0 B8R0.7 C=CCCCCB(O)O N890 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.7 C=CCCCCB(O)O Z7102 [0,0,0,0,0,0|2,0,2]=4 2 B8R0.7 CC(=O)NCCCCN 8335AL [0,0,0,0,0,0|2,0,2]=4 3 B8R0.7 CC(=O)OCCCCBr 7492AF [0,0,0,0,0,0|2,0,2]=4 4 B8R0.7 CCCCCCC(=O)[O-] 7832AL [0,0,0,0,0,0|1,0,2]=3 5 B8R0.7 CCCCCCC(C)O Z6063 [0,0,0,0,0,0|0,0,0]=0 6 B8R0.7 CCCC\C=C\C(C)=O 6146AL [0,0,0,0,0,0|0,0,4]=4 7 B8R0.7 NC(=O)CCCCCBr 8542AB [0,0,0,0,0,0|2,0,2]=4 8 B8R0.7 NCCCCCC(=O)O 5982AB [0,0,0,0,0,0|2,0,1]=3 9 B8R0.7 NCCCNCC(=O)O 8332AL [0,0,0,0,0,0|3,0,1]=4 10 B8R0.7 O=C(Cl)CCCCCBr 5957AH [0,0,0,0,0,0|2,0,2]=4 11 B7R0.1 CCCC#CCCC 7932AF [1,0,0,0,0,0|0,0,2]=3 12 B7R0.1 CCCC#CCCO 5337AH [1,0,0,0,0,0|0,0,2]=3 13 B7R0.1 CCCCC#CCO V0602 [1,0,0,0,0,0|0,0,2]=3 14 B7R0.1 CCCCCCOC 8052AL [1,0,0,0,0,0|1,0,0]=2 15 B7R0.1 CCCCCOC=O 7518AF [1,0,0,0,0,0|1,0,2]=4 16 B7R0.1 CCCCSCCO 5039AL [1,0,0,0,0,0|1,0,0]=2 17 B7R0.1 CCCNCCCN 1645AB [1,0,0,0,0,0|2,0,0]=3 18 B7R0.1 CCC\C=C/CCC 7451AL [1,0,0,0,0,0|0,0,2]=3 19 B7R0.1 CCNCCCCO 2370AE [1,0,0,0,0,0|1,0,0]=2 20 B7R0.1 CC\C=C/CCCO 7447AL [1,0,0,0,0,0|0,0,2]=3 21 B7R0.1 CNCCCCNC 8068AA [1,0,0,0,0,0|2,0,0]=3 22 B7R0.1 NCCCNCCN M698 [1,0,0,0,0,0|3,0,0]=4 23 B7R0.1 NCCCNCCO 6154AB [1,0,0,0,0,0|2,0,0]=3 24 B7R0.1 NCCNCCCO 8334AL [1,0,0,0,0,0|2,0,0]=3 25 B7R0.1 OCCNNCCO 1925AB [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 CC(=O)CCCCCl D718 [1,0,0,0,0,0|1,0,2]=4 27 B7R0.4 CC(C)NCCCO 0839AE [1,0,0,0,0,0|3,0,0]=4 28 B7R0.4 CCC#CCC(C)O 6519AL [1,0,0,0,0,0|0,0,2]=3 29 B7R0.4 CCCCSC(C)=O 3195AL [1,0,0,0,0,0|1,0,2]=4 30 B7R0.4 CCCOCC(=O)O 5344AE [1,0,0,0,0,0|2,0,1]=4 31 B7R0.4 CNCCCC(=O)O 2115AA [1,0,0,0,0,0|2,0,1]=4 32 B7R0.4 COCCCC(=O)O 2917AB [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 NCCCCC(=O)O 9495AB [1,0,0,0,0,0|2,0,1]=4 34 B7R0.4 OB(O)CCCCBr X0904 [1,0,0,0,0,0|3,0,0]=4 35 B9R0.1 CCC(=O)CCCC(=O)O 1673AE [0,1,0,0,0,0|1,0,2]=4 36 B9R0.1 CCC(C)CCOC(C)=O 6119AL [0,1,0,0,0,0|1,0,2]=4 37 B9R0.1 CCC(C)OCCC(C)=O 6681AL [0,1,0,0,0,0|1,0,2]=4 38 B9R0.2 CC(C)NCCCCCN 5224AD [0,1,0,0,0,0|2,0,0]=3 39 B9R0.2 CC(C)NCCCCCO 6718AL [0,1,0,0,0,0|2,0,0]=3 40 B9R0.2 CCCCCCCB(O)O Y5025 [0,1,0,0,0,0|2,0,0]=3 41 B9R0.2 CCCCCCCC(C)C 5737AL [0,1,0,0,0,0|1,0,0]=2 42 B9R0.2 CCCCCCCC(N)=O 7980AF [0,1,0,0,0,0|1,0,2]=4 43 B9R0.2 CCCCCCC[13C](=O)O 8956AJ [0,1,0,0,0,0|1,0,1]=3 44 B9R0.2 CCCCCCOC(C)=O 7968AF [0,1,0,0,0,0|0,0,2]=3 45 B9R0.2 COCCOCCC(=O)O X3859 [0,1,0,0,0,0|2,0,1]=4 46 B9R0.2 C\C=C\CCCCB(O)O N891 [0,1,0,0,0,0|2,0,1]=4 47 B9R0.2 NCCCCCCC(=O)O X4768 [0,1,0,0,0,0|1,0,1]=3 48 B9R0.4 CSCC[C@H](N)CC(=O)O Z5847 [0,1,0,0,0,0|2,0,1]=4 49 B9R0.38 CCCCCC[N+](C)(C)C Z3300 [0,1,0,0,0,0|2,0,0]=3 50 B9R0.46 CCCCCCC(=O)NN 7657AD [0,1,0,0,0,0|1,0,2]=4 51 B9R0.46 CCCCCCC(O)CC 6139AL [0,1,0,0,0,0|0,0,0]=1 52 B9R0.46 COC(=O)CCCCCO 6266AB [0,1,0,0,0,0|1,0,2]=4 53 B9R0.47 CCCCCC(N)C(=O)O 2079AA [0,1,0,0,0,0|1,0,1]=3 54 B9R0.47 CCCCC[C@@H](N)C(=O)O 6195AB [0,1,0,0,0,0|1,0,1]=3 55 B9R0.47 CCCCOC(=O)[C@H](C)N W5153 [0,1,0,0,0,0|2,0,1]=4 56 B9R0.47 CCSCC[C@@H](N)C(=O)O C618 [0,1,0,0,0,0|2,0,1]=4 57 B9R0.47 NCCCCC(N)C(=O)O 8604AJ [0,1,0,0,0,0|2,0,1]=4 58 B9R0.47 NCCCC[C@H](N)C(=O)O 9230AB [0,1,0,0,0,0|2,0,1]=4 59 B9R0.48 CCOC(=O)CCC(C)C 6706AH [0,1,0,0,0,0|2,0,1]=4 60 B9R0.55 CC(=O)CCOCC(C)C 6549AL [0,1,0,0,0,0|1,0,2]=4 61 B9R0.55 CC(C)CCCCC(=O)O 5715AC [0,1,0,0,0,0|1,0,1]=3 62 B9R0.55 CN(C)CCCCC(=O)O 6277AJ [0,1,0,0,0,0|2,0,1]=4 63 B9R1.2 CCC1CCCC(=O)C1 7677AD [0,0,0,1,0,0|0,0,2]=3 64 B9R1.2 CN1CCCC(CN)C1 W3191 [0,0,0,1,0,0|3,0,0]=4 65 B9R1.2 CN1CCC[C@@H](CO)C1 2915AH [0,0,0,1,0,0|3,0,0]=4 66 B9R1.2 CN1CCC[C@H](CO)C1 2962AH [0,0,0,1,0,0|3,0,0]=4 67 B9R1.2 NCC1CCCC(O)C1 2722AA [0,0,0,1,0,0|1,0,0]=2 68 B9R1.6 CC(=O)C1CCNCC1 W9267 [0,0,0,1,0,0|1,0,2]=4 69 B9R1.6 CC(C)[C@@H]1COCCN1 1580AC [0,0,0,1,0,0|3,0,0]=4 70 B9R1.6 CC(O)C1CCCCC1 3320AA [0,0,0,1,0,0|0,0,0]=1 71 B9R1.6 FC(F)C1CCNCC1 2519AJ [0,0,0,1,0,0|3,0,0]=4 72 B9R1.6 O=C(O)C1CCCCO1 Y9295 [0,0,0,1,0,0|2,0,1]=4 73 B9R1.6 O=C(O)C1CCCOC1 W8958 [0,0,0,1,0,0|2,0,1]=4 74 B9R1.6 O=C(O)C1CCNCC1 W7261 [0,0,0,1,0,0|2,0,1]=4 75 B9R1.6 O=C(O)C1CCSCC1 W9239 [0,0,0,1,0,0|2,0,1]=4 76 B9R1.6 O=C(O)[C@@H]1CCCCN1 W4435 [0,0,0,1,0,0|2,0,1]=4 77 B9R1.6 O=C(O)[C@@H]1CCCNC1 W9119 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.6 O=C(O)[C@H]1CCCNC1 3193AC [0,0,0,1,0,0|2,0,1]=4 79 B9R1.6 O=C(O)[C@H]1CCCNC1 C833 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.7 NCCN1CC[C@H](O)C1 W6844 [0,0,0,1,0,0|2,0,0]=3 81 B9R1.13 CN(C)CC1CCNC1 7098AD [0,0,0,1,0,0|3,0,0]=4 82 B9R1.13 O=C(O)CC1CCCC1 2161AA [0,0,0,1,0,0|1,0,1]=3 83 B9R1.13 O=C(O)CC1CCCN1 X4013 [0,0,0,1,0,0|2,0,1]=4 84 B9R1.13 O=C(O)CC1CCOC1 W3025 [0,0,0,1,0,0|2,0,1]=4 85 B9R1.13 O=C(O)CN1CCCC1 0183AC [0,0,0,1,0,0|2,0,1]=4 86 B9R1.13 O=C(O)CN1CCCC1 Y8903 [0,0,0,1,0,0|2,0,1]=4 87 B9R1.13 O=C(O)C[C@@H]1CCCN1 M616 [0,0,0,1,0,0|2,0,1]=4 88 B9R1.13 O=C(O)C[C@H]1CCCN1 6072AB [0,0,0,1,0,0|2,0,1]=4 89 B9R1.13 O=C(O)C[C@H]1CCCN1 9054AH [0,0,0,1,0,0|2,0,1]=4 90 B9R1.41 CN1CCC[C@@H]1C(=O)O V7386 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.41 CN1CCC[C@H]1C(=O)O 1661AL [0,0,0,1,0,0|2,0,1]=4 92 B9R1.41 NC1CCCC1C(=O)O 3422AA [0,0,0,1,0,0|2,0,1]=4 93 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 9632AA [0,0,0,1,0,0|2,0,1]=4 94 B9R1.50 OC1CCCCCCC1 7963AF [0,0,0,1,0,0|0,0,0]=1 95 B9R1.85 O=C(O)CSCC1CC1 4499AF [0,0,0,1,0,0|2,0,1]=4 96 B6R0.6 CCC#CCCO 5338AH [2,0,0,0,0,0|0,0,2]=4 97 B6R0.6 CCCC#CCO V0624 [2,0,0,0,0,0|0,0,2]=4 98 B6R0.6 CCCCSCC 7568AF [2,0,0,0,0,0|1,0,0]=3 99 B6R0.6 CCCNCCO 8316AA [2,0,0,0,0,0|1,0,0]=3 100 B6R0.6 CNCCCCO 5794AB [2,0,0,0,0,0|1,0,0]=3 101 B6R0.6 C\C=C/CCCO 7448AL [2,0,0,0,0,0|0,0,2]=4 102 B6R0.6 SCCCCCS 7344AF [2,0,0,0,0,0|1,1,0]=4 103 B6R0.4 CC(Br)CCCBr 9465AB [2,0,0,0,0,0|2,0,0]=4 104 B6R0.4 CC(O)CCCO 1536AL [2,0,0,0,0,0|1,0,0]=3 105 B6R0.4 CCCSC(C)C 8111AL [2,0,0,0,0,0|2,0,0]=4 106 B8R0.1 CCCCC(O)CCC 7995AF [1,1,0,0,0,0|0,0,0]=2 107 B8R0.1 CCCCN(C)CCCl 9577AC [1,1,0,0,0,0|2,0,0]=4 108 B8R0.1 CCCOC(=O)CCC 9026AJ [1,1,0,0,0,0|1,0,1]=4 109 B8R0.4 CCCCCCCCF V6056 [1,1,0,0,0,0|0,0,0]=2 110 B8R0.4 CCCCCCON=O 8053AL [1,1,0,0,0,0|1,0,1]=4 111 B8R0.4 CCCCCOCCO 6511AH [1,1,0,0,0,0|0,0,0]=2 112 B8R0.4 CCCCNCCC#N 8245AE [1,1,0,0,0,0|1,0,1]=4 113 B8R0.4 CCCCNCCCC W7485 [1,1,0,0,0,0|0,0,0]=2 114 B8R0.4 CCCCOCCCN P793 [1,1,0,0,0,0|1,0,0]=3 115 B8R0.4 CCCC\C=C/CCO 7442AL [1,1,0,0,0,0|0,0,1]=3 116 B8R0.4 CC\C=C/CCCCO 7454AL [1,1,0,0,0,0|0,0,1]=3 117 B8R0.4 ClCCCCCCCBr 4782AL [1,1,0,0,0,0|1,0,0]=3 118 B8R0.4 N#CCCCCCCBr L877 [1,1,0,0,0,0|1,0,1]=4 119 B8R0.6 C#CC(O)CCCCC X7103 [1,1,0,0,0,0|0,0,2]=4 120 B8R0.6 C#CC(O)CCCCC X7104 [1,1,0,0,0,0|0,0,2]=4 121 B8R0.6 CCCCCC(=O)CC 6144AL [1,1,0,0,0,0|0,0,1]=3 122 B8R0.6 CCCCNC(=O)CC 8516AL [1,1,0,0,0,0|1,0,1]=4 123 B8R0.6 OCCCCC(O)CO X6223 [1,1,0,0,0,0|1,0,0]=3 124 B8R0.8 CCCCC(C)C(C)=O 1634AB [1,1,0,0,0,0|0,0,2]=4 125 B8R0.8 CCCCC(O)C(=O)O 3592AH [1,1,0,0,0,0|1,0,1]=4 126 B8R0.8 CCCOC(=O)C(C)O 8130AL [1,1,0,0,0,0|1,0,1]=4 127 B8R0.28 CC(=O)CCCC(C)C 5697AC [1,1,0,0,0,0|0,0,2]=4 128 B8R0.28 CC(C)CCCC(C)O 6866AL [1,1,0,0,0,0|0,0,0]=2 129 B8R0.28 CC(C)COCC(C)C 7669AL [1,1,0,0,0,0|2,0,0]=4 130 B10R0.3 CCCC(=O)CCCC(=O)O 1674AE [0,2,0,0,0,0|1,0,1]=4 131 B10R0.4 CC(C)CCCCCCCO 0582AC [0,2,0,0,0,0|1,0,0]=3 132 B10R0.4 CCCCCCCCC(C)C Z5044 [0,2,0,0,0,0|1,0,0]=3 133 B10R0.4 CCCCCCCCC(C)O 5773AF [0,2,0,0,0,0|0,0,0]=2 134 B10R0.4 CCCCCC\C=C\C(C)=O 2414AL [0,2,0,0,0,0|0,0,2]=4 135 B10R0.22 CCCCCCOS(C)(=O)=O 8051AL [0,2,0,0,0,0|1,0,1]=4 136 B10R0.74 C=CC(O)CCCCCCC U552 [0,2,0,0,0,0|0,0,1]=3 137 B10R0.74 CCCCCCCC(O)CC 6031AL [0,2,0,0,0,0|0,0,0]=2 138 B10R0.74 CCCCCCCC(O)CO 4474AL [0,2,0,0,0,0|0,0,0]=2 139 B10R0.74 COC(=O)CCCCCCBr W6840 [0,2,0,0,0,0|0,0,2]=4 140 B10R0.74 COC(=O)CCCCCCN W3908 [0,2,0,0,0,0|0,0,2]=4 141 B10R0.75 CCCCCCC(O)C(=O)O 7972AF [0,2,0,0,0,0|0,0,1]=3 142 B10R0.75 CCCCCC[C@@H](N)C(=O)O 1467AA [0,2,0,0,0,0|1,0,0]=3 143 B10R0.75 CNCCCC[C@H](N)C(=O)O Z5971 [0,2,0,0,0,0|1,0,1]=4 144 B10R0.97 CC(=O)CCCCCC(=O)O X3704 [0,2,0,0,0,0|1,0,1]=4 145 B10R0.1 CCCCCCC(=O)CCC 9409AB [0,2,0,0,0,0|0,0,2]=4 146 B10R0.1 CCCCCCC(C)N=C=S 8314AE [0,2,0,0,0,0|0,1,0]=3 147 B10R0.83 CCCCCC(=O)N(C)OC 9830AB [0,2,0,0,0,0|1,0,1]=4 148 B10R0.105 CCCC(C)(O)CCC(C)C 5774AF [0,2,0,0,0,0|1,0,0]=3 149 B8R1.2 BrCC1CCNCC1 Z2771 [1,0,0,1,0,0|2,0,0]=4 150 B8R1.2 CCC1CCCCC1 8567AA [1,0,0,1,0,0|0,0,0]=2 151 B8R1.2 CCC1CCNCC1 0192AE [1,0,0,1,0,0|1,0,0]=3 152 B8R1.2 CCC1CNCCO1 V6407 [1,0,0,1,0,0|1,0,0]=3 153 B8R1.2 CC[C@H]1COCCN1 1076AB [1,0,0,1,0,0|2,0,0]=4 154 B8R1.2 CNC1CCOCC1 5124AB [1,0,0,1,0,0|2,0,0]=4 155 B8R1.2 CNC1CCOCC1 W4553 [1,0,0,1,0,0|2,0,0]=4 156 B8R1.2 COC1CCNCC1 V5785 [1,0,0,1,0,0|2,0,0]=4 157 B8R1.2 FCC1CCCNC1 2978AD [1,0,0,1,0,0|2,0,0]=4 158 B8R1.2 ICC1CCCCC1 4784AJ [1,0,0,1,0,0|1,0,0]=3 159 B8R1.2 ICC1CCOCC1 Y6802 [1,0,0,1,0,0|2,0,0]=4 160 B8R1.2 NCC1CCCCO1 V7179 [1,0,0,1,0,0|1,0,0]=3 161 B8R1.2 NCC1CCCNC1 U802 [1,0,0,1,0,0|2,0,0]=4 162 B8R1.2 NC[C@H]1COCCO1 8566AH [1,0,0,1,0,0|2,0,0]=4 163 B8R1.2 NNC1CCCCC1 3658AF [1,0,0,1,0,0|2,0,0]=4 164 B8R1.2 OCC1CCNCC1 5626AH [1,0,0,1,0,0|1,0,0]=3 165 B8R1.2 OCC1CCSCC1 Y6767 [1,0,0,1,0,0|1,0,0]=3 166 B8R1.2 OCC1CNCCO1 W3143 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.2 OCC1CNCCO1 X8636 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.2 OCC1COCCN1 1479AA [1,0,0,1,0,0|2,0,0]=4 169 B8R1.2 OCC1COCCN1 6468AC [1,0,0,1,0,0|2,0,0]=4 170 B8R1.2 OC[C@@H]1CNCCO1 X9792 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.2 ONC1CCCCC1 1210AB [1,0,0,1,0,0|1,0,0]=3 172 B8R1.2 [C-]#[N+]C1CCCCC1 M219 [1,0,0,1,0,0|1,0,1]=4 173 B8R1.2 [C@@H]1(CC)COCCN1 9533AF [1,0,0,1,0,0|2,0,0]=4 174 B8R1.5 BrC1CCCCC1Br Y5040 [1,0,0,1,0,0|2,0,0]=4 175 B8R1.5 Br[C@H]1CCCC[C@@H]1Br 9187AL [1,0,0,1,0,0|2,0,0]=4 176 B8R1.5 CC1CNCCN1C 9602AH [1,0,0,1,0,0|2,0,0]=4 177 B8R1.5 CC1COCCC1O 2365AJ [1,0,0,1,0,0|1,0,0]=3 178 B8R1.5 C[C@H]1CNCCN1C 6630AB [1,0,0,1,0,0|2,0,0]=4 179 B8R1.5 C[C@H]1CNCCN1C 9092AH [1,0,0,1,0,0|2,0,0]=4 180 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl 9188AL [1,0,0,1,0,0|2,0,0]=4 181 B8R1.5 N[C@@H]1CCCC[C@@H]1O W4237 [1,0,0,1,0,0|1,0,0]=3 182 B8R1.5 N[C@H]1CCCC[C@@H]1N E396 [1,0,0,1,0,0|2,0,0]=4 183 B8R1.5 N[C@H]1CCCC[C@@H]1O B566 [1,0,0,1,0,0|1,0,0]=3 184 B8R1.5 N[C@H]1CCCC[C@H]1O 0705AC [1,0,0,1,0,0|1,0,0]=3 185 B8R1.5 N[C@H]1CCCC[C@H]1O X3115 [1,0,0,1,0,0|1,0,0]=3 186 B8R1.5 OC1CCCCC1Cl 7832AA [1,0,0,1,0,0|1,0,0]=3 187 B8R1.8 CNCC1CCCO1 7539AF [1,0,0,1,0,0|1,0,0]=3 188 B8R1.8 COCC1CCCN1 V2776 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.8 COCC1CCCN1 Y4051 [1,0,0,1,0,0|2,0,0]=4 190 B8R1.8 COC[C@H]1CCCN1 8959AH [1,0,0,1,0,0|2,0,0]=4 191 B8R1.8 N#CCC1CCCC1 5870AE [1,0,0,1,0,0|1,0,1]=4 192 B8R1.8 NCCC1CCCC1 W7101 [1,0,0,1,0,0|1,0,0]=3 193 B8R1.8 NCCC1CCCC1 Z5033 [1,0,0,1,0,0|1,0,0]=3 194 B8R1.11 CCC1CCCC1=O 6742AB [1,0,0,1,0,0|0,0,2]=4 195 B8R1.11 CN1CCCC1CN X2049 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.22 BrC1CCCCCC1 1727AB [1,0,0,1,0,0|1,0,0]=3 197 B8R1.22 NC1CCCCNC1 3820AJ [1,0,0,1,0,0|2,0,0]=4 198 B8R1.49 C1=CCCCCCC1 R645 [1,0,0,1,0,0|0,0,2]=4 199 B8R1.49 C1=CCCCCCC1 Z3117 [1,0,0,1,0,0|0,0,2]=4 200 B8R1.49 [CH]1[CH]CCCCCC1 8468AJ [1,0,0,1,0,0|0,0,2]=4 201 B8R1.1 CCN1CCC(O)C1 3250AB [1,0,0,1,0,0|1,0,0]=3 202 B8R1.4 CC1CC(O)CCO1 1817AJ [1,0,0,1,0,0|1,0,0]=3 203 B8R1.4 CC1CCCC(C)C1 4569AL [1,0,0,1,0,0|1,0,0]=3 204 B8R1.4 CN1CCCC(N)C1 W9236 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.4 CN1CCC[C@@H](N)C1 8666AH [1,0,0,1,0,0|2,0,0]=4 206 B8R1.4 CN1CCC[C@@H](N)C1 8990AH [1,0,0,1,0,0|2,0,0]=4 207 B8R1.4 C[C@H]1CCC[C@@H](C)N1 9437AE [1,0,0,1,0,0|1,0,0]=3 208 B8R1.4 C[C@H]1COC[C@H](C)N1 W3372 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.4 NC1CCCC(N)C1 V5282 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.4 NC1CCCC(O)C1 2142AJ [1,0,0,1,0,0|1,0,0]=3 211 B8R1.4 NC1CCCC(O)C1 W7861 [1,0,0,1,0,0|1,0,0]=3 212 B8R1.34 O=C(O)CC1CCC1 W7672 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.35 O=C(O)CCC1CC1 8214AB [1,0,0,1,0,0|1,0,1]=4 214 B8R1.72 CC1(C)CCCNC1 Y8537 [1,0,0,1,0,0|2,0,0]=4 215 B8R1.72 CC1(C)CCNCC1 Z4691 [1,0,0,1,0,0|2,0,0]=4 216 B8R1.72 CC1(Cl)CCCCC1 3529AF [1,0,0,1,0,0|1,0,0]=3 217 B8R1.72 CC1(N)CCCCC1 9931AH [1,0,0,1,0,0|1,0,0]=3 218 B8R1.72 CC1(N)CCOCC1 0694AC [1,0,0,1,0,0|2,0,0]=4 219 B8R1.72 CC1(N)CCOCC1 W8790 [1,0,0,1,0,0|2,0,0]=4 220 B8R1.72 CC1(O)CCCNC1 4087AE [1,0,0,1,0,0|1,0,0]=3 221 B8R1.72 CC1(O)CCNCC1 5226AB [1,0,0,1,0,0|1,0,0]=3 222 B8R1.72 CC1(O)CCOCC1 W8268 [1,0,0,1,0,0|1,0,0]=3 223 B10R1.13 CC(C)C1CCC(=O)CC1 7826AB [0,1,0,1,0,0|1,0,1]=4 224 B10R1.13 CC(C)C1CCC(O)CC1 6357AB [0,1,0,1,0,0|1,0,0]=3 225 B10R1.13 NC1CCC(C(=O)O)CC1 0769AF [0,1,0,1,0,0|1,0,1]=4 226 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 X0367 [0,1,0,1,0,0|1,0,1]=4 227 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 X2034 [0,1,0,1,0,0|1,0,1]=4 228 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 3218AL [0,1,0,1,0,0|1,0,1]=4 229 B10R1.10 CCCC1CCCC(=O)O1 R377 [0,1,0,1,0,0|1,0,1]=4 230 B10R1.10 CCNC1CCCN(C)C1 6818AJ [0,1,0,1,0,0|2,0,0]=4 231 B10R1.16 CCNCC1CCN(C)C1 4485AF [0,1,0,1,0,0|2,0,0]=4 232 B10R1.18 CC(C)CN1CCNCC1 O185 [0,1,0,1,0,0|2,0,0]=4 233 B10R1.18 CC(N)CN1CCOCC1 4556AE [0,1,0,1,0,0|2,0,0]=4 234 B10R1.18 O=C(O)CC1CCCNC1 V7579 [0,1,0,1,0,0|1,0,1]=4 235 B10R1.18 O=C(O)CC1CCCNC1 W8079 [0,1,0,1,0,0|1,0,1]=4 236 B10R1.18 O=C(O)CC1CCNCC1 N549 [0,1,0,1,0,0|1,0,1]=4 237 B10R1.18 O=C(O)CN1CCCCC1 0202AE [0,1,0,1,0,0|1,0,1]=4 238 B10R1.18 OB(O)CC1CCCCC1 X0676 [0,1,0,1,0,0|2,0,0]=4 239 B10R1.61 CC(C)N1CCNCC1C 9897AH [0,1,0,1,0,0|2,0,0]=4 240 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1N W5390 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1N 4803AC [0,1,0,1,0,0|2,0,0]=4 242 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 1036AL [0,1,0,1,0,0|1,0,1]=4 243 B10R1.66 O=C(O)CCN1CCCC1 1858AC [0,1,0,1,0,0|1,0,1]=4 244 B10R1.66 O=C(O)COC1CCCC1 5276AJ [0,1,0,1,0,0|1,0,1]=4 245 B10R1.78 O=C1CCCCCCCC1 3914AB [0,1,0,1,0,0|0,0,2]=4 246 B10R1.348 O=C(O)C1CCCCCN1 7360AB [0,1,0,1,0,0|1,0,1]=4 247 B10R1.28 CC(C)(C)C1CCNCC1 0772AC [0,1,0,1,0,0|2,0,0]=4 248 B10R1.95 CC1(C)OCC(CCO)O1 8479AB [0,1,0,1,0,0|2,0,0]=4 249 B10R1.1 CCCC1CCC(O)CC1 7346AB [0,1,0,1,0,0|0,0,0]=2 250 B10R1.1 CCCN1CCC(N)CC1 V5893 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.1 CCC[C@H]1CC[C@H](O)CC1 9234AL [0,1,0,1,0,0|0,0,0]=2 252 B10R1.1 NC1CCC(CCO)CC1 5011AL [0,1,0,1,0,0|2,0,0]=4 253 B10R1.1 NCCN1CCC(O)CC1 4505AH [0,1,0,1,0,0|2,0,0]=4 254 B10R1.1 NCCN1CCC(O)CC1 8725AC [0,1,0,1,0,0|2,0,0]=4 255 B10R1.15 CCC(=O)C1CCCCC1 2177AA [0,1,0,1,0,0|0,0,2]=4 256 B10R1.15 N[C@H](CO)C1CCCCC1 2997AC [0,1,0,1,0,0|1,0,0]=3 257 B10R1.15 O=C(CBr)C1CCCCC1 W6993 [0,1,0,1,0,0|0,0,2]=4 258 B10R1.15 OCC(O)C1CCCCN1 7450AB [0,1,0,1,0,0|1,0,0]=3 259 B10R1.113 CC1CCCC(C(=O)O)N1 W9881 [0,1,0,1,0,0|1,0,1]=4 260 B10R1.113 NC1CCCC(C(=O)O)C1 5989AL [0,1,0,1,0,0|1,0,1]=4 261 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 4020AL [0,1,0,1,0,0|1,0,1]=4 262 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 8462AA [0,1,0,1,0,0|1,0,1]=4 263 B10R1.113 O=C(O)C1CCCC(O)C1 6064AL [0,1,0,1,0,0|1,0,1]=4 264 B10R1.204 N[C@H](CC1CCC1)C(=O)O 9009AA [0,1,0,1,0,0|1,0,1]=4 265 B10R1.363 O=C(O)C1(O)CCCCC1 2168AA [0,1,0,1,0,0|1,0,1]=4 266 B10R1.140 CCOC(=O)C1CC(O)C1 Y6088 [0,1,0,1,0,0|1,0,1]=4 267 B10R2.62 C12CCC(CC1)C(=O)O2 5773AL [0,0,0,2,0,0|1,0,1]=4 268 B10R2.62 N[C@H]1CN2CCC1CC2 8665AH [0,0,0,2,0,0|2,0,0]=4 269 B10R2.196 BrC1(Br)C2CCCCC21 1171AQ [0,0,0,2,0,0|2,0,0]=4 270 B10R2.196 ClC1(Cl)C2CCCCC21 2733AC [0,0,0,2,0,0|2,0,0]=4 271 B10R2.18 C1=CCCC2OC2CC1 V7053 [0,0,0,2,0,0|0,0,2]=4