVL_AK00442SB1085 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|2,0,1]=4 73 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,1,0,0,0,0|2,0,1]=4 74 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,1,0,0,0,0|1,0,2]=4 75 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [0,1,0,0,0,0|1,0,2]=4 76 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|1,0,2]=4 77 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|1,0,2]=4 78 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 80 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,2]=4 81 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|1,0,2]=4 82 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,0,2]=4 83 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [0,1,0,0,0,0|1,0,2]=4 84 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,2]=4 85 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [0,1,0,0,0,0|1,0,2]=4 86 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|1,0,2]=4 87 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|1,0,2]=4 88 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|1,0,2]=4 89 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [0,1,0,0,0,0|1,0,2]=4 90 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|1,0,0]=2 91 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|1,0,0]=2 92 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|1,0,2]=4 93 B6R1.11 NC(=O)C1CC1 WXVL_AK0084SB0038 [0,0,0,1,0,0|1,0,2]=4 94 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 95 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,0]=3 96 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|2,0,0]=4 97 B5R0.3 C#CC(=O)NC WXVL_AK00442SB0338 [1,1,0,0,0,0|2,0,0]=4 98 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 99 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 100 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 101 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 102 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 103 B5R0.5 C=C(F)C(=O)N WXVL_AK0084SB1376 [1,1,0,0,0,0|1,0,0]=3 104 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 105 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,0]=3 106 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|2,0,0]=4 107 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|2,0,0]=4 108 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,1]=4 109 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|1,0,1]=4 110 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,1]=4 111 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,1,0,0,0,0|1,0,1]=4 112 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,1]=4 113 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|1,0,1]=4 114 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 115 B5R0.5 NC(=O)C(=O)N WXVL_AK0084SB0128 [1,1,0,0,0,0|2,0,0]=4 116 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 117 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 118 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,0]=3 119 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|1,0,0]=3 120 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|1,0,1]=4 121 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,2,0,0,0,0|1,0,1]=4 122 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|0,0,2]=4 123 B7R0.3 C=CCNC(=O)CO WXVL_AK00561SB2706 [0,2,0,0,0,0|0,0,2]=4 124 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|0,0,2]=4 125 B7R0.3 CCCNC(=O)CO WXVL_AK00504SB2706 [0,2,0,0,0,0|0,0,2]=4 126 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,0]=3 127 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|1,0,0]=3 128 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,1]=4 129 B7R0.3 O=C(CO)NCCF WXVL_AK00466SB2706 [0,2,0,0,0,0|1,0,1]=4 130 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 131 B7R0.5 C/C=C/C(=O)N(C)C WXVL_AN0032SB0340 [0,2,0,0,0,0|1,0,0]=3 132 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,0]=3 133 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,0]=3 134 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 135 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|1,0,1]=4 136 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 137 B7R0.5 CCNC(=O)C(=O)N WXVL_AK00476SB0128 [0,2,0,0,0,0|1,0,1]=4 138 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 139 B7R0.5 CCNC(=O)[C@@H](C)O WXVL_AK00476SB1085 [0,2,0,0,0,0|1,0,1]=4 140 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,1]=4 141 B7R0.5 CCOC(=O)C(=O)N WXVL_AK0084SB4144 [0,2,0,0,0,0|1,0,1]=4 142 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 143 B7R0.7 C/C=C/C(=O)NCC WXVL_AK00476SB0340 [0,2,0,0,0,0|1,0,0]=3 144 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,1]=4 145 B7R0.7 CCNC(=O)COC WXVL_AK00476SB0090 [0,2,0,0,0,0|1,0,1]=4 146 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,0]=3 147 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|1,0,0]=3 148 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 149 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|1,0,1]=4 150 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 151 B7R0.16 CC(=O)C(=O)N(C)C WXVL_AN0032SB0051 [0,2,0,0,0,0|2,0,0]=4 152 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,1]=4 153 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [0,2,0,0,0,0|1,0,1]=4 154 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 155 B7R0.16 CN(C)C(=O)C(=O)N WXVL_AN0032SB0128 [0,2,0,0,0,0|2,0,0]=4 156 B7R0.4 C/C=C/C=C/C(=O)N WXVL_AK0084SB0348 [0,2,0,0,0,0|1,0,0]=3 157 B7R0.4 C/C=C/C=C/C(=O)N WXVL_AK0084SB0348 [0,2,0,0,0,0|1,0,0]=3 158 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [0,2,0,0,0,0|1,0,0]=3 159 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [0,2,0,0,0,0|1,0,0]=3 160 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [0,2,0,0,0,0|1,0,0]=3 161 B7R0.4 CCO/C=C/C(=O)N WXVL_AK0084SB3226 [0,2,0,0,0,0|1,0,0]=3 162 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.6 C=C(C)CNC(=O)C WXVL_AK0761SB0150 [0,2,0,0,0,0|1,0,1]=4 164 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 165 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [0,2,0,0,0,0|1,0,1]=4 166 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 167 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0084SB0357 [0,2,0,0,0,0|1,0,1]=4 168 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 169 B7R0.6 CC(=O)NCC(=O)N WXVL_AK0147SB0150 [0,2,0,0,0,0|1,0,1]=4 170 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|1,0,1]=4 171 B7R0.6 CC(=O)OCC(=O)N WXVL_AK0084SB2824 [0,2,0,0,0,0|1,0,1]=4 172 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|1,0,1]=4 173 B7R0.6 CC(=O)SCC(=O)N WXVL_AK0084SB3992 [0,2,0,0,0,0|1,0,1]=4 174 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|1,0,0]=3 175 B7R0.6 CC(C)/C=C/C(=O)N WXVL_AK0084SB0036 [0,2,0,0,0,0|1,0,0]=3 176 B7R0.6 NC(=O)C#CC(=O)O WXVL_AK0084SB1110 [0,2,0,0,0,0|1,0,1]=4 177 B7R0.6 NC(=O)C#CC(=O)O WXVL_AK0084SB1110 [0,2,0,0,0,0|1,0,1]=4