0 B11R0.40 CCCCCCCCC(=O)NN 0539AE [0,0,0,0,0,0|2,0,0]=2 1 B11R0.40 CCCCCCCCC(O)CC 6165AL [0,0,0,0,0,0|1,0,2]=3 2 B11R0.40 CCCCCCCC[C@@H](O)CO O013 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.40 CCCCCCCNC(=O)CBr 5387AE [0,0,0,0,0,0|3,0,0]=3 4 B11R0.40 CNC(=O)CCNCCCOC 7938AC [0,0,0,0,0,0|3,0,0]=3 5 B11R0.40 COCCCNCCC(=O)NN 7890AC [0,0,0,0,0,0|4,0,0]=4 6 B11R0.40 COCCCNCCC(=O)OC 4815AE [0,0,0,0,0,0|2,0,0]=2 7 B10R0.4 C=CCCCCCCC(=O)O 0024AE [1,0,0,0,0,0|0,0,2]=3 8 B10R0.4 C=CCCCCCOC(C)=O 6880AL [1,0,0,0,0,0|1,0,2]=4 9 B10R0.4 CCCCCCOCC(=O)O 8556AB [1,0,0,0,0,0|1,0,0]=2 10 B10R0.4 CCCCCC\C=C\C(=O)O 5765AL [1,0,0,0,0,0|0,0,2]=3 11 B10R0.4 CCCCC\C=C\CC(=O)O 6140AL [1,0,0,0,0,0|0,0,2]=3 12 B10R0.4 COCCCNCCC(N)=O 7888AC [1,0,0,0,0,0|3,0,0]=4 13 B10R0.4 O=C(O)CCCCCCCS 0512AQ [1,0,0,0,0,0|1,0,0]=2 14 B10R0.71 C=CCCCCCCCCC 5902AF [1,0,0,0,0,0|1,0,2]=4 15 B10R0.71 CCCCCOCCCCC 5775AF [1,0,0,0,0,0|2,0,1]=4 16 B10R0.71 CCNCCCNCCOC 7929AC [1,0,0,0,0,0|2,0,1]=4 17 B10R0.71 CNCCCNCCCOC 7939AC [1,0,0,0,0,0|2,0,1]=4 18 B10R0.74 CCCCCCCC(=O)CC 5762AF [1,0,0,0,0,0|1,0,0]=2 19 B10R0.74 CNC(=O)CCNCCCO 7931AC [1,0,0,0,0,0|3,0,0]=4 20 B10R0.74 CNC(=O)CCNCCOC 7100AC [1,0,0,0,0,0|3,0,0]=4 21 B10R0.74 COC(=O)CCNCCCO 8073AC [1,0,0,0,0,0|2,0,0]=3 22 B10R0.74 COCCNCCC(=O)OC 5596AE [1,0,0,0,0,0|2,0,0]=3 23 B12R0.1 CCOC(=O)CCCCCCCCl 1248AA [0,1,0,0,0,0|1,0,0]=2 24 B12R0.1 CCOC(=O)CCNCCCOC 5459AD [0,1,0,0,0,0|2,0,0]=3 25 B12R0.49 CCCCCCCC(=O)N(C)OC 0493AA [0,1,0,0,0,0|2,0,1]=4 26 B12R0.183 COC(=N)CCCCCC(=N)OC 7699AL [0,1,0,0,0,0|2,0,1]=4 27 B12R0.184 COC(=O)CCNCCCN(C)C 2814AF [0,1,0,0,0,0|2,0,0]=3 28 B12R0.248 CCCCCCCCCC(=O)CC 6039AF [0,1,0,0,0,0|1,0,0]=2 29 B12R0.248 CCCCCCCCCC(=O)NN 6928AD [0,1,0,0,0,0|2,0,0]=3 30 B12R0.248 CCCCCCCCNC(=S)NN 3733AD [0,1,0,0,0,0|2,1,0]=4 31 B12R0.251 CCCCCCCCC(F)=C(F)F 8226AE [0,1,0,0,0,0|3,0,0]=4 32 B12R1.27 CCC(=O)OCC1CCCNC1 1932AD [0,0,0,1,0,0|3,0,0]=4 33 B12R1.27 CCC(=O)OCC1CCNCC1 6180AD [0,0,0,1,0,0|3,0,0]=4 34 B12R1.27 COC(=O)COC1CCNCC1 4336AH [0,0,0,1,0,0|2,0,0]=3 35 B12R1.27 NNC(=O)CCC1CCCCC1 0133AF [0,0,0,1,0,0|2,0,0]=3 36 B12R1.27 NNC(=O)CCN1CCCCC1 9386AD [0,0,0,1,0,0|3,0,0]=4 37 B12R1.77 CCC1CCCCN1C(=O)CN 1835AD [0,0,0,1,0,0|3,0,0]=4 38 B12R1.371 COC(=O)CC1CCCCC1=O 6503AA [0,0,0,1,0,0|1,0,1]=3 39 B12R1.410 CNC1CCCCCCCCC1 2563AC [0,0,0,1,0,0|2,0,1]=4 40 B12R1.477 COC(=O)CCNC1CCCC1 W8274 [0,0,0,1,0,0|1,0,0]=2 41 B12R1.477 COC(=O)CCOC1CCNC1 2332AD [0,0,0,1,0,0|2,0,0]=3 42 B12R1.1659 O=C(CCl)N1CCCCCCC1 4328AD [0,0,0,1,0,0|3,0,0]=4 43 B12R1.1748 O=C(CCl)NC1CCCCCC1 7958AD [0,0,0,1,0,0|3,0,0]=4 44 B9R0.2 C=CCCCCCC(=O)O 6293AD [2,0,0,0,0,0|0,0,2]=4 45 B9R0.2 COCCCCCC(=O)O 5735AB [2,0,0,0,0,0|1,0,0]=3 46 B9R0.2 COCCCCOC(C)=O 6564AL [2,0,0,0,0,0|2,0,0]=4 47 B9R0.45 CC#CCCCCCCC 5746AF [2,0,0,0,0,0|0,0,2]=4 48 B9R0.45 CCCCCCCCSC 8241AL [2,0,0,0,0,0|0,1,0]=3 49 B9R0.45 CCCCCCCC[Mg]Br 8938AJ [2,0,0,0,0,0|2,0,0]=4 50 B9R0.45 CCCCCCCNCC P111 [2,0,0,0,0,0|1,0,1]=4 51 B9R0.45 CCCCNCCCCO 3911AE [2,0,0,0,0,0|1,0,1]=4 52 B9R0.45 CNCCCNCCOC 7927AC [2,0,0,0,0,0|2,0,0]=4 53 B9R0.45 C\C=C/CCCCCCC 7421AL [2,0,0,0,0,0|0,0,1]=3 54 B9R0.45 O=CCCCCCCC=O 4439AJ [2,0,0,0,0,0|1,0,1]=4 55 B9R0.46 C=CCCCCC(=O)OC 0116AQ [2,0,0,0,0,0|0,0,2]=4 56 B9R0.46 CCCNCCC(=O)NC 7922AC [2,0,0,0,0,0|2,0,0]=4 57 B9R0.46 CCCNCCC(=O)OC 4406AE [2,0,0,0,0,0|1,0,0]=3 58 B11R0.30 C=C(C)CCCCCOC(C)=O 8902AE [1,1,0,0,0,0|1,0,1]=4 59 B11R0.30 CC(=O)CCCCCCC(C)=O 8396AA [1,1,0,0,0,0|0,0,1]=3 60 B11R0.30 CC(C)CCCCCCC(=O)O X8438 [1,1,0,0,0,0|0,0,0]=2 61 B11R0.30 CC(C)\C=C\CCCCC(=O)O X8437 [1,1,0,0,0,0|0,0,2]=4 62 B11R0.42 C=CCCCCC[C@H](N)C(=O)O 5617AC [1,1,0,0,0,0|0,0,2]=4 63 B11R0.42 CCCCCCCC(N)C(=O)O 7857AB [1,1,0,0,0,0|0,0,0]=2 64 B11R0.46 CCCCCC(C)CCC(=O)O 6213AB [1,1,0,0,0,0|0,0,0]=2 65 B11R0.147 CCCCC(=O)CCCC(=O)O 1675AE [1,1,0,0,0,0|0,0,1]=3 66 B11R0.148 C=CCCCCCCOC(C)=O 6898AL [1,1,0,0,0,0|0,0,2]=4 67 B11R0.148 CCCCCCCCCC(N)=O 7564AL [1,1,0,0,0,0|1,0,0]=3 68 B11R0.148 CCCCCCCCOC(=O)Cl 7369AL [1,1,0,0,0,0|1,0,0]=3 69 B11R0.148 CCCCCCC\C=C/C(=O)O Z1707 [1,1,0,0,0,0|0,0,1]=3 70 B11R0.148 CCCCCC\C=C\CC(=O)O 6032AL [1,1,0,0,0,0|0,0,1]=3 71 B11R0.3 CCC\C=C\CCCCCCC Y0126 [1,1,0,0,0,0|1,0,1]=4 72 B11R0.3 CCNCCCCCCNCC 8428AL [1,1,0,0,0,0|2,0,0]=4 73 B11R0.3 CCNCCCNCCCOC 7940AC [1,1,0,0,0,0|1,0,1]=4 74 B11R0.4 CCCCCCCC(O)CCC 6706AL [1,1,0,0,0,0|1,0,1]=4 75 B13R0.2 CCCCCCCCNC(=O)CC#N 2440AE [0,2,0,0,0,0|1,0,1]=4 76 B13R0.2 CCCCCCC\C=C\C(=O)OCC 7894AL [0,2,0,0,0,0|0,0,1]=3 77 B13R0.66 C=CCOC(=O)CCCCCCCC 7033AL [0,2,0,0,0,0|0,0,0]=2 78 B13R0.88 C=C(C)CCCCCCC(=O)OCC 4193AE [0,2,0,0,0,0|0,0,1]=3 79 B13R0.335 CCCCCCCOC(=O)CC(C)=O 8020AL [0,2,0,0,0,0|2,0,0]=4 80 B11R1.53 CCN1CCCCC1C(=O)O 4707AH [1,0,0,1,0,0|1,0,0]=3 81 B11R1.53 CCN1CCCCC1C(=O)O 4708AH [1,0,0,1,0,0|1,0,0]=3 82 B11R1.53 NC(=O)[C@H]1CCCC[C@@H]1CO 2662AA [1,0,0,1,0,0|2,0,0]=4 83 B11R1.86 CC(=O)CC1CCCCN1C W1084 [1,0,0,1,0,0|1,0,0]=3 84 B11R1.86 CC1CCCCN1CC(=O)O 0553AD [1,0,0,1,0,0|1,0,0]=3 85 B11R1.86 CC1CCCCN1CC(=O)O 0823AF [1,0,0,1,0,0|1,0,0]=3 86 B11R1.86 CN1CCCCC1CC(=O)O 6616AE [1,0,0,1,0,0|1,0,0]=3 87 B11R1.91 CC(=O)NCC1CCNCC1 8556AE [1,0,0,1,0,0|2,0,0]=4 88 B11R1.91 CC(=O)OCC1CCCNC1 1664AD [1,0,0,1,0,0|2,0,0]=4 89 B11R1.91 CC(=O)OCC1CCNCC1 6179AD [1,0,0,1,0,0|2,0,0]=4 90 B11R1.91 NC(=O)COC1CCCCC1 5271AJ [1,0,0,1,0,0|2,0,0]=4 91 B11R1.91 O=C(O)CCC1CCCCN1 6959AC [1,0,0,1,0,0|1,0,0]=3 92 B11R1.91 O=C(O)CCC1CCCNC1 9554AA [1,0,0,1,0,0|1,0,0]=3 93 B11R1.91 O=C(O)CCC1OCCCO1 9605AE [1,0,0,1,0,0|2,0,0]=4 94 B11R1.91 O=C(O)CCN1CCCCO1 0335AD [1,0,0,1,0,0|2,0,0]=4 95 B11R1.91 O=C(O)COC1CCNCC1 4439AD [1,0,0,1,0,0|2,0,0]=4 96 B11R1.91 OB(O)CCC1CCCCC1 Y6936 [1,0,0,1,0,0|1,0,1]=4 97 B11R1.101 O=C1CCCCCCCCC1 7516AA [1,0,0,1,0,0|0,0,0]=2 98 B11R1.172 NC(=O)CCNC1CCCC1 6502AD [1,0,0,1,0,0|2,0,0]=4 99 B11R1.172 O=C(O)CCCN1CCCC1 X2079 [1,0,0,1,0,0|1,0,0]=3 100 B11R1.742 CC(=O)CN1CCCCCC1 9642AC [1,0,0,1,0,0|1,0,0]=3 101 B11R1.28 CCCCCC1CCCCC1 8653AL [1,0,0,1,0,0|1,0,1]=4 102 B11R1.1 CCCCC1CCC(=O)CC1 W7348 [1,0,0,1,0,0|1,0,0]=3 103 B11R1.25 COC(=O)CCC1CCCC1 3543AL [1,0,0,1,0,0|0,0,0]=2 104 B11R1.25 COC(=O)CNC1CCCC1 W4169 [1,0,0,1,0,0|1,0,0]=3 105 B11R1.40 CNC(=O)CC1CCNCC1 8495AE [1,0,0,1,0,0|2,0,0]=4 106 B11R1.40 COC(=O)CC1CCNCC1 W3680 [1,0,0,1,0,0|1,0,0]=3 107 B11R1.40 COC(=O)CC1CNCCO1 4208AJ [1,0,0,1,0,0|2,0,0]=4 108 B11R1.40 COC(=O)CC1CNCCO1 6437AB [1,0,0,1,0,0|2,0,0]=4 109 B11R1.40 NNC(=O)CC1CCCCC1 8982AD [1,0,0,1,0,0|2,0,0]=4 110 B11R1.222 COC(=O)C1CNCCN1C 5495AB [1,0,0,1,0,0|2,0,0]=4 111 B11R1.852 COC(=O)C1CCCCNC1 0226AB [1,0,0,1,0,0|1,0,0]=3 112 B11R1.852 COC(=O)C1CCCNCC1 Y6046 [1,0,0,1,0,0|1,0,0]=3 113 B11R1.852 COC(=O)C1CNCCCO1 6958AJ [1,0,0,1,0,0|2,0,0]=4 114 B13R1.42 CCOC(=O)CCC1OCCCO1 0953AF [0,1,0,1,0,0|2,0,0]=4 115 B13R1.42 COCC(=O)OCC1CCCNC1 1689AD [0,1,0,1,0,0|2,0,0]=4 116 B13R1.42 COCC(=O)OCC1CCNCC1 1691AD [0,1,0,1,0,0|2,0,0]=4 117 B13R1.279 O=C1CCCCCCCCCCO1 1381AQ [0,1,0,1,0,0|0,0,0]=2 118 B13R1.404 CCOC(=O)CCNC1CCCC1 3486AF [0,1,0,1,0,0|1,0,0]=3 119 B13R1.464 CCC1CCCCN1C(=O)CCN 2188AD [0,1,0,1,0,0|2,0,0]=4 120 B13R1.464 CCC1CCCCN1C(=O)CNC 2175AD [0,1,0,1,0,0|2,0,0]=4 121 B13R1.464 CCOC(=O)N1CCCCC1CO 0660AB [0,1,0,1,0,0|2,0,0]=4 122 B13R1.1575 CCOC(=O)C=C1CCCCCC1 3418AL [0,1,0,1,0,0|0,0,2]=4 123 B13R1.1575 CCOC(=O)CN1CCCCCC1 4677AF [0,1,0,1,0,0|1,0,0]=3 124 B13R1.135 COC(=O)C(N)CC1CCOCC1 3283AA [0,1,0,1,0,0|1,0,0]=3 125 B13R1.718 CCC(=O)OCCC1CCCCN1 1953AD [0,1,0,1,0,0|2,0,0]=4 126 B13R1.718 CCC(=O)OCCC1CCCNC1 2355AD [0,1,0,1,0,0|2,0,0]=4 127 B13R1.718 CCC(=O)OCCC1CCNCC1 6182AD [0,1,0,1,0,0|2,0,0]=4 128 B13R1.718 COC(=O)CCCN1CCCCC1 0778AA [0,1,0,1,0,0|0,0,0]=2 129 B13R1.718 COC(=O)CCCN1CCSCC1 7082AJ [0,1,0,1,0,0|1,0,0]=3 130 B13R1.718 COC(=O)CCNC1CCCCC1 7797AD [0,1,0,1,0,0|0,0,0]=2 131 B13R1.718 COC(=O)CCOC1CCCNC1 1676AD [0,1,0,1,0,0|1,0,0]=3 132 B13R1.547 COC(=O)[C@@H]1CCCC[C@H]1C(=O)O 6789AC [0,1,0,1,0,0|1,0,1]=4 133 B13R1.547 COC(=O)[C@H]1CCCC[C@@H]1C(=O)O 8342AD [0,1,0,1,0,0|1,0,1]=4 134 B13R1.536 CNC(=O)CCNCC1CCCO1 7914AC [0,1,0,1,0,0|2,0,0]=4 135 B13R1.536 COC(=O)CCNCC1CCCO1 7898AC [0,1,0,1,0,0|1,0,0]=3 136 B13R1.536 COC(=O)CCOCC1CCNC1 1795AD [0,1,0,1,0,0|1,0,0]=3 137 B13R1.89 CCC1CCCCN1C(=O)C(C)N 2844AD [0,1,0,1,0,0|2,0,0]=4 138 B13R2.5037 O=C1CCC2(CCCCC2)CC1 9848AA [0,0,0,2,0,0|1,0,0]=3