0 B12R0.1 CCCC(=O)NCCCCCCO WXVL_AK0751SB0073 [0,0,1,0,0,0|2,0,0]=3 1 B12R0.1 CCCC(=O)NCCCCCCO WXVL_AK0751SB0073 [0,0,1,0,0,0|2,0,0]=3 2 B12R0.1 CCCC(=O)NCCOCCOC WXVL_AK2206SB0073 [0,0,1,0,0,0|3,0,0]=4 3 B12R0.1 CCCC(=O)NCCOCCOC WXVL_AK2206SB0073 [0,0,1,0,0,0|3,0,0]=4 4 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,0,1,0,0,0|2,0,0]=3 5 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,0,1,0,0,0|2,0,0]=3 6 B12R0.1 CCCCOCCNC(=O)CCC WXVL_AK9674SB0073 [0,0,1,0,0,0|2,0,0]=3 7 B12R0.1 CCCCOCCNC(=O)CCC WXVL_AK9674SB0073 [0,0,1,0,0,0|2,0,0]=3 8 B12R0.1 CCCCOCCNC(=O)COC WXVL_AK9674SB0090 [0,0,1,0,0,0|3,0,0]=4 9 B12R0.1 CCCCOCCNC(=O)COC WXVL_AK9674SB0090 [0,0,1,0,0,0|3,0,0]=4 10 B12R0.1 CCCCOCCNC(=O)CSC WXVL_AK9674SB1267 [0,0,1,0,0,0|3,0,0]=4 11 B12R0.1 CCCCOCCNC(=O)CSC WXVL_AK9674SB1267 [0,0,1,0,0,0|3,0,0]=4 12 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,0,1,0,0,0|3,0,0]=4 13 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,0,1,0,0,0|3,0,0]=4 14 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,0,1,0,0,0|3,0,0]=4 15 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,0,1,0,0,0|3,0,0]=4 16 B12R0.1 COCC(=O)NCCCCCCO WXVL_AK0751SB0090 [0,0,1,0,0,0|3,0,0]=4 17 B12R0.1 COCC(=O)NCCCCCCO WXVL_AK0751SB0090 [0,0,1,0,0,0|3,0,0]=4 18 B12R0.1 CSCC(=O)NCCCCCCO WXVL_AK0751SB1267 [0,0,1,0,0,0|3,0,0]=4 19 B12R0.1 CSCC(=O)NCCCCCCO WXVL_AK0751SB1267 [0,0,1,0,0,0|3,0,0]=4 20 B12R0.4 CCCCCCCC(O)CC(=O)N WXVL_AK0084SB4065 [0,0,1,0,0,0|2,0,0]=3 21 B12R0.4 CCCCCCCC(O)CC(=O)N WXVL_AK0084SB4065 [0,0,1,0,0,0|2,0,0]=3 22 B11R0.4 CCCC(=O)NCCCCCO WXVL_AK0077SB0073 [1,0,1,0,0,0|2,0,0]=4 23 B11R0.4 CCCC(=O)NCCCCCO WXVL_AK0077SB0073 [1,0,1,0,0,0|2,0,0]=4 24 B11R0.4 CCCC(=O)NCCCOCC WXVL_AK0072SB0073 [1,0,1,0,0,0|2,0,0]=4 25 B11R0.4 CCCC(=O)NCCCOCC WXVL_AK0072SB0073 [1,0,1,0,0,0|2,0,0]=4 26 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,0,1,0,0,0|1,0,0]=3 27 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,0,1,0,0,0|1,0,0]=3 28 B11R0.4 CCCCCCNC(=O)CCC WXVL_AK0286SB0073 [1,0,1,0,0,0|1,0,0]=3 29 B11R0.4 CCCCCCNC(=O)CCC WXVL_AK0286SB0073 [1,0,1,0,0,0|1,0,0]=3 30 B11R0.4 CCCCCCNC(=O)COC WXVL_AK0286SB0090 [1,0,1,0,0,0|2,0,0]=4 31 B11R0.4 CCCCCCNC(=O)COC WXVL_AK0286SB0090 [1,0,1,0,0,0|2,0,0]=4 32 B11R0.4 CCCCCCNC(=O)CSC WXVL_AK0286SB1267 [1,0,1,0,0,0|2,0,0]=4 33 B11R0.4 CCCCCCNC(=O)CSC WXVL_AK0286SB1267 [1,0,1,0,0,0|2,0,0]=4 34 B11R0.4 CCNC(=O)CCCCCCBr WXVL_AK00476SB1386 [1,0,1,0,0,0|2,0,0]=4 35 B11R0.4 CCNC(=O)CCCCCCBr WXVL_AK00476SB1386 [1,0,1,0,0,0|2,0,0]=4 36 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,0,1,0,0,0|2,0,0]=4 37 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,0,1,0,0,0|2,0,0]=4 38 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,0,1,0,0,0|2,0,0]=4 39 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,0,1,0,0,0|2,0,0]=4 40 B11R0.40 CCCCOCCNC(=O)CC WXVL_AK9674SB0064 [1,0,1,0,0,0|2,0,0]=4 41 B11R0.40 CCCCOCCNC(=O)CC WXVL_AK9674SB0064 [1,0,1,0,0,0|2,0,0]=4 42 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,0,1,0,0,0|1,0,0]=3 43 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,0,1,0,0,0|1,0,0]=3 44 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,0,1,0,0,0|2,0,0]=4 45 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,0,1,0,0,0|2,0,0]=4 46 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,1,1,0,0,0|2,0,0]=4 47 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,1,1,0,0,0|2,0,0]=4 48 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,1,1,0,0,0|1,0,0]=3 49 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,1,1,0,0,0|1,0,0]=3 50 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,1,1,0,0,0|2,0,0]=4 51 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,1,1,0,0,0|2,0,0]=4 52 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,1,1,0,0,0|2,0,0]=4 53 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,1,1,0,0,0|2,0,0]=4 54 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,1,1,0,0,0|2,0,0]=4 55 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,1,1,0,0,0|2,0,0]=4 56 B13R0.2 CCCCOCCCNC(=O)CCC WXVL_AK2310SB0073 [0,1,1,0,0,0|1,0,0]=3 57 B13R0.2 CCCCOCCCNC(=O)CCC WXVL_AK2310SB0073 [0,1,1,0,0,0|1,0,0]=3 58 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,1,1,0,0,0|2,0,0]=4 59 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,1,1,0,0,0|2,0,0]=4 60 B13R0.2 CCCCOCCCNC(=O)CSC WXVL_AK2310SB1267 [0,1,1,0,0,0|2,0,0]=4 61 B13R0.2 CCCCOCCCNC(=O)CSC WXVL_AK2310SB1267 [0,1,1,0,0,0|2,0,0]=4 62 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,1,1,0,0,0|1,0,0]=3 63 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,1,1,0,0,0|1,0,0]=3 64 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,1,1,0,0,0|2,0,0]=4 65 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,1,1,0,0,0|2,0,0]=4 66 B13R0.66 CCCCOCCNC(=O)CCOC WXVL_AK9674SB0156 [0,1,1,0,0,0|2,0,0]=4 67 B13R0.66 CCCCOCCNC(=O)CCOC WXVL_AK9674SB0156 [0,1,1,0,0,0|2,0,0]=4 68 B13R0.66 CCCCOCCNC(=O)CCSC WXVL_AK9674SB0361 [0,1,1,0,0,0|2,0,0]=4 69 B13R0.66 CCCCOCCNC(=O)CCSC WXVL_AK9674SB0361 [0,1,1,0,0,0|2,0,0]=4 70 B13R0.66 CCCCOCCNC(=O)COCC WXVL_AK9674SB0091 [0,1,1,0,0,0|2,0,0]=4 71 B13R0.66 CCCCOCCNC(=O)COCC WXVL_AK9674SB0091 [0,1,1,0,0,0|2,0,0]=4 72 B13R0.66 CCCCOCCNC(=O)CSCC WXVL_AK9674SB0002 [0,1,1,0,0,0|2,0,0]=4 73 B13R0.66 CCCCOCCNC(=O)CSCC WXVL_AK9674SB0002 [0,1,1,0,0,0|2,0,0]=4 74 B13R0.66 CCCNC(=O)CCCCCCCBr WXVL_AK00504SB0559 [0,1,1,0,0,0|2,0,0]=4 75 B13R0.66 CCCNC(=O)CCCCCCCBr WXVL_AK00504SB0559 [0,1,1,0,0,0|2,0,0]=4 76 B13R0.66 CCCNC(=O)CCCCCCCO WXVL_AK00504SB1306 [0,1,1,0,0,0|2,0,0]=4 77 B13R0.66 CCCNC(=O)CCCCCCCO WXVL_AK00504SB1306 [0,1,1,0,0,0|2,0,0]=4 78 B13R0.66 CCOCC(=O)NCCCCCCO WXVL_AK0751SB0091 [0,1,1,0,0,0|2,0,0]=4 79 B13R0.66 CCOCC(=O)NCCCCCCO WXVL_AK0751SB0091 [0,1,1,0,0,0|2,0,0]=4 80 B13R0.66 CCSCC(=O)NCCCCCCO WXVL_AK0751SB0002 [0,1,1,0,0,0|2,0,0]=4 81 B13R0.66 CCSCC(=O)NCCCCCCO WXVL_AK0751SB0002 [0,1,1,0,0,0|2,0,0]=4 82 B13R0.66 COCCC(=O)NCCCCCCO WXVL_AK0751SB0156 [0,1,1,0,0,0|2,0,0]=4 83 B13R0.66 COCCC(=O)NCCCCCCO WXVL_AK0751SB0156 [0,1,1,0,0,0|2,0,0]=4 84 B13R0.66 CSCCC(=O)NCCCCCCO WXVL_AK0751SB0361 [0,1,1,0,0,0|2,0,0]=4 85 B13R0.66 CSCCC(=O)NCCCCCCO WXVL_AK0751SB0361 [0,1,1,0,0,0|2,0,0]=4 86 B13R0.88 CCCC(=O)NCCCCCN(C)C WXVL_AK0956SB0073 [0,1,1,0,0,0|2,0,0]=4 87 B13R0.88 CCCC(=O)NCCCCCN(C)C WXVL_AK0956SB0073 [0,1,1,0,0,0|2,0,0]=4 88 B13R0.335 CC(C)CC(=O)NCCCCCCO WXVL_AK0751SB0063 [0,1,1,0,0,0|2,0,0]=4 89 B13R0.335 CC(C)CC(=O)NCCCCCCO WXVL_AK0751SB0063 [0,1,1,0,0,0|2,0,0]=4 90 B13R0.335 CC(O)CC(=O)NCCCCCCO WXVL_AK0751SB3643 [0,1,1,0,0,0|2,0,0]=4 91 B13R0.335 CC(O)CC(=O)NCCCCCCO WXVL_AK0751SB3643 [0,1,1,0,0,0|2,0,0]=4 92 B13R0.335 CCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0409 [0,1,1,0,0,0|2,0,0]=4 93 B13R0.335 CCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0409 [0,1,1,0,0,0|2,0,0]=4 94 B13R0.335 CCCCOCCNC(=O)CC(C)C WXVL_AK9674SB0063 [0,1,1,0,0,0|2,0,0]=4 95 B13R0.335 CCCCOCCNC(=O)CC(C)C WXVL_AK9674SB0063 [0,1,1,0,0,0|2,0,0]=4 96 B13R0.335 CCCCOCCNC(=O)CC(C)O WXVL_AK9674SB3643 [0,1,1,0,0,0|2,0,0]=4 97 B13R0.335 CCCCOCCNC(=O)CC(C)O WXVL_AK9674SB3643 [0,1,1,0,0,0|2,0,0]=4 98 B13R0.340 CCC(C)C(=O)NCCCCCCO WXVL_AK0751SB0054 [0,1,1,0,0,0|2,0,0]=4 99 B13R0.340 CCC(C)C(=O)NCCCCCCO WXVL_AK0751SB0054 [0,1,1,0,0,0|2,0,0]=4 100 B13R0.340 CCCCOCCNC(=O)C(C)CC WXVL_AK9674SB0054 [0,1,1,0,0,0|2,0,0]=4 101 B13R0.340 CCCCOCCNC(=O)C(C)CC WXVL_AK9674SB0054 [0,1,1,0,0,0|2,0,0]=4 102 B13R0.340 CCCCOCCNC(=O)[C@@H](O)CC WXVL_AK9674SB3573 [0,1,1,0,0,0|2,0,0]=4 103 B13R0.340 CCCCOCCNC(=O)[C@@H](O)CC WXVL_AK9674SB3573 [0,1,1,0,0,0|2,0,0]=4 104 B13R0.340 CCCCOCCNC(=O)[C@H](C)CC WXVL_AK9674SB00054 [0,1,1,0,0,0|2,0,0]=4 105 B13R0.340 CCCCOCCNC(=O)[C@H](C)CC WXVL_AK9674SB00054 [0,1,1,0,0,0|2,0,0]=4 106 B13R0.340 CC[C@@H](C)C(=O)NCCCCCCO WXVL_AK0751SB00054 [0,1,1,0,0,0|2,0,0]=4 107 B13R0.340 CC[C@@H](C)C(=O)NCCCCCCO WXVL_AK0751SB00054 [0,1,1,0,0,0|2,0,0]=4 108 B13R0.340 CC[C@H](O)C(=O)NCCCCCCO WXVL_AK0751SB3573 [0,1,1,0,0,0|2,0,0]=4 109 B13R0.340 CC[C@H](O)C(=O)NCCCCCCO WXVL_AK0751SB3573 [0,1,1,0,0,0|2,0,0]=4 110 B13R0.274 CCCCCCCC(O)CC(=O)NC WXVL_AK00442SB4065 [0,1,1,0,0,0|2,0,0]=4 111 B13R0.274 CCCCCCCC(O)CC(=O)NC WXVL_AK00442SB4065 [0,1,1,0,0,0|2,0,0]=4 112 B13R1.42 CCCC(=O)NCC1CCCCO1 WXVL_AK1232SB0073 [0,0,1,1,0,0|2,0,0]=4 113 B13R1.42 CCCC(=O)NCC1CCCCO1 WXVL_AK1232SB0073 [0,0,1,1,0,0|2,0,0]=4 114 B13R1.42 CCCC(=O)NCC1CCCOC1 WXVL_AK00150SB0073 [0,0,1,1,0,0|2,0,0]=4 115 B13R1.42 CCCC(=O)NCC1CCCOC1 WXVL_AK00150SB0073 [0,0,1,1,0,0|2,0,0]=4 116 B13R1.42 CCCC(=O)NCC1CCOCC1 WXVL_AK0150SB0073 [0,0,1,1,0,0|2,0,0]=4 117 B13R1.42 CCCC(=O)NCC1CCOCC1 WXVL_AK0150SB0073 [0,0,1,1,0,0|2,0,0]=4 118 B13R1.42 CCCC(=O)NCC1CCSCC1 WXVL_AK00654SB0073 [0,0,1,1,0,0|2,0,0]=4 119 B13R1.42 CCCC(=O)NCC1CCSCC1 WXVL_AK00654SB0073 [0,0,1,1,0,0|2,0,0]=4 120 B13R1.42 CCNC(=O)CCC1CCCCC1 WXVL_AK00476SB0049 [0,0,1,1,0,0|2,0,0]=4 121 B13R1.42 CCNC(=O)CCC1CCCCC1 WXVL_AK00476SB0049 [0,0,1,1,0,0|2,0,0]=4 122 B13R1.404 CCCC(=O)NCCC1CCCC1 WXVL_AK00531SB0073 [0,0,1,1,0,0|1,0,0]=3 123 B13R1.404 CCCC(=O)NCCC1CCCC1 WXVL_AK00531SB0073 [0,0,1,1,0,0|1,0,0]=3 124 B13R1.404 COCC(=O)NCCC1CCCC1 WXVL_AK00531SB0090 [0,0,1,1,0,0|2,0,0]=4 125 B13R1.404 COCC(=O)NCCC1CCCC1 WXVL_AK00531SB0090 [0,0,1,1,0,0|2,0,0]=4 126 B13R1.404 CSCC(=O)NCCC1CCCC1 WXVL_AK00531SB1267 [0,0,1,1,0,0|2,0,0]=4 127 B13R1.404 CSCC(=O)NCCC1CCCC1 WXVL_AK00531SB1267 [0,0,1,1,0,0|2,0,0]=4 128 B13R1.464 CCCC(=O)N1CCCCC1CO WXVL_AN0018SB0073 [0,0,1,1,0,0|2,0,0]=4 129 B13R1.464 CCCC(=O)N1CCCCC1CO WXVL_AN0018SB0073 [0,0,1,1,0,0|2,0,0]=4 130 B13R1.3151 CCCCOCCNC(=O)C1CC1 WXVL_AK9674SB0038 [0,0,1,1,0,0|2,0,0]=4 131 B13R1.3151 CCCCOCCNC(=O)C1CC1 WXVL_AK9674SB0038 [0,0,1,1,0,0|2,0,0]=4 132 B13R1.3151 O=C(NCCCCCCO)C1CC1 WXVL_AK0751SB0038 [0,0,1,1,0,0|2,0,0]=4 133 B13R1.3151 O=C(NCCCCCCO)C1CC1 WXVL_AK0751SB0038 [0,0,1,1,0,0|2,0,0]=4 134 B13R1.713 CC(=O)N[C@@H](CO)C1CCCCC1 WXVL_AK00496SB0150 [0,0,1,1,0,0|2,0,0]=4 135 B13R1.713 CC(=O)N[C@@H](CO)C1CCCCC1 WXVL_AK00496SB0150 [0,0,1,1,0,0|2,0,0]=4 136 B13R1.713 CC[C@H](NC(=O)C)C1CCCCC1 WXVL_AK00783SB0150 [0,0,1,1,0,0|1,0,0]=3 137 B13R1.713 CC[C@H](NC(=O)C)C1CCCCC1 WXVL_AK00783SB0150 [0,0,1,1,0,0|1,0,0]=3