0 B15R0.366 C#CCC(=O)NCCCCCCCCCC WXVL_AK1845SB3070 [0,0,0,0,0,0|2,0,2]=4 1 B15R0.366 C#CCC(=O)NCCCCCCCCCC WXVL_AK1845SB3070 [0,0,0,0,0,0|2,0,2]=4 2 B15R0.366 C/C=C/C(=O)NCCCCCCCCCC WXVL_AK1845SB0340 [0,0,0,0,0,0|2,0,1]=3 3 B15R0.366 C/C=C/C(=O)NCCCCCCCCCC WXVL_AK1845SB0340 [0,0,0,0,0,0|2,0,1]=3 4 B15R0.366 C=CCC(=O)NCCCCCCCCCC WXVL_AK1845SB2732 [0,0,0,0,0,0|2,0,2]=4 5 B15R0.366 C=CCC(=O)NCCCCCCCCCC WXVL_AK1845SB2732 [0,0,0,0,0,0|2,0,2]=4 6 B15R0.366 CC#CC(=O)NCCCCCCCCCC WXVL_AK1845SB1240 [0,0,0,0,0,0|2,0,1]=3 7 B15R0.366 CC#CC(=O)NCCCCCCCCCC WXVL_AK1845SB1240 [0,0,0,0,0,0|2,0,1]=3 8 B15R0.366 CCCCCCCCCCCC(=O)NCC WXVL_AK00476SB2796 [0,0,0,0,0,0|0,0,0]=0 9 B15R0.366 CCCCCCCCCCCC(=O)NCC WXVL_AK00476SB2796 [0,0,0,0,0,0|0,0,0]=0 10 B15R0.366 CCCCCCCCCCNC(=O)CC#N WXVL_AK1845SB0057 [0,0,0,0,0,0|3,0,1]=4 11 B15R0.366 CCCCCCCCCCNC(=O)CC#N WXVL_AK1845SB0057 [0,0,0,0,0,0|3,0,1]=4 12 B15R0.366 CCCCCCCCCCNC(=O)CCC WXVL_AK1845SB0073 [0,0,0,0,0,0|2,0,0]=2 13 B15R0.366 CCCCCCCCCCNC(=O)CCC WXVL_AK1845SB0073 [0,0,0,0,0,0|2,0,0]=2 14 B15R0.366 CCCCCCCCCCNC(=O)COC WXVL_AK1845SB0090 [0,0,0,0,0,0|3,0,0]=3 15 B15R0.366 CCCCCCCCCCNC(=O)COC WXVL_AK1845SB0090 [0,0,0,0,0,0|3,0,0]=3 16 B15R0.366 CCCCCCCCCCNC(=O)CSC WXVL_AK1845SB1267 [0,0,0,0,0,0|3,0,0]=3 17 B15R0.366 CCCCCCCCCCNC(=O)CSC WXVL_AK1845SB1267 [0,0,0,0,0,0|3,0,0]=3 18 B14R0.337 C#CC(=O)NCCCCCCCCCC WXVL_AK1845SB0338 [1,0,0,0,0,0|1,0,2]=4 19 B14R0.337 C#CC(=O)NCCCCCCCCCC WXVL_AK1845SB0338 [1,0,0,0,0,0|1,0,2]=4 20 B14R0.337 CCCCCCCCCCCC(=O)NC WXVL_AK00442SB2796 [1,0,0,0,0,0|0,0,0]=1 21 B14R0.337 CCCCCCCCCCCC(=O)NC WXVL_AK00442SB2796 [1,0,0,0,0,0|0,0,0]=1 22 B14R0.337 CCCCCCCCCCNC(=O)CC WXVL_AK1845SB0064 [1,0,0,0,0,0|1,0,0]=2 23 B14R0.337 CCCCCCCCCCNC(=O)CC WXVL_AK1845SB0064 [1,0,0,0,0,0|1,0,0]=2 24 B14R0.337 CCCCCCCCCCNC(=O)CO WXVL_AK1845SB2706 [1,0,0,0,0,0|2,0,0]=3 25 B14R0.337 CCCCCCCCCCNC(=O)CO WXVL_AK1845SB2706 [1,0,0,0,0,0|2,0,0]=3 26 B14R0.393 C/C=C/C(=O)NCCCCCCCCC WXVL_AK1826SB0340 [1,0,0,0,0,0|2,0,1]=4 27 B14R0.393 C/C=C/C(=O)NCCCCCCCCC WXVL_AK1826SB0340 [1,0,0,0,0,0|2,0,1]=4 28 B14R0.393 C=CCCCCCCCCC(=O)NCC WXVL_AK00476SB0481 [1,0,0,0,0,0|0,0,2]=3 29 B14R0.393 C=CCCCCCCCCC(=O)NCC WXVL_AK00476SB0481 [1,0,0,0,0,0|0,0,2]=3 30 B14R0.393 CC#CC(=O)NCCCCCCCCC WXVL_AK1826SB1240 [1,0,0,0,0,0|2,0,1]=4 31 B14R0.393 CC#CC(=O)NCCCCCCCCC WXVL_AK1826SB1240 [1,0,0,0,0,0|2,0,1]=4 32 B14R0.393 CCCC(=O)NCCCCCCCCO WXVL_AK4142SB0073 [1,0,0,0,0,0|3,0,0]=4 33 B14R0.393 CCCC(=O)NCCCCCCCCO WXVL_AK4142SB0073 [1,0,0,0,0,0|3,0,0]=4 34 B14R0.393 CCCCCCCCCCC(=O)NCC WXVL_AK00476SB0490 [1,0,0,0,0,0|0,0,0]=1 35 B14R0.393 CCCCCCCCCCC(=O)NCC WXVL_AK00476SB0490 [1,0,0,0,0,0|0,0,0]=1 36 B14R0.393 CCCCCCCCCNC(=O)CCC WXVL_AK1826SB0073 [1,0,0,0,0,0|2,0,0]=3 37 B14R0.393 CCCCCCCCCNC(=O)CCC WXVL_AK1826SB0073 [1,0,0,0,0,0|2,0,0]=3 38 B14R0.393 CCCCCCCCCNC(=O)COC WXVL_AK1826SB0090 [1,0,0,0,0,0|3,0,0]=4 39 B14R0.393 CCCCCCCCCNC(=O)COC WXVL_AK1826SB0090 [1,0,0,0,0,0|3,0,0]=4 40 B14R0.393 CCCCCCCCCNC(=O)CSC WXVL_AK1826SB1267 [1,0,0,0,0,0|3,0,0]=4 41 B14R0.393 CCCCCCCCCNC(=O)CSC WXVL_AK1826SB1267 [1,0,0,0,0,0|3,0,0]=4 42 B16R0.61 C/C=C/C(=O)NCCCCCCCCCCO WXVL_AK3148SB0340 [0,1,0,0,0,0|2,0,1]=4 43 B16R0.61 C/C=C/C(=O)NCCCCCCCCCCO WXVL_AK3148SB0340 [0,1,0,0,0,0|2,0,1]=4 44 B16R0.61 CC#CC(=O)NCCCCCCCCCCO WXVL_AK3148SB1240 [0,1,0,0,0,0|2,0,1]=4 45 B16R0.61 CC#CC(=O)NCCCCCCCCCCO WXVL_AK3148SB1240 [0,1,0,0,0,0|2,0,1]=4 46 B16R0.61 CCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0073 [0,1,0,0,0,0|2,0,0]=3 47 B16R0.61 CCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0073 [0,1,0,0,0,0|2,0,0]=3 48 B16R0.61 CCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0547 [0,1,0,0,0,0|0,0,0]=1 49 B16R0.61 CCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0547 [0,1,0,0,0,0|0,0,0]=1 50 B16R0.61 CCNC(=O)CCCCCCCCCCCBr WXVL_AK00476SB0603 [0,1,0,0,0,0|0,0,0]=1 51 B16R0.61 CCNC(=O)CCCCCCCCCCCBr WXVL_AK00476SB0603 [0,1,0,0,0,0|0,0,0]=1 52 B16R0.61 COCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0090 [0,1,0,0,0,0|3,0,0]=4 53 B16R0.61 COCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0090 [0,1,0,0,0,0|3,0,0]=4 54 B16R0.61 CSCC(=O)NCCCCCCCCCCO WXVL_AK3148SB1267 [0,1,0,0,0,0|3,0,0]=4 55 B16R0.61 CSCC(=O)NCCCCCCCCCCO WXVL_AK3148SB1267 [0,1,0,0,0,0|3,0,0]=4 56 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC WXVL_AK1845SB0343 [0,1,0,0,0,0|2,0,1]=4 57 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC WXVL_AK1845SB0343 [0,1,0,0,0,0|2,0,1]=4 58 B16R0.70 CCCCCCCCCCNC(=O)C(=O)CC WXVL_AK1845SB0344 [0,1,0,0,0,0|2,0,0]=3 59 B16R0.70 CCCCCCCCCCNC(=O)C(=O)CC WXVL_AK1845SB0344 [0,1,0,0,0,0|2,0,0]=3 60 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC WXVL_AK1845SB0054 [0,1,0,0,0,0|2,0,0]=3 61 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC WXVL_AK1845SB0054 [0,1,0,0,0,0|2,0,0]=3 62 B16R0.70 CCCCCCCCCCNC(=O)[C@@H](C)OC WXVL_AK1845SB2926 [0,1,0,0,0,0|3,0,0]=4 63 B16R0.70 CCCCCCCCCCNC(=O)[C@@H](C)OC WXVL_AK1845SB2926 [0,1,0,0,0,0|3,0,0]=4 64 B16R0.70 CCCCCCCCCCNC(=O)[C@@H](O)CC WXVL_AK1845SB3573 [0,1,0,0,0,0|2,0,0]=3 65 B16R0.70 CCCCCCCCCCNC(=O)[C@@H](O)CC WXVL_AK1845SB3573 [0,1,0,0,0,0|2,0,0]=3 66 B16R0.70 CCCCCCCCCCNC(=O)[C@H](C)CC WXVL_AK1845SB00054 [0,1,0,0,0,0|2,0,0]=3 67 B16R0.70 CCCCCCCCCCNC(=O)[C@H](C)CC WXVL_AK1845SB00054 [0,1,0,0,0,0|2,0,0]=3 68 B16R0.154 CCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1818SB3094 [0,1,0,0,0,0|2,0,1]=4 69 B16R0.154 CCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1818SB3094 [0,1,0,0,0,0|2,0,1]=4 70 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2796 [0,1,0,0,0,0|0,0,0]=1 71 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2796 [0,1,0,0,0,0|0,0,0]=1 72 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C WXVL_AK1845SB0342 [0,1,0,0,0,0|2,0,1]=4 73 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C WXVL_AK1845SB0342 [0,1,0,0,0,0|2,0,1]=4 74 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C WXVL_AK1845SB0063 [0,1,0,0,0,0|2,0,0]=3 75 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C WXVL_AK1845SB0063 [0,1,0,0,0,0|2,0,0]=3 76 B16R0.302 CCCCCCCCCCNC(=O)CC(C)O WXVL_AK1845SB3643 [0,1,0,0,0,0|2,0,0]=3 77 B16R0.302 CCCCCCCCCCNC(=O)CC(C)O WXVL_AK1845SB3643 [0,1,0,0,0,0|2,0,0]=3 78 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C WXVL_AK1845SB0085 [0,1,0,0,0,0|3,0,0]=4 79 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C WXVL_AK1845SB0085 [0,1,0,0,0,0|3,0,0]=4 80 B16R0.661 C#CCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2189 [0,1,0,0,0,0|2,0,1]=4 81 B16R0.661 C#CCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2189 [0,1,0,0,0,0|2,0,1]=4 82 B16R0.661 C=CCCC(=O)NCCCCCCCCCC WXVL_AK1845SB1035 [0,1,0,0,0,0|2,0,1]=4 83 B16R0.661 C=CCCC(=O)NCCCCCCCCCC WXVL_AK1845SB1035 [0,1,0,0,0,0|2,0,1]=4 84 B16R0.661 C=CCNC(=O)CCCCCCCCCCC WXVL_AK00561SB2796 [0,1,0,0,0,0|0,0,1]=2 85 B16R0.661 C=CCNC(=O)CCCCCCCCCCC WXVL_AK00561SB2796 [0,1,0,0,0,0|0,0,1]=2 86 B16R0.661 CCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB2796 [0,1,0,0,0,0|0,0,1]=2 87 B16R0.661 CCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB2796 [0,1,0,0,0,0|0,0,1]=2 88 B16R0.661 CCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB2796 [0,1,0,0,0,0|0,0,0]=1 89 B16R0.661 CCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB2796 [0,1,0,0,0,0|0,0,0]=1 90 B16R0.661 CCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB2796 [0,1,0,0,0,0|0,0,0]=1 91 B16R0.661 CCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB2796 [0,1,0,0,0,0|0,0,0]=1 92 B16R0.661 CCCCCCCCCCNC(=O)/C=C/CBr WXVL_AK1845SB0424 [0,1,0,0,0,0|2,0,1]=4 93 B16R0.661 CCCCCCCCCCNC(=O)/C=C/CBr WXVL_AK1845SB0424 [0,1,0,0,0,0|2,0,1]=4 94 B16R0.661 CCCCCCCCCCNC(=O)CCOC WXVL_AK1845SB0156 [0,1,0,0,0,0|2,0,0]=3 95 B16R0.661 CCCCCCCCCCNC(=O)CCOC WXVL_AK1845SB0156 [0,1,0,0,0,0|2,0,0]=3 96 B16R0.661 CCCCCCCCCCNC(=O)CCSC WXVL_AK1845SB0361 [0,1,0,0,0,0|2,0,0]=3 97 B16R0.661 CCCCCCCCCCNC(=O)CCSC WXVL_AK1845SB0361 [0,1,0,0,0,0|2,0,0]=3 98 B16R0.661 CCCCCCCCCCNC(=O)COCC WXVL_AK1845SB0091 [0,1,0,0,0,0|2,0,0]=3 99 B16R0.661 CCCCCCCCCCNC(=O)COCC WXVL_AK1845SB0091 [0,1,0,0,0,0|2,0,0]=3 100 B16R0.661 CCCCCCCCCCNC(=O)CSCC WXVL_AK1845SB0002 [0,1,0,0,0,0|2,0,0]=3 101 B16R0.661 CCCCCCCCCCNC(=O)CSCC WXVL_AK1845SB0002 [0,1,0,0,0,0|2,0,0]=3 102 B16R0.661 CCCCCCCCCCNC(=O)NCCCl WXVL_AK1845YV0092 [0,1,0,0,0,0|1,0,0]=2 103 B16R0.661 CCCCCCCCCCNC(=O)NCCCl WXVL_AK1845YV0092 [0,1,0,0,0,0|1,0,0]=2 104 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC WXVL_AK1826SB4144 [0,1,0,0,0,0|2,0,1]=4 105 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC WXVL_AK1826SB4144 [0,1,0,0,0,0|2,0,1]=4 106 B16R0.5205 CCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0393 [0,1,0,0,0,0|2,0,1]=4 107 B16R0.5205 CCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0393 [0,1,0,0,0,0|2,0,1]=4 108 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC WXVL_AK1845HU0030 [0,1,0,0,0,0|3,0,0]=4 109 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC WXVL_AK1845HU0030 [0,1,0,0,0,0|3,0,0]=4 110 B16R1.889 CCCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0073 [0,0,0,1,0,0|3,0,0]=4 111 B16R1.889 CCCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0073 [0,0,0,1,0,0|3,0,0]=4 112 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0073 [0,0,0,1,0,0|3,0,0]=4 113 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0073 [0,0,0,1,0,0|3,0,0]=4 114 B16R1.2034 C/C=C/C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0340 [0,0,0,1,0,0|2,0,1]=4 115 B16R1.2034 C/C=C/C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0340 [0,0,0,1,0,0|2,0,1]=4 116 B16R1.2034 CC#CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB1240 [0,0,0,1,0,0|2,0,1]=4 117 B16R1.2034 CC#CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB1240 [0,0,0,1,0,0|2,0,1]=4 118 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0073 [0,0,0,1,0,0|2,0,0]=3 119 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0073 [0,0,0,1,0,0|2,0,0]=3 120 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0090 [0,0,0,1,0,0|3,0,0]=4 121 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0090 [0,0,0,1,0,0|3,0,0]=4 122 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB1267 [0,0,0,1,0,0|3,0,0]=4 123 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB1267 [0,0,0,1,0,0|3,0,0]=4 124 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 WXVL_AK1845SB0038 [0,0,0,1,0,0|2,0,0]=3 125 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 WXVL_AK1845SB0038 [0,0,0,1,0,0|2,0,0]=3 126 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [2,0,0,0,0,0|0,0,0]=2 127 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [2,0,0,0,0,0|0,0,0]=2 128 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [2,0,0,0,0,0|1,0,0]=3 129 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [2,0,0,0,0,0|1,0,0]=3 130 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [2,0,0,0,0,0|0,0,2]=4 131 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [2,0,0,0,0,0|0,0,2]=4 132 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [2,0,0,0,0,0|2,0,0]=4 133 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [2,0,0,0,0,0|2,0,0]=4 134 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [2,0,0,0,0,0|0,0,0]=2 135 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [2,0,0,0,0,0|0,0,0]=2 136 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [2,0,0,0,0,0|1,0,0]=3 137 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [2,0,0,0,0,0|1,0,0]=3 138 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [2,0,0,0,0,0|2,0,0]=4 139 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [2,0,0,0,0,0|2,0,0]=4 140 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [2,0,0,0,0,0|0,0,0]=2 141 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [2,0,0,0,0,0|0,0,0]=2 142 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [2,0,0,0,0,0|2,0,0]=4 143 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [2,0,0,0,0,0|2,0,0]=4 144 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [2,0,0,0,0,0|1,0,0]=3 145 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [2,0,0,0,0,0|1,0,0]=3 146 B15R0.81 CCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0064 [1,1,0,0,0,0|1,0,0]=3 147 B15R0.81 CCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0064 [1,1,0,0,0,0|1,0,0]=3 148 B15R0.81 CCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0547 [1,1,0,0,0,0|0,0,0]=2 149 B15R0.81 CCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0547 [1,1,0,0,0,0|0,0,0]=2 150 B15R0.81 CNC(=O)CCCCCCCCCCCBr WXVL_AK00442SB0603 [1,1,0,0,0,0|0,0,0]=2 151 B15R0.81 CNC(=O)CCCCCCCCCCCBr WXVL_AK00442SB0603 [1,1,0,0,0,0|0,0,0]=2 152 B15R0.81 O=C(CO)NCCCCCCCCCCO WXVL_AK3148SB2706 [1,1,0,0,0,0|2,0,0]=4 153 B15R0.81 O=C(CO)NCCCCCCCCCCO WXVL_AK3148SB2706 [1,1,0,0,0,0|2,0,0]=4 154 B15R0.84 CCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB2796 [1,1,0,0,0,0|0,0,0]=2 155 B15R0.84 CCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB2796 [1,1,0,0,0,0|0,0,0]=2 156 B15R0.84 CCCCCCCCCCNC(=O)C(=O)C WXVL_AK1845SB0051 [1,1,0,0,0,0|1,0,1]=4 157 B15R0.84 CCCCCCCCCCNC(=O)C(=O)C WXVL_AK1845SB0051 [1,1,0,0,0,0|1,0,1]=4 158 B15R0.84 CCCCCCCCCCNC(=O)C(C)C WXVL_AK1845SB0052 [1,1,0,0,0,0|1,0,0]=3 159 B15R0.84 CCCCCCCCCCNC(=O)C(C)C WXVL_AK1845SB0052 [1,1,0,0,0,0|1,0,0]=3 160 B15R0.84 CCCCCCCCCCNC(=O)C(C)S WXVL_AK1845SB2708 [1,1,0,0,0,0|1,0,0]=3 161 B15R0.84 CCCCCCCCCCNC(=O)C(C)S WXVL_AK1845SB2708 [1,1,0,0,0,0|1,0,0]=3 162 B15R0.84 CCCCCCCCCCNC(=O)C(F)F WXVL_AK1845SB0079 [1,1,0,0,0,0|2,0,0]=4 163 B15R0.84 CCCCCCCCCCNC(=O)C(F)F WXVL_AK1845SB0079 [1,1,0,0,0,0|2,0,0]=4 164 B15R0.84 CCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1845SB1085 [1,1,0,0,0,0|1,0,0]=3 165 B15R0.84 CCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1845SB1085 [1,1,0,0,0,0|1,0,0]=3 166 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC WXVL_AK1845HU0028 [1,1,0,0,0,0|2,0,0]=4 167 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC WXVL_AK1845HU0028 [1,1,0,0,0,0|2,0,0]=4 168 B15R0.324 CCCCCCCCCNC(=O)C(=O)CC WXVL_AK1826SB0344 [1,1,0,0,0,0|1,0,1]=4 169 B15R0.324 CCCCCCCCCNC(=O)C(=O)CC WXVL_AK1826SB0344 [1,1,0,0,0,0|1,0,1]=4 170 B15R0.2405 CCCCCCCCC(=O)NCC(=O)NC WXVL_AK1222SB0409 [1,1,0,0,0,0|1,0,1]=4 171 B15R0.2405 CCCCCCCCC(=O)NCC(=O)NC WXVL_AK1222SB0409 [1,1,0,0,0,0|1,0,1]=4 172 B15R0.164 CCCCCCCCCCCCNC(=O)C WXVL_AK1886SB0150 [1,1,0,0,0,0|0,0,2]=4 173 B15R0.164 CCCCCCCCCCCCNC(=O)C WXVL_AK1886SB0150 [1,1,0,0,0,0|0,0,2]=4 174 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0481 [1,1,0,0,0,0|0,0,2]=4 175 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0481 [1,1,0,0,0,0|0,0,2]=4 176 B15R0.69 CCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0490 [1,1,0,0,0,0|0,0,0]=2 177 B15R0.69 CCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0490 [1,1,0,0,0,0|0,0,0]=2 178 B15R0.69 CCCCCCCCCNC(=O)CC(C)C WXVL_AK1826SB0063 [1,1,0,0,0,0|2,0,0]=4 179 B15R0.69 CCCCCCCCCNC(=O)CC(C)C WXVL_AK1826SB0063 [1,1,0,0,0,0|2,0,0]=4 180 B15R0.69 CCCCCCCCCNC(=O)CC(C)O WXVL_AK1826SB3643 [1,1,0,0,0,0|2,0,0]=4 181 B15R0.69 CCCCCCCCCNC(=O)CC(C)O WXVL_AK1826SB3643 [1,1,0,0,0,0|2,0,0]=4 182 B15R0.1157 CCCCCCCCCCS(=O)(=O)NCC WXVL_AK00476HU0549 [1,1,0,0,0,0|1,0,0]=3 183 B15R0.1157 CCCCCCCCCCS(=O)(=O)NCC WXVL_AK00476HU0549 [1,1,0,0,0,0|1,0,0]=3 184 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0063 [0,2,0,0,0,0|2,0,0]=4 185 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0063 [0,2,0,0,0,0|2,0,0]=4 186 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0030SB0603 [0,2,0,0,0,0|0,0,0]=2 187 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0030SB0603 [0,2,0,0,0,0|0,0,0]=2 188 B17R0.116 CC(O)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB3643 [0,2,0,0,0,0|2,0,0]=4 189 B17R0.116 CC(O)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB3643 [0,2,0,0,0,0|2,0,0]=4 190 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0547 [0,2,0,0,0,0|0,0,0]=2 191 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0547 [0,2,0,0,0,0|0,0,0]=2 192 B17R0.196 C=CCNC(=O)CCCCCCCCCCCBr WXVL_AK00561SB0603 [0,2,0,0,0,0|0,0,1]=3 193 B17R0.196 C=CCNC(=O)CCCCCCCCCCCBr WXVL_AK00561SB0603 [0,2,0,0,0,0|0,0,1]=3 194 B17R0.196 C=CCNC(=O)CCCCCCCCCCCC WXVL_AK00561SB0547 [0,2,0,0,0,0|0,0,1]=3 195 B17R0.196 C=CCNC(=O)CCCCCCCCCCCC WXVL_AK00561SB0547 [0,2,0,0,0,0|0,0,1]=3 196 B17R0.196 CCCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB0547 [0,2,0,0,0,0|0,0,1]=3 197 B17R0.196 CCCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB0547 [0,2,0,0,0,0|0,0,1]=3 198 B17R0.196 CCCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB0547 [0,2,0,0,0,0|0,0,0]=2 199 B17R0.196 CCCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB0547 [0,2,0,0,0,0|0,0,0]=2 200 B17R0.196 CCCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB0547 [0,2,0,0,0,0|0,0,0]=2 201 B17R0.196 CCCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB0547 [0,2,0,0,0,0|0,0,0]=2 202 B17R0.196 CCCNC(=O)CCCCCCCCCCCBr WXVL_AK00504SB0603 [0,2,0,0,0,0|0,0,0]=2 203 B17R0.196 CCCNC(=O)CCCCCCCCCCCBr WXVL_AK00504SB0603 [0,2,0,0,0,0|0,0,0]=2 204 B17R0.196 CCOCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0091 [0,2,0,0,0,0|2,0,0]=4 205 B17R0.196 CCOCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0091 [0,2,0,0,0,0|2,0,0]=4 206 B17R0.196 CCSCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0002 [0,2,0,0,0,0|2,0,0]=4 207 B17R0.196 CCSCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0002 [0,2,0,0,0,0|2,0,0]=4 208 B17R0.196 COCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0156 [0,2,0,0,0,0|2,0,0]=4 209 B17R0.196 COCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0156 [0,2,0,0,0,0|2,0,0]=4 210 B17R0.196 CSCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0361 [0,2,0,0,0,0|2,0,0]=4 211 B17R0.196 CSCCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0361 [0,2,0,0,0,0|2,0,0]=4 212 B17R0.196 N#CCNC(=O)CCCCCCCCCCCBr WXVL_AK0683SB0603 [0,2,0,0,0,0|0,0,1]=3 213 B17R0.196 N#CCNC(=O)CCCCCCCCCCCBr WXVL_AK0683SB0603 [0,2,0,0,0,0|0,0,1]=3 214 B17R0.196 O=C(CCCCCCCCCCCBr)NCCF WXVL_AK00466SB0603 [0,2,0,0,0,0|0,0,0]=2 215 B17R0.196 O=C(CCCCCCCCCCCBr)NCCF WXVL_AK00466SB0603 [0,2,0,0,0,0|0,0,0]=2 216 B17R0.196 O=C(NCCCl)NCCCCCCCCCCO WXVL_AK3148YV0092 [0,2,0,0,0,0|1,0,0]=3 217 B17R0.196 O=C(NCCCl)NCCCCCCCCCCO WXVL_AK3148YV0092 [0,2,0,0,0,0|1,0,0]=3 218 B17R0.231 CCCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1826SB3094 [0,2,0,0,0,0|1,0,1]=4 219 B17R0.231 CCCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1826SB3094 [0,2,0,0,0,0|1,0,1]=4 220 B17R0.250 C/C=C/C(=O)NCCCCCCCCCCCC WXVL_AK1886SB0340 [0,2,0,0,0,0|1,0,1]=4 221 B17R0.250 C/C=C/C(=O)NCCCCCCCCCCCC WXVL_AK1886SB0340 [0,2,0,0,0,0|1,0,1]=4 222 B17R0.250 CC#CC(=O)NCCCCCCCCCCCC WXVL_AK1886SB1240 [0,2,0,0,0,0|1,0,1]=4 223 B17R0.250 CC#CC(=O)NCCCCCCCCCCCC WXVL_AK1886SB1240 [0,2,0,0,0,0|1,0,1]=4 224 B17R0.250 CCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0562 [0,2,0,0,0,0|0,0,0]=2 225 B17R0.250 CCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0562 [0,2,0,0,0,0|0,0,0]=2 226 B17R0.250 CCCCCCCCCCCCNC(=O)CCC WXVL_AK1886SB0073 [0,2,0,0,0,0|1,0,0]=3 227 B17R0.250 CCCCCCCCCCCCNC(=O)CCC WXVL_AK1886SB0073 [0,2,0,0,0,0|1,0,0]=3 228 B17R0.250 CCCCCCCCCCCCNC(=O)COC WXVL_AK1886SB0090 [0,2,0,0,0,0|2,0,0]=4 229 B17R0.250 CCCCCCCCCCCCNC(=O)COC WXVL_AK1886SB0090 [0,2,0,0,0,0|2,0,0]=4 230 B17R0.250 CCCCCCCCCCCCNC(=O)CSC WXVL_AK1886SB1267 [0,2,0,0,0,0|2,0,0]=4 231 B17R0.250 CCCCCCCCCCCCNC(=O)CSC WXVL_AK1886SB1267 [0,2,0,0,0,0|2,0,0]=4 232 B17R0.250 CCCCCCCCCCCCNC(=O)NCC WXVL_AK00476YV0205 [0,2,0,0,0,0|0,0,0]=2 233 B17R0.250 CCCCCCCCCCCCNC(=O)NCC WXVL_AK00476YV0205 [0,2,0,0,0,0|0,0,0]=2 234 B17R0.1022 CCCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0409 [0,2,0,0,0,0|1,0,1]=4 235 B17R0.1022 CCCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0409 [0,2,0,0,0,0|1,0,1]=4 236 B17R0.3112 CCC(=O)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0344 [0,2,0,0,0,0|2,0,0]=4 237 B17R0.3112 CCC(=O)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0344 [0,2,0,0,0,0|2,0,0]=4 238 B17R0.3112 CCC(C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0054 [0,2,0,0,0,0|2,0,0]=4 239 B17R0.3112 CCC(C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0054 [0,2,0,0,0,0|2,0,0]=4 240 B17R0.3112 CC[C@@H](C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB00054 [0,2,0,0,0,0|2,0,0]=4 241 B17R0.3112 CC[C@@H](C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB00054 [0,2,0,0,0,0|2,0,0]=4 242 B17R0.3112 CC[C@H](O)C(=O)NCCCCCCCCCCO WXVL_AK3148SB3573 [0,2,0,0,0,0|2,0,0]=4 243 B17R0.3112 CC[C@H](O)C(=O)NCCCCCCCCCCO WXVL_AK3148SB3573 [0,2,0,0,0,0|2,0,0]=4 244 B17R0.10075 CCCCCCCCCCCCS(=O)(=O)NCC WXVL_AK00476HU0325 [0,2,0,0,0,0|1,0,0]=3 245 B17R0.10075 CCCCCCCCCCCCS(=O)(=O)NCC WXVL_AK00476HU0325 [0,2,0,0,0,0|1,0,0]=3 246 B17R0.13602 CC/C=C(\C)/C(=O)NCCCCCCCCCC WXVL_AK1845SB0037 [0,2,0,0,0,0|2,0,0]=4 247 B17R0.13602 CC/C=C(\C)/C(=O)NCCCCCCCCCC WXVL_AK1845SB0037 [0,2,0,0,0,0|2,0,0]=4 248 B17R0.13602 CCCCCCCCCCCC(=O)N(C)CC#N WXVL_AN2942SB2796 [0,2,0,0,0,0|0,0,1]=3 249 B17R0.13602 CCCCCCCCCCCC(=O)N(C)CC#N WXVL_AN2942SB2796 [0,2,0,0,0,0|0,0,1]=3 250 B17R0.13602 CCCCCCCCCCCC(=O)N(C)CCO WXVL_AN2670SB2796 [0,2,0,0,0,0|0,0,0]=2 251 B17R0.13602 CCCCCCCCCCCC(=O)N(C)CCO WXVL_AN2670SB2796 [0,2,0,0,0,0|0,0,0]=2 252 B17R0.13602 CCCCCCCCCCNC(=O)C(=O)OCC WXVL_AK1845SB4144 [0,2,0,0,0,0|1,0,1]=4 253 B17R0.13602 CCCCCCCCCCNC(=O)C(=O)OCC WXVL_AK1845SB4144 [0,2,0,0,0,0|1,0,1]=4 254 B17R0.13602 CCCCCCCCCCNC(=O)C(C)CCC WXVL_AK1845SB0352 [0,2,0,0,0,0|2,0,0]=4 255 B17R0.13602 CCCCCCCCCCNC(=O)C(C)CCC WXVL_AK1845SB0352 [0,2,0,0,0,0|2,0,0]=4 256 B17R0.13602 CCCCCCCCCCNC(=O)[C@@H](O)CCC WXVL_AK1845SB3627 [0,2,0,0,0,0|2,0,0]=4 257 B17R0.13602 CCCCCCCCCCNC(=O)[C@@H](O)CCC WXVL_AK1845SB3627 [0,2,0,0,0,0|2,0,0]=4 258 B17R0.191 CCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB2796 [0,2,0,0,0,0|0,0,0]=2 259 B17R0.191 CCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB2796 [0,2,0,0,0,0|0,0,0]=2 260 B17R0.191 CCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK1845SB2578 [0,2,0,0,0,0|2,0,0]=4 261 B17R0.191 CCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK1845SB2578 [0,2,0,0,0,0|2,0,0]=4 262 B17R0.191 CCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK1845SB1147 [0,2,0,0,0,0|2,0,0]=4 263 B17R0.191 CCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK1845SB1147 [0,2,0,0,0,0|2,0,0]=4 264 B17R0.5622 CCCCCCCCCCNC(=O)C(C)(C)CC WXVL_AK1845SB0355 [0,2,0,0,0,0|2,0,0]=4 265 B17R0.5622 CCCCCCCCCCNC(=O)C(C)(C)CC WXVL_AK1845SB0355 [0,2,0,0,0,0|2,0,0]=4 266 B17R0.5622 CCCCCCCCCCNC(=O)C(C)(O)CC WXVL_AK1845SB3009 [0,2,0,0,0,0|2,0,0]=4 267 B17R0.5622 CCCCCCCCCCNC(=O)C(C)(O)CC WXVL_AK1845SB3009 [0,2,0,0,0,0|2,0,0]=4 268 B17R0.13604 CCCCCCCCCCCC(=O)N(CC)CC WXVL_AN0042SB2796 [0,2,0,0,0,0|0,0,0]=2 269 B17R0.13604 CCCCCCCCCCCC(=O)N(CC)CC WXVL_AN0042SB2796 [0,2,0,0,0,0|0,0,0]=2 270 B17R0.13604 CCCCCCCCCCNC(=O)C(CC)CC WXVL_AK1845SB0055 [0,2,0,0,0,0|2,0,0]=4 271 B17R0.13604 CCCCCCCCCCNC(=O)C(CC)CC WXVL_AK1845SB0055 [0,2,0,0,0,0|2,0,0]=4 272 B17R0.13601 C#C[C@@H](C)NC(=O)CCCCCCCCCCC WXVL_AK00735SB2796 [0,2,0,0,0,0|0,0,0]=2 273 B17R0.13601 C#C[C@@H](C)NC(=O)CCCCCCCCCCC WXVL_AK00735SB2796 [0,2,0,0,0,0|0,0,0]=2 274 B17R0.13601 C=CC(C)NC(=O)CCCCCCCCCCC WXVL_AK00769SB2796 [0,2,0,0,0,0|0,0,0]=2 275 B17R0.13601 C=CC(C)NC(=O)CCCCCCCCCCC WXVL_AK00769SB2796 [0,2,0,0,0,0|0,0,0]=2 276 B17R0.13601 CCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB2796 [0,2,0,0,0,0|0,0,0]=2 277 B17R0.13601 CCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB2796 [0,2,0,0,0,0|0,0,0]=2 278 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB2796 [0,2,0,0,0,0|0,0,0]=2 279 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB2796 [0,2,0,0,0,0|0,0,0]=2 280 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB2796 [0,2,0,0,0,0|0,0,0]=2 281 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB2796 [0,2,0,0,0,0|0,0,0]=2 282 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB2796 [0,2,0,0,0,0|0,0,0]=2 283 B17R0.13601 CCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB2796 [0,2,0,0,0,0|0,0,0]=2 284 B17R0.13601 CCCCCCCCCCNC(=O)CC(C)CC WXVL_AK1845SB0353 [0,2,0,0,0,0|2,0,0]=4 285 B17R0.13601 CCCCCCCCCCNC(=O)CC(C)CC WXVL_AK1845SB0353 [0,2,0,0,0,0|2,0,0]=4 286 B17R0.13601 CCCCCCCCCCNC(=O)CC(O)CC WXVL_AK1845SB4092 [0,2,0,0,0,0|2,0,0]=4 287 B17R0.13601 CCCCCCCCCCNC(=O)CC(O)CC WXVL_AK1845SB4092 [0,2,0,0,0,0|2,0,0]=4 288 B17R0.13601 CCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK1845SB8650 [0,2,0,0,0,0|2,0,0]=4 289 B17R0.13601 CCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK1845SB8650 [0,2,0,0,0,0|2,0,0]=4 290 B17R0.13612 CCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB2796 [0,2,0,0,0,0|0,0,0]=2 291 B17R0.13612 CCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB2796 [0,2,0,0,0,0|0,0,0]=2 292 B17R0.13612 CCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK1845SB0062 [0,2,0,0,0,0|2,0,0]=4 293 B17R0.13612 CCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK1845SB0062 [0,2,0,0,0,0|2,0,0]=4 294 B17R0.13612 CCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK1845SB0163 [0,2,0,0,0,0|2,0,0]=4 295 B17R0.13612 CCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK1845SB0163 [0,2,0,0,0,0|2,0,0]=4 296 B17R0.192 C=C(C)CNC(=O)CCCCCCCCCCC WXVL_AK0761SB2796 [0,2,0,0,0,0|0,0,0]=2 297 B17R0.192 C=C(C)CNC(=O)CCCCCCCCCCC WXVL_AK0761SB2796 [0,2,0,0,0,0|0,0,0]=2 298 B17R0.192 CCCCCCCCCCCC(=O)NCC(=O)N WXVL_AK0147SB2796 [0,2,0,0,0,0|0,0,1]=3 299 B17R0.192 CCCCCCCCCCCC(=O)NCC(=O)N WXVL_AK0147SB2796 [0,2,0,0,0,0|0,0,1]=3 300 B17R0.192 CCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB2796 [0,2,0,0,0,0|0,0,0]=2 301 B17R0.192 CCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB2796 [0,2,0,0,0,0|0,0,0]=2 302 B17R0.192 CCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB2796 [0,2,0,0,0,0|0,0,0]=2 303 B17R0.192 CCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB2796 [0,2,0,0,0,0|0,0,0]=2 304 B17R0.192 CCCCCCCCCCCC(=O)NCC(F)F WXVL_AK0136SB2796 [0,2,0,0,0,0|0,0,0]=2 305 B17R0.192 CCCCCCCCCCCC(=O)NCC(F)F WXVL_AK0136SB2796 [0,2,0,0,0,0|0,0,0]=2 306 B17R0.192 CCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB2796 [0,2,0,0,0,0|0,0,0]=2 307 B17R0.192 CCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB2796 [0,2,0,0,0,0|0,0,0]=2 308 B17R0.192 CCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK1845SB0036 [0,2,0,0,0,0|2,0,0]=4 309 B17R0.192 CCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK1845SB0036 [0,2,0,0,0,0|2,0,0]=4 310 B17R0.192 CCCCCCCCCCNC(=O)CCC(=O)C WXVL_AK1845SB0072 [0,2,0,0,0,0|2,0,0]=4 311 B17R0.192 CCCCCCCCCCNC(=O)CCC(=O)C WXVL_AK1845SB0072 [0,2,0,0,0,0|2,0,0]=4 312 B17R0.192 CCCCCCCCCCNC(=O)CCC(C)C WXVL_AK1845SB0354 [0,2,0,0,0,0|2,0,0]=4 313 B17R0.192 CCCCCCCCCCNC(=O)CCC(C)C WXVL_AK1845SB0354 [0,2,0,0,0,0|2,0,0]=4 314 B17R0.192 CCCCCCCCCCNC(=O)CCN(C)C WXVL_AK1845SB00052 [0,2,0,0,0,0|2,0,0]=4 315 B17R0.192 CCCCCCCCCCNC(=O)CCN(C)C WXVL_AK1845SB00052 [0,2,0,0,0,0|2,0,0]=4 316 B17R0.192 CCCCCCCCCCNC(=O)CNC(=O)C WXVL_AK1845SB0357 [0,2,0,0,0,0|1,0,1]=4 317 B17R0.192 CCCCCCCCCCNC(=O)CNC(=O)C WXVL_AK1845SB0357 [0,2,0,0,0,0|1,0,1]=4 318 B17R0.192 CCCCCCCCCCNC(=O)COC(C)C WXVL_AK1845SB0213 [0,2,0,0,0,0|2,0,0]=4 319 B17R0.192 CCCCCCCCCCNC(=O)COC(C)C WXVL_AK1845SB0213 [0,2,0,0,0,0|2,0,0]=4 320 B17R0.3110 C#CCCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2709 [0,2,0,0,0,0|2,0,0]=4 321 B17R0.3110 C#CCCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2709 [0,2,0,0,0,0|2,0,0]=4 322 B17R0.3110 C#CCCNC(=O)CCCCCCCCCCC WXVL_AK3109SB2796 [0,2,0,0,0,0|0,0,0]=2 323 B17R0.3110 C#CCCNC(=O)CCCCCCCCCCC WXVL_AK3109SB2796 [0,2,0,0,0,0|0,0,0]=2 324 B17R0.3110 C=CCCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2920 [0,2,0,0,0,0|2,0,0]=4 325 B17R0.3110 C=CCCCC(=O)NCCCCCCCCCC WXVL_AK1845SB2920 [0,2,0,0,0,0|2,0,0]=4 326 B17R0.3110 C=CCCNC(=O)CCCCCCCCCCC WXVL_AK00138SB2796 [0,2,0,0,0,0|0,0,0]=2 327 B17R0.3110 C=CCCNC(=O)CCCCCCCCCCC WXVL_AK00138SB2796 [0,2,0,0,0,0|0,0,0]=2 328 B17R0.3110 CC/C=C/CC(=O)NCCCCCCCCCC WXVL_AK1845SB0349 [0,2,0,0,0,0|2,0,0]=4 329 B17R0.3110 CC/C=C/CC(=O)NCCCCCCCCCC WXVL_AK1845SB0349 [0,2,0,0,0,0|2,0,0]=4 330 B17R0.3110 CCCCCCCCCCCC(=O)NCCC#N WXVL_AK0087SB2796 [0,2,0,0,0,0|0,0,0]=2 331 B17R0.3110 CCCCCCCCCCCC(=O)NCCC#N WXVL_AK0087SB2796 [0,2,0,0,0,0|0,0,0]=2 332 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC WXVL_AK00588SB2796 [0,2,0,0,0,0|0,0,0]=2 333 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC WXVL_AK00588SB2796 [0,2,0,0,0,0|0,0,0]=2 334 B17R0.3110 CCCCCCCCCCCC(=O)NCCCO WXVL_AK0073SB2796 [0,2,0,0,0,0|0,0,0]=2 335 B17R0.3110 CCCCCCCCCCCC(=O)NCCCO WXVL_AK0073SB2796 [0,2,0,0,0,0|0,0,0]=2 336 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC WXVL_AK00440SB2796 [0,2,0,0,0,0|0,0,0]=2 337 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC WXVL_AK00440SB2796 [0,2,0,0,0,0|0,0,0]=2 338 B17R0.3110 CCCCCCCCCCNC(=O)/C=C/OCC WXVL_AK1845SB3226 [0,2,0,0,0,0|2,0,0]=4 339 B17R0.3110 CCCCCCCCCCNC(=O)/C=C/OCC WXVL_AK1845SB3226 [0,2,0,0,0,0|2,0,0]=4 340 B17R0.3110 CCCCCCCCCCNC(=O)CCCCBr WXVL_AK1845SB3153 [0,2,0,0,0,0|2,0,0]=4 341 B17R0.3110 CCCCCCCCCCNC(=O)CCCCBr WXVL_AK1845SB3153 [0,2,0,0,0,0|2,0,0]=4 342 B17R0.3110 CCCCCCCCCCNC(=O)CCCCCl WXVL_AK1845SB0379 [0,2,0,0,0,0|2,0,0]=4 343 B17R0.3110 CCCCCCCCCCNC(=O)CCCCCl WXVL_AK1845SB0379 [0,2,0,0,0,0|2,0,0]=4 344 B17R0.3110 CCCCCCCCCCNC(=O)NCCCCl WXVL_AK1845YV0130 [0,2,0,0,0,0|1,0,0]=3 345 B17R0.3110 CCCCCCCCCCNC(=O)NCCCCl WXVL_AK1845YV0130 [0,2,0,0,0,0|1,0,0]=3 346 B15R1.975 CCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0064 [1,0,0,1,0,0|2,0,0]=4 347 B15R1.975 CCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0064 [1,0,0,1,0,0|2,0,0]=4 348 B15R1.1091 CCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0064 [1,0,0,1,0,0|2,0,0]=4 349 B15R1.1091 CCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0064 [1,0,0,1,0,0|2,0,0]=4 350 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0064 [1,0,0,1,0,0|1,0,0]=3 351 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0064 [1,0,0,1,0,0|1,0,0]=3 352 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 WXVL_AK2380SB2706 [1,0,0,1,0,0|2,0,0]=4 353 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 WXVL_AK2380SB2706 [1,0,0,1,0,0|2,0,0]=4 354 B15R1.778 CCCC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0073 [1,0,0,1,0,0|2,0,0]=4 355 B15R1.778 CCCC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0073 [1,0,0,1,0,0|2,0,0]=4 356 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 WXVL_AK1826SB0038 [1,0,0,1,0,0|2,0,0]=4 357 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 WXVL_AK1826SB0038 [1,0,0,1,0,0|2,0,0]=4 358 B17R1.11019 O=C(NCCCCCCCCCCO)C1CC1 WXVL_AK3148SB0038 [0,1,0,1,0,0|2,0,0]=4 359 B17R1.11019 O=C(NCCCCCCCCCCO)C1CC1 WXVL_AK3148SB0038 [0,1,0,1,0,0|2,0,0]=4 360 B17R1.2197 CCC(=O)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0344 [0,1,0,1,0,0|2,0,0]=4 361 B17R1.2197 CCC(=O)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0344 [0,1,0,1,0,0|2,0,0]=4 362 B17R1.2197 CCC(C)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0054 [0,1,0,1,0,0|2,0,0]=4 363 B17R1.2197 CCC(C)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0054 [0,1,0,1,0,0|2,0,0]=4 364 B17R1.2197 CC[C@@H](C)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB00054 [0,1,0,1,0,0|2,0,0]=4 365 B17R1.2197 CC[C@@H](C)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB00054 [0,1,0,1,0,0|2,0,0]=4 366 B17R1.2197 CC[C@H](O)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB3573 [0,1,0,1,0,0|2,0,0]=4 367 B17R1.2197 CC[C@H](O)C(=O)NCCC1CCCCCCC1 WXVL_AK2380SB3573 [0,1,0,1,0,0|2,0,0]=4 368 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 WXVL_AK1845SB0042 [0,1,0,1,0,0|2,0,0]=4 369 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 WXVL_AK1845SB0042 [0,1,0,1,0,0|2,0,0]=4 370 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)Br WXVL_AK1845SB5517 [0,1,0,1,0,0|2,0,0]=4 371 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)Br WXVL_AK1845SB5517 [0,1,0,1,0,0|2,0,0]=4 372 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)C WXVL_AK1845SB0040 [0,1,0,1,0,0|2,0,0]=4 373 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)C WXVL_AK1845SB0040 [0,1,0,1,0,0|2,0,0]=4 374 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)F WXVL_AK1845SB0218 [0,1,0,1,0,0|2,0,0]=4 375 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)F WXVL_AK1845SB0218 [0,1,0,1,0,0|2,0,0]=4 376 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)O WXVL_AK1845SB2965 [0,1,0,1,0,0|2,0,0]=4 377 B17R1.29774 CCCCCCCCCCNC(=O)C1(CC1)O WXVL_AK1845SB2965 [0,1,0,1,0,0|2,0,0]=4 378 B17R1.73265 CCCCCCCCCCNC(=O)C1CC1C WXVL_AK1845SB0041 [0,1,0,1,0,0|2,0,0]=4 379 B17R1.73265 CCCCCCCCCCNC(=O)C1CC1C WXVL_AK1845SB0041 [0,1,0,1,0,0|2,0,0]=4 380 B17R1.73265 CCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK1845SB1245 [0,1,0,1,0,0|2,0,0]=4 381 B17R1.73265 CCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK1845SB1245 [0,1,0,1,0,0|2,0,0]=4 382 B17R1.73265 CCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK1845SB00019 [0,1,0,1,0,0|2,0,0]=4 383 B17R1.73265 CCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK1845SB00019 [0,1,0,1,0,0|2,0,0]=4 384 B17R1.40 CCCCCCCCC(=O)N1CCNC(=O)C1 WXVL_AN0102SB0409 [0,1,0,1,0,0|1,0,1]=4 385 B17R1.40 CCCCCCCCC(=O)N1CCNC(=O)C1 WXVL_AN0102SB0409 [0,1,0,1,0,0|1,0,1]=4 386 B17R1.6956 CCCCCCCCC(=O)N[C@@H]1CCNC1=O WXVL_AK0496SB0409 [0,1,0,1,0,0|1,0,1]=4 387 B17R1.6956 CCCCCCCCC(=O)N[C@@H]1CCNC1=O WXVL_AK0496SB0409 [0,1,0,1,0,0|1,0,1]=4 388 B17R1.1576 O=C(NCCCl)NCCCCCN1CCCC1 WXVL_AK00797YV0092 [0,1,0,1,0,0|2,0,0]=4 389 B17R1.1576 O=C(NCCCl)NCCCCCN1CCCC1 WXVL_AK00797YV0092 [0,1,0,1,0,0|2,0,0]=4 390 B17R1.29775 CCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB2796 [0,1,0,1,0,0|0,0,0]=2 391 B17R1.29775 CCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB2796 [0,1,0,1,0,0|0,0,0]=2 392 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 WXVL_AK1845SB0155 [0,1,0,1,0,0|2,0,0]=4 393 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 WXVL_AK1845SB0155 [0,1,0,1,0,0|2,0,0]=4 394 B17R1.103871 CC(C)CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0063 [0,1,0,1,0,0|2,0,0]=4 395 B17R1.103871 CC(C)CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0063 [0,1,0,1,0,0|2,0,0]=4 396 B17R1.103871 CC(O)CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB3643 [0,1,0,1,0,0|2,0,0]=4 397 B17R1.103871 CC(O)CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB3643 [0,1,0,1,0,0|2,0,0]=4 398 B17R1.1515 CC1CCCCN1CCCNC(=O)NCCCl WXVL_AK1585YV0092 [0,1,0,1,0,0|2,0,0]=4 399 B17R1.1515 CC1CCCCN1CCCNC(=O)NCCCl WXVL_AK1585YV0092 [0,1,0,1,0,0|2,0,0]=4 400 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0091 [0,1,0,1,0,0|2,0,0]=4 401 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0091 [0,1,0,1,0,0|2,0,0]=4 402 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0002 [0,1,0,1,0,0|2,0,0]=4 403 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0002 [0,1,0,1,0,0|2,0,0]=4 404 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0156 [0,1,0,1,0,0|2,0,0]=4 405 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0156 [0,1,0,1,0,0|2,0,0]=4 406 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0361 [0,1,0,1,0,0|2,0,0]=4 407 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0361 [0,1,0,1,0,0|2,0,0]=4 408 B17R1.30208 O=C(NCCCl)NCCC1CCCCCCC1 WXVL_AK2380YV0092 [0,1,0,1,0,0|1,0,0]=3 409 B17R1.30208 O=C(NCCCl)NCCC1CCCCCCC1 WXVL_AK2380YV0092 [0,1,0,1,0,0|1,0,0]=3 410 B17R1.66796 CCCCCCCC(=O)N1CCNC(=O)CC1 WXVL_AN00585SB0393 [0,1,0,1,0,0|1,0,1]=4 411 B17R2.295062 O=C(NCCC1CCCCCCC1)C2CC2 WXVL_AK2380SB0038 [0,0,0,2,0,0|2,0,0]=4 412 B17R2.295062 O=C(NCCC1CCCCCCC1)C2CC2 WXVL_AK2380SB0038 [0,0,0,2,0,0|2,0,0]=4