0 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C/C=C/C(=O)N WXVL_AK0084SB0340 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|2,0,1]=4 7 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|2,0,1]=4 8 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,0]=3 11 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|2,0,1]=4 13 B6R0.1 C/C=C/C(=O)NC WXVL_AK00442SB0340 [0,1,0,0,0,0|2,0,1]=4 14 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|2,0,1]=4 16 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|3,0,0]=4 17 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,1,0,0,0,0|3,0,0]=4 18 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|3,0,0]=4 19 B6R0.1 CCNC(=O)CO WXVL_AK00476SB2706 [0,1,0,0,0,0|3,0,0]=4 20 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|0,0,2]=3 21 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [0,1,0,0,0,0|0,0,2]=3 22 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|3,0,0]=4 23 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [0,1,0,0,0,0|3,0,0]=4 24 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|3,0,0]=4 29 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,1,0,0,0,0|3,0,0]=4 30 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|1,0,0]=2 33 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|1,0,0]=2 34 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|3,0,0]=4 35 B6R0.3 CNC(=O)C(=O)C WXVL_AK00442SB0051 [0,1,0,0,0,0|3,0,0]=4 36 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 37 B6R0.3 CNC(=O)C(C)C WXVL_AK00442SB0052 [0,1,0,0,0,0|2,0,1]=4 38 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|3,0,0]=4 39 B6R0.4 C=CCNC(=O)C WXVL_AK00561SB0150 [0,1,0,0,0,0|3,0,0]=4 40 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,1,0,0,0,0|3,0,0]=4 41 B6R0.4 CC(=O)NCC#N WXVL_AK0683SB0150 [0,1,0,0,0,0|3,0,0]=4 42 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|2,0,1]=4 45 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|3,0,0]=4 49 B6R0.4 NC(=O)/C=C/CBr WXVL_AK0084SB0424 [0,1,0,0,0,0|3,0,0]=4 50 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,1]=4 51 B3R0.2 CC(=O)N WXVL_AK0084SB0150 [2,0,0,0,0,0|1,0,1]=4 52 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 53 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|1,0,1]=4 54 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 55 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|1,0,0]=3 56 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 57 B5R0.5 CC(=O)C(=O)N WXVL_AK0084SB0051 [1,1,0,0,0,0|1,0,1]=4 58 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 59 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|1,0,0]=3 60 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,2]=4 61 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,1,0,0,0,0|0,0,2]=4 62 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 63 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,1,0,0,0,0|2,0,0]=4 64 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,1]=4 65 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|1,0,1]=4 66 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|0,0,1]=3 67 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|0,0,1]=3 68 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.2 CCC(=O)NC(C)C WXVL_AK0030SB0064 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,2]=4 71 B7R0.2 CNC(=O)C=C(C)C WXVL_AK00442SB0342 [0,2,0,0,0,0|0,0,2]=4 72 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 73 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|2,0,0]=4 75 B7R0.3 CNC(=O)/C=C/CBr WXVL_AK00442SB0424 [0,2,0,0,0,0|2,0,0]=4 76 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 77 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|1,0,1]=4 78 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,2,0,0,0,0|2,0,0]=4 79 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,2,0,0,0,0|2,0,0]=4 80 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|2,0,0]=4 81 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|2,0,0]=4 82 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 83 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|1,0,1]=4 84 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,1]=4 85 B7R0.5 CC/C=C(\C)/C(=O)N WXVL_AK0084SB0037 [0,2,0,0,0,0|1,0,1]=4 86 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|2,0,0]=4 87 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|2,0,0]=4 88 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|2,0,0]=4 89 B7R0.5 CCNC(=O)C(=O)C WXVL_AK00476SB0051 [0,2,0,0,0,0|2,0,0]=4 90 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|1,0,1]=4 91 B7R0.5 CCNC(=O)C(C)C WXVL_AK00476SB0052 [0,2,0,0,0,0|1,0,1]=4 92 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,2,0,0,0,0|2,0,0]=4 93 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,2,0,0,0,0|2,0,0]=4 94 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,0]=3 95 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|1,0,0]=3 96 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|1,1,0]=4 97 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|1,1,0]=4 98 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|2,0,0]=4 99 B7R0.10 C/C=C(\C)/C(=O)NC WXVL_AK00442SB0343 [0,2,0,0,0,0|2,0,0]=4 100 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|2,0,0]=4 101 B7R0.10 CCC(=O)C(=O)NC WXVL_AK00442SB0344 [0,2,0,0,0,0|2,0,0]=4 102 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|2,0,0]=4 103 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|2,0,0]=4 104 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|1,1,0]=4 105 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|1,1,0]=4 106 B7R0.16 CN(C)C(=O)C(F)F WXVL_AN0032SB0079 [0,2,0,0,0,0|2,0,0]=4 107 B7R0.16 CN(C)C(=O)C(F)F WXVL_AN0032SB0079 [0,2,0,0,0,0|2,0,0]=4 108 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|1,0,0]=3 109 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|1,0,0]=3 110 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|1,0,1]=4 111 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|1,0,1]=4 112 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 113 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|1,0,1]=4 114 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4 115 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|1,0,1]=4