0 B8R0.6 C=CC(=O)CC=CCC CNP0046682.0 [0,0,0,0,0,0|0,0,4]=4 1 B8R0.6 C=CC(=O)CCCCC CNP0297364.0 [0,0,0,0,0,0|0,0,2]=2 2 B8R0.6 C=CC(=O)OCCCC CNP0191898.0 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.6 C=CC(O)CCC=CC CNP0288913.0 [0,0,0,0,0,0|0,0,2]=2 4 B8R0.6 C=CCCCC(=C)C=C CNP0546296.0 [0,0,0,0,0,0|1,0,3]=4 5 B8R0.6 C=CCCC[C@H](O)C=C CNP0223839.1 [0,0,0,0,0,0|0,0,2]=2 6 B8R0.6 C=C[C@@H](O)/C=C/CCC CNP0182495.1 [0,0,0,0,0,0|0,0,2]=2 7 B8R0.6 C=C[C@@H](O)C/C=C/CC CNP0227768.1 [0,0,0,0,0,0|0,0,2]=2 8 B8R0.6 C=C[C@@H](O)C/C=C\CC CNP0227768.2 [0,0,0,0,0,0|0,0,2]=2 9 B8R0.6 C=C[C@@H](O)CCCCC CNP0246419.1 [0,0,0,0,0,0|0,0,0]=0 10 B8R0.6 C=C[C@H](O)C/C=C/CC CNP0227768.4 [0,0,0,0,0,0|0,0,2]=2 11 B8R0.6 C=C[C@H](O)C/C=C\CC CNP0227768.3 [0,0,0,0,0,0|0,0,2]=2 12 B8R0.6 C=C[C@H](O)CCCCC CNP0246419.2 [0,0,0,0,0,0|0,0,0]=0 13 B8R0.6 CC=C(O)CCCCC CNP0174345.0 [0,0,0,0,0,0|0,0,2]=2 14 B8R0.6 CCCCC=C(C)C=O CNP0586407.0 [0,0,0,0,0,0|2,0,2]=4 15 B8R0.6 CCCCCC(=NO)C CNP0241223.0 [0,0,0,0,0,0|3,0,1]=4 16 B8R0.6 CCCCCC(=O)CC CNP0381627.0 [0,0,0,0,0,0|0,0,4]=4 17 B8R0.6 CCCCCC(=O)CO CNP0546319.0 [0,0,0,0,0,0|1,0,3]=4 18 B8R0.6 CCCCCC(=O)OC CNP0192346.0 [0,0,0,0,0,0|1,0,3]=4 19 B8R0.6 CCCCCC(=O)SC CNP0018085.0 [0,0,0,0,0,0|1,0,3]=4 20 B8R0.6 CCCCCC(S)SC CNP0002612.0 [0,0,0,0,0,0|1,1,1]=3 21 B8R0.6 CCCCC[C@@H](O)CC CNP0204116.1 [0,0,0,0,0,0|0,0,2]=2 22 B8R0.6 CCCCC[C@H](C)CC CNP0121781.1 [0,0,0,0,0,0|1,0,2]=3 23 B8R0.6 CCCCC[C@H](O)CC CNP0204116.2 [0,0,0,0,0,0|0,0,2]=2 24 B8R0.6 CCCCC[C@H](O)CO CNP0528306.1 [0,0,0,0,0,0|1,0,1]=2 25 B8R0.6 CCCCO[C@H](C)OC CNP0139681.1 [0,0,0,0,0,0|3,0,1]=4 26 B8R0.6 CC[C@@H](C)CCCCO CNP0076966.2 [0,0,0,0,0,0|2,0,2]=4 27 B8R0.6 CC[C@H](C)CCCCO CNP0076966.1 [0,0,0,0,0,0|2,0,2]=4 28 B8R0.6 NCCCCC(N)C=O CNP0581320.0 [0,0,0,0,0,0|3,0,0]=3 29 B7R0.1 C=CC=CCCCC CNP0084214.0 [1,0,0,0,0,0|0,0,2]=3 30 B7R0.1 C=CCCCC=CC CNP0076717.0 [1,0,0,0,0,0|0,0,2]=3 31 B7R0.1 C=CCCCCC=C CNP0118215.0 [1,0,0,0,0,0|0,0,2]=3 32 B7R0.1 C=CCCCCCC CNP0246919.0 [1,0,0,0,0,0|0,0,0]=1 33 B7R0.1 C=CCCCCCO CNP0075956.0 [1,0,0,0,0,0|1,0,0]=2 34 B7R0.1 C=CCCCN=C=S CNP0144953.0 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.1 C=CCSSCCC CNP0170059.0 [1,0,0,0,0,0|2,0,0]=3 36 B7R0.1 CC=CCCCCC CNP0199237.0 [1,0,0,0,0,0|0,0,2]=3 37 B7R0.1 CC=CCSCCC CNP0536250.0 [1,0,0,0,0,0|1,0,2]=4 38 B7R0.1 CCC=CCCC=O CNP0265888.0 [1,0,0,0,0,0|1,0,2]=4 39 B7R0.1 CCCC=CCC=O CNP0201799.0 [1,0,0,0,0,0|1,0,2]=4 40 B7R0.1 CCCCC=CC=O CNP0210810.0 [1,0,0,0,0,0|1,0,2]=4 41 B7R0.1 CCCCCCC#N CNP0186663.0 [1,0,0,0,0,0|1,0,1]=3 42 B7R0.1 CCCCCCC=O CNP0243745.0 [1,0,0,0,0,0|1,0,0]=2 43 B7R0.1 CCCCCCCC CNP0286567.0 [1,0,0,0,0,0|0,0,2]=3 44 B7R0.1 CCCCCCCN CNP0186919.0 [1,0,0,0,0,0|1,0,1]=3 45 B7R0.1 CCCCCCCO CNP0329737.0 [1,0,0,0,0,0|1,0,1]=3 46 B7R0.1 CCCCCCNC CNP0413437.0 [1,0,0,0,0,0|1,0,1]=3 47 B7R0.1 CCCCCN=C=S CNP0391667.0 [1,0,0,0,0,0|2,0,1]=4 48 B7R0.1 CCCCCOC=O CNP0294368.0 [1,0,0,0,0,0|2,0,0]=3 49 B7R0.1 CCCCCOCC CNP0520137.0 [1,0,0,0,0,0|1,0,2]=4 50 B7R0.1 CCCCCON=O CNP0511882.0 [1,0,0,0,0,0|3,0,0]=4 51 B7R0.1 CCCCCSSC CNP0201479.0 [1,0,0,0,0,0|2,0,1]=4 52 B7R0.1 CCCCN=CC=S CNP0423600.0 [1,0,0,0,0,0|2,0,1]=4 53 B7R0.1 CCCCNCCO CNP0185911.0 [1,0,0,0,0,0|2,0,1]=4 54 B7R0.1 CCCCOCCO CNP0080154.0 [1,0,0,0,0,0|2,0,1]=4 55 B7R0.1 CCCC[N+]=CC=S CNP0578229.0 [1,0,0,0,0,0|2,0,1]=4 56 B7R0.1 CCNCCCCN CNP0107714.0 [1,0,0,0,0,0|2,0,1]=4 57 B7R0.1 CNCCCCCN CNP0390055.0 [1,0,0,0,0,0|2,0,1]=4 58 B7R0.1 CNCCCCNC CNP0145070.0 [1,0,0,0,0,0|2,0,1]=4 59 B7R0.1 CSCCCCC#N CNP0183103.0 [1,0,0,0,0,0|2,0,1]=4 60 B7R0.1 NCCCCCCN CNP0230906.0 [1,0,0,0,0,0|2,0,1]=4 61 B7R0.1 NCCCCCCO CNP0568466.0 [1,0,0,0,0,0|2,0,1]=4 62 B7R0.1 NCCCCCNO CNP0455910.0 [1,0,0,0,0,0|3,0,0]=4 63 B7R0.1 OCCCCCCBr CNP0593386.0 [1,0,0,0,0,0|2,0,1]=4 64 B7R0.1 OCCCCCCO CNP0080019.0 [1,0,0,0,0,0|2,0,1]=4 65 B7R0.1 OCCCCCCS CNP0154751.0 [1,0,0,0,0,0|2,0,1]=4 66 B7R0.1 SCCCCCCS CNP0089642.0 [1,0,0,0,0,0|2,0,1]=4 67 B7R0.1 [CH2-]CCCCCC#[O+] CNP0489135.0 [1,0,0,0,0,0|1,0,2]=4 68 B7R0.3 C=C(C=O)CCCC CNP0555185.0 [1,0,0,0,0,0|2,0,1]=4 69 B7R0.3 C=CC(=CCCC)C CNP0605951.0 [1,0,0,0,0,0|1,0,2]=4 70 B7R0.3 C=CC(=O)CCCC CNP0083902.0 [1,0,0,0,0,0|0,0,2]=3 71 B7R0.3 C=CC(C)CCCC CNP0354372.0 [1,0,0,0,0,0|1,0,0]=2 72 B7R0.3 C=CC(Cl)CCCC CNP0275370.0 [1,0,0,0,0,0|1,0,0]=2 73 B7R0.3 C=C[C@@H](O)CSC#N CNP0229436.1 [1,0,0,0,0,0|2,0,1]=4 74 B7R0.3 C=C[C@H](O)CCCC CNP0076908.1 [1,0,0,0,0,0|0,0,0]=1 75 B7R0.3 CCCCC(C)CO CNP0563062.0 [1,0,0,0,0,0|2,0,1]=4 76 B7R0.3 CCCCC(O)CO CNP0481107.0 [1,0,0,0,0,0|1,0,1]=3 77 B7R0.3 CCCC[C@@H](C)C=O CNP0315338.1 [1,0,0,0,0,0|2,0,0]=3 78 B7R0.3 CCCC[C@@H](C)CC CNP0161853.2 [1,0,0,0,0,0|1,0,2]=4 79 B7R0.3 CCCC[C@H](C)CC CNP0161853.1 [1,0,0,0,0,0|1,0,2]=4 80 B7R0.3 CCCC[C@H](C)CO CNP0563062.1 [1,0,0,0,0,0|2,0,1]=4 81 B7R0.3 CCCC[C@H](N)C=O CNP0526620.1 [1,0,0,0,0,0|2,0,0]=3 82 B7R0.3 CCCC[C@H](O)CC CNP0102609.1 [1,0,0,0,0,0|0,0,2]=3 83 B7R0.4 C=C(O)CCCCC CNP0475201.0 [1,0,0,0,0,0|0,0,1]=2 84 B7R0.4 CC(C)CCCCO CNP0497904.0 [1,0,0,0,0,0|2,0,1]=4 85 B7R0.4 CC(O)CCCCO CNP0285438.0 [1,0,0,0,0,0|1,0,1]=3 86 B7R0.4 CC/C=C/C[C@H](C)O CNP0273661.3 [1,0,0,0,0,0|0,0,3]=4 87 B7R0.4 CC/C=C\C[C@@H](C)O CNP0273661.2 [1,0,0,0,0,0|0,0,3]=4 88 B7R0.4 CC/C=C\C[C@H](C)O CNP0273661.1 [1,0,0,0,0,0|0,0,3]=4 89 B7R0.4 CCCCCC(=O)C CNP0240774.0 [1,0,0,0,0,0|0,0,3]=4 90 B7R0.4 CCCCCC(=O)N CNP0077222.0 [1,0,0,0,0,0|1,0,2]=4 91 B7R0.4 CCCCCC(=O)O CNP0210437.0 [1,0,0,0,0,0|1,0,1]=3 92 B7R0.4 CCCCCC(=S)O CNP0092443.0 [1,0,0,0,0,0|1,0,1]=3 93 B7R0.4 CCCCCC(C)C CNP0146536.0 [1,0,0,0,0,0|1,0,1]=3 94 B7R0.4 CCCCC[14C](=O)O CNP0563421.0 [1,0,0,0,0,0|1,0,1]=3 95 B7R0.4 CCCCC[C@@H](C)N CNP0336832.2 [1,0,0,0,0,0|1,0,1]=3 96 B7R0.4 CCCCC[C@@H](C)O CNP0256316.1 [1,0,0,0,0,0|0,0,1]=2 97 B7R0.4 CCCCC[C@@H](C)S CNP0076785.2 [1,0,0,0,0,0|0,1,1]=3 98 B7R0.4 CCCCC[C@H](C)N CNP0336832.1 [1,0,0,0,0,0|1,0,1]=3 99 B7R0.4 CCCCC[C@H](C)O CNP0256316.2 [1,0,0,0,0,0|0,0,1]=2 100 B7R0.4 CCCCC[C@H](C)S CNP0076785.1 [1,0,0,0,0,0|0,1,1]=3 101 B7R0.4 CCCNCC(C)C CNP0333564.0 [1,0,0,0,0,0|2,0,1]=4 102 B7R0.4 CCCSCC(C)C CNP0116113.0 [1,0,0,0,0,0|2,0,1]=4 103 B7R0.4 CCNCCC(C)C CNP0184897.0 [1,0,0,0,0,0|2,0,1]=4 104 B7R0.4 CCOCCC(=O)O CNP0566237.0 [1,0,0,0,0,0|2,0,1]=4 105 B7R0.4 CCOCCC(C)C CNP0032749.0 [1,0,0,0,0,0|2,0,1]=4 106 B7R0.4 CNCCCC(=O)O CNP0216187.0 [1,0,0,0,0,0|2,0,1]=4 107 B7R0.4 NCCCCC(=O)O CNP0167970.0 [1,0,0,0,0,0|2,0,1]=4 108 B7R0.4 O=C(O)CCCCO CNP0601188.0 [1,0,0,0,0,0|2,0,1]=4 109 B7R0.4 [CH2]CCCCC(C)C CNP0488090.0 [1,0,0,0,0,0|1,0,2]=4 110 B9R0.1 C=CC(=C)CCCC(=C)C CNP0388953.0 [0,1,0,0,0,0|1,0,2]=4 111 B9R0.1 C=CC(=CCCC(C)C)C CNP0227262.0 [0,1,0,0,0,0|1,0,2]=4 112 B9R0.1 C=CC(C)CCCC(C)C CNP0584628.0 [0,1,0,0,0,0|1,0,0]=2 113 B9R0.1 C=C[C@@H](C)CCC=C(C)C CNP0168256.2 [0,1,0,0,0,0|1,0,2]=4 114 B9R0.1 C=C[C@@H](C)CCCC(=C)C CNP0304623.1 [0,1,0,0,0,0|1,0,1]=3 115 B9R0.1 C=C[C@H](C)CCC=C(C)C CNP0168256.1 [0,1,0,0,0,0|1,0,2]=4 116 B9R0.1 CC(C)CCC[C@@H](C)C=O CNP0422099.2 [0,1,0,0,0,0|2,0,0]=3 117 B9R0.1 CC(C)CCC[C@@H](C)CO CNP0195092.1 [0,1,0,0,0,0|2,0,1]=4 118 B9R0.1 CC(C)CCC[C@H](C)C=O CNP0422099.1 [0,1,0,0,0,0|2,0,0]=3 119 B9R0.1 CC(C)CCC[C@H](C)CO CNP0195092.2 [0,1,0,0,0,0|2,0,1]=4 120 B9R0.1 CCC(C)CCCC(C)O CNP0205205.0 [0,1,0,0,0,0|1,0,2]=4 121 B9R0.1 CC[C@H](C)CCCC(C)C CNP0308857.1 [0,1,0,0,0,0|1,0,2]=4 122 B9R0.5 C/C=C/[S@@+]([O-])SCCCC CNP0553305.1 [0,1,0,0,0,0|2,0,1]=4 123 B9R0.5 C/C=C/[S@@H+]([O-])SCCCC CNP0479452.1 [0,1,0,0,0,0|2,0,1]=4 124 B9R0.5 C=CCC(=O)CCCCC CNP0108996.0 [0,1,0,0,0,0|0,0,2]=3 125 B9R0.5 C=CCC(O)CCCCC CNP0609867.0 [0,1,0,0,0,0|0,0,0]=1 126 B9R0.5 C=COC(=O)CCCCC CNP0521245.0 [0,1,0,0,0,0|0,0,2]=3 127 B9R0.5 CC=CC(=O)CCCCC CNP0176491.0 [0,1,0,0,0,0|0,0,2]=3 128 B9R0.5 CC=CC(=O)OCCCC CNP0017670.0 [0,1,0,0,0,0|1,0,2]=4 129 B9R0.5 CCCCC[C@@H](C)CC=O CNP0044104.1 [0,1,0,0,0,0|1,0,1]=3 130 B9R0.5 CCCCC[C@H](C)CC=O CNP0044104.2 [0,1,0,0,0,0|1,0,1]=3 131 B9R0.5 CCCCC[C@H](C)CCC CNP0345469.1 [0,1,0,0,0,0|1,0,2]=4 132 B9R0.5 CCCCC[C@H](C)NC=O CNP0539161.1 [0,1,0,0,0,0|2,0,0]=3 133 B9R0.5 CCCCC[C@H](O)/C=C/I CNP0530671.1 [0,1,0,0,0,0|0,0,0]=1 134 B9R0.5 CCCCC[C@H](O)CCC CNP0294811.1 [0,1,0,0,0,0|0,0,2]=3 135 B9R0.5 CCCCC[C@H](O)CCO CNP0370820.1 [0,1,0,0,0,0|0,0,2]=3 136 B9R0.8 CCCCC(C)C(C)CC CNP0516887.0 [0,1,0,0,0,0|1,0,2]=4 137 B9R0.8 CCCC[C@@H](O)[C@H](C)CC CNP0267749.1 [0,1,0,0,0,0|1,0,2]=4 138 B9R0.8 CCCC[C@@H](O)[C@H](O)CO CNP0487375.1 [0,1,0,0,0,0|1,0,1]=3 139 B9R0.8 CCCC[C@H](O)[C@@H](C)CC CNP0267749.2 [0,1,0,0,0,0|1,0,2]=4 140 B9R0.20 CCCCCC(C)(C)CC CNP0233685.0 [0,1,0,0,0,0|1,0,2]=4 141 B9R0.24 CCC(C)CCC(C)CC CNP0597985.0 [0,1,0,0,0,0|1,0,2]=4 142 B9R0.34 C=C[C@H](O)CC(=O)/C=C/C CNP0207948.1 [0,1,0,0,0,0|0,0,3]=4 143 B9R0.34 CCCC(C)CC(C)CC CNP0083059.0 [0,1,0,0,0,0|1,0,2]=4 144 B9R0.46 C=CC(=O)CCCCCC CNP0199222.0 [0,1,0,0,0,0|0,0,2]=3 145 B9R0.46 C=CC(=O)OCCOCC CNP0523688.0 [0,1,0,0,0,0|1,0,2]=4 146 B9R0.46 C=C[C@@H](O)CCCCCC CNP0310616.2 [0,1,0,0,0,0|0,0,0]=1 147 B9R0.46 C=C[C@@H](O)CCCCCO CNP0167960.1 [0,1,0,0,0,0|0,0,0]=1 148 B9R0.46 C=C[C@H](O)CCCCCC CNP0310616.1 [0,1,0,0,0,0|0,0,0]=1 149 B9R0.46 C=C[C@H](O)CCCCCO CNP0167960.2 [0,1,0,0,0,0|0,0,0]=1 150 B9R0.46 CCCC#CCC(O)CC CNP0082068.0 [0,1,0,0,0,0|0,0,3]=4 151 B9R0.46 CCCCCC=C(C)C=O CNP0094185.0 [0,1,0,0,0,0|2,0,1]=4 152 B9R0.46 CCCCCCC(C)C=O CNP0003353.0 [0,1,0,0,0,0|2,0,0]=3 153 B9R0.46 CCCCCCC(C)CO CNP0611666.0 [0,1,0,0,0,0|2,0,1]=4 154 B9R0.46 CCCCCCC(C)NN CNP0592321.0 [0,1,0,0,0,0|3,0,0]=4 155 B9R0.46 CCCCCC[C@@H](C)CC CNP0315749.1 [0,1,0,0,0,0|1,0,2]=4 156 B9R0.46 CCCCCC[C@@H](O)CC CNP0164339.1 [0,1,0,0,0,0|0,0,2]=3 157 B9R0.46 CCCCCC[C@@H](O)CO CNP0150758.1 [0,1,0,0,0,0|1,0,1]=3 158 B9R0.46 CCCCCC[C@H](C)OC CNP0198435.1 [0,1,0,0,0,0|2,0,1]=4 159 B9R0.46 CCCCCC[C@H](O)CC CNP0164339.2 [0,1,0,0,0,0|0,0,2]=3 160 B9R0.46 CCCCCO[C@H](C)OC CNP0289301.1 [0,1,0,0,0,0|2,0,1]=4 161 B9R0.46 CCCSSC[C@H](N)C=O CNP0579506.1 [0,1,0,0,0,0|3,0,0]=4 162 B9R0.46 CC[C@H](C)CCCCCO CNP0220176.1 [0,1,0,0,0,0|1,0,2]=4 163 B9R0.47 C=C(C)C(=O)OCCCC CNP0245815.0 [0,1,0,0,0,0|1,0,2]=4 164 B9R0.47 C=C(CCCCC)C(=O)C CNP0237498.0 [0,1,0,0,0,0|1,0,2]=4 165 B9R0.47 CCCCCC(=O)C(=O)C CNP0172779.0 [0,1,0,0,0,0|0,0,3]=4 166 B9R0.47 CCCCCC(C)C(C)O CNP0111334.0 [0,1,0,0,0,0|1,0,2]=4 167 B9R0.47 CCCCC[C@@H](C)C(=O)O CNP0262834.1 [0,1,0,0,0,0|2,0,0]=3 168 B9R0.47 CCCCC[C@@H](N)C(=O)O CNP0193634.1 [0,1,0,0,0,0|2,0,0]=3 169 B9R0.47 CCCCC[C@@H](O)C(=O)C CNP0254836.1 [0,1,0,0,0,0|0,0,1]=2 170 B9R0.47 CCCCC[C@@H](O)C(=O)O CNP0135339.2 [0,1,0,0,0,0|1,0,0]=2 171 B9R0.47 CCCCC[C@H](N)C(=O)O CNP0193634.2 [0,1,0,0,0,0|2,0,0]=3 172 B9R0.47 CCCCC[C@H](O)C(=O)O CNP0135339.1 [0,1,0,0,0,0|1,0,0]=2 173 B9R0.47 CCCCC[C@H](O)C(Br)Br CNP0017667.1 [0,1,0,0,0,0|1,0,1]=3 174 B9R0.47 CCCCC[C@H](O)[C@@H](C)O CNP0205782.2 [0,1,0,0,0,0|0,0,2]=3 175 B9R0.47 CCCCC[C@H](O)[C@H](C)O CNP0205782.1 [0,1,0,0,0,0|0,0,2]=3 176 B9R0.47 CCCSC[C@H](N)C(=O)O CNP0231801.1 [0,1,0,0,0,0|3,0,0]=4 177 B9R0.47 CCNCC[C@H](N)C(=O)O CNP0373665.1 [0,1,0,0,0,0|3,0,0]=4 178 B9R0.47 CCOCC[C@H](N)C(=O)O CNP0109857.1 [0,1,0,0,0,0|3,0,0]=4 179 B9R0.47 CCSCC[C@@H](N)C(=O)O CNP0415767.2 [0,1,0,0,0,0|3,0,0]=4 180 B9R0.47 CCSCC[C@H](N)C(=O)O CNP0415767.1 [0,1,0,0,0,0|3,0,0]=4 181 B9R0.47 CC[Se]CCC(N)C(=O)O CNP0076033.0 [0,1,0,0,0,0|3,0,0]=4 182 B9R0.47 CNCCC[C@H](N)C(=O)O CNP0022631.1 [0,1,0,0,0,0|3,0,0]=4 183 B9R0.47 CSCCC[C@@H](N)C(=O)O CNP0165905.2 [0,1,0,0,0,0|3,0,0]=4 184 B9R0.47 CSCCC[C@H](N)C(=O)O CNP0165905.1 [0,1,0,0,0,0|3,0,0]=4 185 B9R0.47 NCCCC[C@@H](N)C(=O)O CNP0204700.3 [0,1,0,0,0,0|3,0,0]=4 186 B9R0.47 NCCCC[C@H](N)C(=O)N CNP0386229.1 [0,1,0,0,0,0|3,0,0]=4 187 B9R0.47 NCCCC[C@H](N)C(=O)O CNP0204700.1 [0,1,0,0,0,0|3,0,0]=4 188 B9R0.47 NCC[13CH2]C[C@H](N)C(=O)O CNP0204700.2 [0,1,0,0,0,0|3,0,0]=4 189 B9R0.47 N[C@@H](CCCCO)C(=O)O CNP0105740.1 [0,1,0,0,0,0|3,0,0]=4 190 B9R0.47 N[C@H](CCCCO)C(=O)O CNP0105740.2 [0,1,0,0,0,0|3,0,0]=4 191 B9R0.50 C=CC(CC)CC=CCC CNP0580048.0 [0,1,0,0,0,0|1,0,2]=4 192 B9R0.50 C=CC(CC)CCCCC CNP0538768.0 [0,1,0,0,0,0|1,0,0]=2 193 B9R0.50 C=CC(CCCCC)OO CNP0001521.0 [0,1,0,0,0,0|0,0,0]=1 194 B9R1.1 CC[C@H]1CC=C(CC1)C CNP0192246.1 [0,0,0,1,0,0|1,0,2]=4 195 B9R1.1 CC[C@H]1CC[C@@H](CC1)C CNP0336780.1 [0,0,0,1,0,0|1,0,2]=4 196 B9R1.1 CC[C@H]1CC[C@@H](CC1)O CNP0167936.1 [0,0,0,1,0,0|0,0,2]=3 197 B9R1.1 CC[C@H]1CC[C@H](CC1)O CNP0167936.2 [0,0,0,1,0,0|0,0,2]=3 198 B9R1.1 OC[C@@H]1CC[C@H](CN1)O CNP0271458.1 [0,0,0,1,0,0|2,0,1]=4 199 B9R1.2 CC[C@@H]1CCC[C@@H](C1)C CNP0296187.1 [0,0,0,1,0,0|1,0,2]=4 200 B9R1.2 CO[C@@H]1CCC[C@@H](O1)C CNP0008964.3 [0,0,0,1,0,0|1,0,1]=3 201 B9R1.2 CO[C@@H]1CCC[C@H](O1)C CNP0008964.4 [0,0,0,1,0,0|1,0,1]=3 202 B9R1.2 CO[C@H]1CCC[C@@H](O1)C CNP0008964.1 [0,0,0,1,0,0|1,0,1]=3 203 B9R1.2 CO[C@H]1CCC[C@H](O1)C CNP0008964.2 [0,0,0,1,0,0|1,0,1]=3 204 B9R1.3 CC1CCCC(C1=O)C CNP0612142.0 [0,0,0,1,0,0|2,0,0]=3 205 B9R1.3 CC1CCCC(C1C)O CNP0521321.0 [0,0,0,1,0,0|0,0,2]=3 206 B9R1.3 CC1[C@@H](CCC[C@H]1C)C CNP0315073.2 [0,0,0,1,0,0|1,0,2]=4 207 B9R1.3 C[C@@H]1CCC[C@@H]([C@H]1O)C CNP0252698.1 [0,0,0,1,0,0|2,0,1]=4 208 B9R1.3 C[C@@H]1CCC[C@H](N1C)C CNP0376276.1 [0,0,0,1,0,0|2,0,1]=4 209 B9R1.3 C[C@H]1CCCC(=O)C1=O CNP0208707.1 [0,0,0,1,0,0|1,0,2]=4 210 B9R1.3 C[C@H]1NCC[C@H]([C@@H]1O)O CNP0174732.1 [0,0,0,1,0,0|2,0,1]=4 211 B9R1.3 C[C@H]1[C@@H](CCC[C@@H]1C)C CNP0315073.1 [0,0,0,1,0,0|1,0,2]=4 212 B9R1.5 CC1CCCCCC1=O CNP0489162.0 [0,0,0,1,0,0|2,0,0]=3 213 B9R1.5 C[C@H]1CCCCOC1=O CNP0187217.1 [0,0,0,1,0,0|3,0,0]=4 214 B9R1.5 N[C@H]1CCCCNC1=O CNP0290610.1 [0,0,0,1,0,0|3,0,0]=4 215 B9R1.7 CCC[C@H]1CC[C@H](C1)C CNP0173723.1 [0,0,0,1,0,0|1,0,2]=4 216 B9R1.11 CCC(O)C1CCCC1 CNP0577832.0 [0,0,0,1,0,0|0,0,2]=3 217 B9R1.16 C=CCCCC1CC1=C CNP0302081.0 [0,0,0,1,0,0|1,0,2]=4 218 B9R1.16 CCCCCC1CC1C CNP0611992.0 [0,0,0,1,0,0|1,0,2]=4 219 B9R1.17 CCCCC[C@@H]1CCS1 CNP0189963.1 [0,0,0,1,0,0|0,1,2]=4 220 B9R1.21 CC[C@@H]1CC[C@@H](O1)CC CNP0244835.1 [0,0,0,1,0,0|0,0,2]=3 221 B9R1.21 CC[C@@H]1CC[C@H](O1)CC CNP0244835.2 [0,0,0,1,0,0|0,0,2]=3 222 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO CNP0531735.1 [0,0,0,1,0,0|2,0,1]=4 223 B9R1.50 CC1CCCCCCC1 CNP0421481.0 [0,0,0,1,0,0|1,0,2]=4 224 B9R1.118 CCC1(CCCCC1)C CNP0085951.0 [0,0,0,1,0,0|1,0,2]=4 225 B9R1.132 CC[C@H]1CCC(=O)C1=O CNP0157827.1 [0,0,0,1,0,0|1,0,2]=4 226 B6R0.6 C#CCCCCO CNP0289179.0 [2,0,0,0,0,0|0,0,2]=4 227 B6R0.6 C=CC=CCCC CNP0526826.0 [2,0,0,0,0,0|0,0,2]=4 228 B6R0.6 C=CCCC=CC CNP0426808.0 [2,0,0,0,0,0|0,0,2]=4 229 B6R0.6 C=CCCCC#N CNP0287374.0 [2,0,0,0,0,0|1,0,1]=4 230 B6R0.6 C=CCCCC=C CNP0115869.0 [2,0,0,0,0,0|0,0,2]=4 231 B6R0.6 C=CCCCCC CNP0226691.0 [2,0,0,0,0,0|0,0,0]=2 232 B6R0.6 C=CCCCCO CNP0162421.0 [2,0,0,0,0,0|1,0,0]=3 233 B6R0.6 C=CCOCCO CNP0248950.0 [2,0,0,0,0,0|2,0,0]=4 234 B6R0.6 C=CCSCCC CNP0150756.0 [2,0,0,0,0,0|1,0,0]=3 235 B6R0.6 C=COCCCC CNP0077236.0 [2,0,0,0,0,0|1,0,0]=3 236 B6R0.6 CC#CCCCO CNP0320046.0 [2,0,0,0,0,0|0,0,2]=4 237 B6R0.6 CC=CCCCC CNP0158475.0 [2,0,0,0,0,0|0,0,2]=4 238 B6R0.6 CC=CCCCO CNP0309139.0 [2,0,0,0,0,0|0,0,2]=4 239 B6R0.6 CCC#CCCO CNP0170517.0 [2,0,0,0,0,0|0,0,2]=4 240 B6R0.6 CCC=CCCO CNP0255718.0 [2,0,0,0,0,0|0,0,2]=4 241 B6R0.6 CCCC#CCO CNP0314465.0 [2,0,0,0,0,0|0,0,2]=4 242 B6R0.6 CCCC=CCO CNP0254124.0 [2,0,0,0,0,0|0,0,2]=4 243 B6R0.6 CCCCC=CO CNP0511187.0 [2,0,0,0,0,0|0,0,2]=4 244 B6R0.6 CCCCC=NO CNP0149695.0 [2,0,0,0,0,0|1,0,1]=4 245 B6R0.6 CCCCCC#N CNP0412353.0 [2,0,0,0,0,0|1,0,1]=4 246 B6R0.6 CCCCCC=O CNP0304790.0 [2,0,0,0,0,0|1,0,0]=3 247 B6R0.6 CCCCCCC CNP0290800.0 [2,0,0,0,0,0|0,0,1]=3 248 B6R0.6 CCCCCCN CNP0213933.0 [2,0,0,0,0,0|1,0,0]=3 249 B6R0.6 CCCCCCO CNP0317600.0 [2,0,0,0,0,0|0,0,0]=2 250 B6R0.6 CCCCCCS CNP0167948.0 [2,0,0,0,0,0|0,1,0]=3 251 B6R0.6 CCCCCC[O-] CNP0579903.0 [2,0,0,0,0,0|0,0,1]=3 252 B6R0.6 CCCCCNC CNP0276164.0 [2,0,0,0,0,0|1,0,1]=4 253 B6R0.6 CCCCCOC CNP0358174.0 [2,0,0,0,0,0|1,0,1]=4 254 B6R0.6 CCCCCSC CNP0293012.0 [2,0,0,0,0,0|1,0,1]=4 255 B6R0.6 CCCCCSS CNP0228282.0 [2,0,0,0,0,0|1,1,0]=4 256 B6R0.6 CCCCNC=O CNP0082472.0 [2,0,0,0,0,0|2,0,0]=4 257 B6R0.6 CCCCOC=O CNP0282325.0 [2,0,0,0,0,0|2,0,0]=4 258 B6R0.6 CCCNCCC CNP0129820.0 [2,0,0,0,0,0|1,0,1]=4 259 B6R0.6 CCCOCCO CNP0079853.0 [2,0,0,0,0,0|1,0,0]=3 260 B6R0.6 CCCSCCC CNP0173387.0 [2,0,0,0,0,0|1,0,1]=4 261 B6R0.6 CCOCCCO CNP0304052.0 [2,0,0,0,0,0|1,0,0]=3 262 B6R0.6 CCOCCCS CNP0267296.0 [2,0,0,0,0,0|1,1,0]=4 263 B6R0.6 CCSCCCO CNP0355297.0 [2,0,0,0,0,0|1,0,0]=3 264 B6R0.6 CNCCCCN CNP0157274.0 [2,0,0,0,0,0|2,0,0]=4 265 B6R0.6 COCCCCO CNP0570905.0 [2,0,0,0,0,0|1,0,0]=3 266 B6R0.6 CSCCCC=O CNP0002814.0 [2,0,0,0,0,0|2,0,0]=4 267 B6R0.6 CSCCCCO CNP0002400.0 [2,0,0,0,0,0|1,0,0]=3 268 B6R0.6 NCCCCC=O CNP0083786.0 [2,0,0,0,0,0|2,0,0]=4 269 B6R0.6 NCCCCCN CNP0184259.0 [2,0,0,0,0,0|2,0,0]=4 270 B6R0.6 NCCCCCO CNP0032450.0 [2,0,0,0,0,0|1,0,0]=3 271 B6R0.6 OCCCCCO CNP0201249.0 [2,0,0,0,0,0|1,0,0]=3 272 B6R0.6 OCCNCCO CNP0247543.0 [2,0,0,0,0,0|2,0,0]=4 273 B6R0.6 OCCOCCO CNP0333860.0 [2,0,0,0,0,0|2,0,0]=4 274 B6R0.6 OCCSCCO CNP0335773.0 [2,0,0,0,0,0|2,0,0]=4 275 B6R0.1 C#C[C@@H](O)CCC CNP0226736.1 [2,0,0,0,0,0|0,0,2]=4 276 B6R0.1 C#C[C@H](O)CCC CNP0226736.2 [2,0,0,0,0,0|0,0,2]=4 277 B6R0.1 C=CC(=O)CCC CNP0162905.0 [2,0,0,0,0,0|0,0,2]=4 278 B6R0.1 C=C[C@@H](O)CC#N CNP0276029.1 [2,0,0,0,0,0|1,0,1]=4 279 B6R0.1 C=C[C@H](O)CCC CNP0193104.1 [2,0,0,0,0,0|0,0,0]=2 280 B6R0.1 CCC[C@@H](C)C=O CNP0370387.1 [2,0,0,0,0,0|2,0,0]=4 281 B6R0.1 CCC[C@@H](O)CC CNP0346810.2 [2,0,0,0,0,0|0,0,2]=4 282 B6R0.1 CCC[C@H](O)CC CNP0346810.1 [2,0,0,0,0,0|0,0,2]=4 283 B6R0.4 CCCCB(O)O CNP0482760.0 [2,0,0,0,0,0|2,0,0]=4 284 B6R0.4 CCCCC(=O)O CNP0144818.0 [2,0,0,0,0,0|1,0,1]=4 285 B6R0.4 CCCCC(C)C CNP0312749.0 [2,0,0,0,0,0|1,0,1]=4 286 B6R0.4 CCCC[11C](=O)O CNP0540258.0 [2,0,0,0,0,0|1,0,1]=4 287 B6R0.4 CCCC[C@@H](C)O CNP0276755.1 [2,0,0,0,0,0|0,0,1]=3 288 B6R0.4 CCCC[C@H](C)O CNP0276755.2 [2,0,0,0,0,0|0,0,1]=3 289 B6R0.4 CCOC[C@@H](C)O CNP0076159.1 [2,0,0,0,0,0|1,0,1]=4 290 B6R0.4 CSCC[C@@H](C)O CNP0206291.1 [2,0,0,0,0,0|1,0,1]=4 291 B8R0.1 C=CCC(O)CCCC CNP0566566.0 [1,1,0,0,0,0|0,0,0]=2 292 B8R0.1 C=CCCC(=O)OCC CNP0003358.0 [1,1,0,0,0,0|1,0,1]=4 293 B8R0.1 C=CCC[C@@H](O)CCC CNP0196626.2 [1,1,0,0,0,0|0,0,0]=2 294 B8R0.1 C=CCC[C@H](O)CCC CNP0196626.1 [1,1,0,0,0,0|0,0,0]=2 295 B8R0.1 C=CCOC(=O)CCC CNP0002468.0 [1,1,0,0,0,0|1,0,1]=4 296 B8R0.1 C=CCOS(=S)CCC CNP0539832.0 [1,1,0,0,0,0|2,0,0]=4 297 B8R0.1 C=CCS(=S)OCCC CNP0529420.0 [1,1,0,0,0,0|2,0,0]=4 298 B8R0.1 C=CCS[S+]([O-])CCC CNP0600952.0 [1,1,0,0,0,0|2,0,0]=4 299 B8R0.1 C=CC[S+]([O-])SCCC CNP0550050.0 [1,1,0,0,0,0|2,0,0]=4 300 B8R0.1 CC=CCC(O)CCC CNP0497599.0 [1,1,0,0,0,0|0,0,2]=4 301 B8R0.1 CCCC(S)CCOC CNP0309037.0 [1,1,0,0,0,0|1,0,1]=4 302 B8R0.1 CCCC[C@H](C)CCC CNP0319238.1 [1,1,0,0,0,0|0,0,2]=4 303 B8R0.1 CCCC[C@H](O)CCC CNP0195357.1 [1,1,0,0,0,0|0,0,2]=4 304 B8R0.1 CCC[C@@H](C)CCCO CNP0421179.1 [1,1,0,0,0,0|1,0,1]=4 305 B8R0.1 NCCCC(N)CC=O CNP0515515.0 [1,1,0,0,0,0|2,0,0]=4 306 B8R0.4 C=CC=CCCCCC CNP0389218.0 [1,1,0,0,0,0|0,0,1]=3 307 B8R0.4 C=CCCCCCC=C CNP0320273.0 [1,1,0,0,0,0|0,0,1]=3 308 B8R0.4 C=CCCCCCC=O CNP0184185.0 [1,1,0,0,0,0|0,0,1]=3 309 B8R0.4 C=CCCCCCCC CNP0317850.0 [1,1,0,0,0,0|0,0,0]=2 310 B8R0.4 C=CCCCCCCO CNP0610530.0 [1,1,0,0,0,0|0,0,0]=2 311 B8R0.4 C=CCCCCN=C=S CNP0002692.0 [1,1,0,0,0,0|1,0,1]=4 312 B8R0.4 C=CCSSSCCC CNP0080526.0 [1,1,0,0,0,0|2,0,0]=4 313 B8R0.4 CC#CCCCCCC CNP0610539.0 [1,1,0,0,0,0|0,0,2]=4 314 B8R0.4 CC=C=CCCCCC CNP0555445.0 [1,1,0,0,0,0|0,0,2]=4 315 B8R0.4 CC=CC#CCCCC CNP0343796.0 [1,1,0,0,0,0|0,0,2]=4 316 B8R0.4 CC=CCCCCC=O CNP0181844.0 [1,1,0,0,0,0|1,0,1]=4 317 B8R0.4 CC=CCCCCCC CNP0241269.0 [1,1,0,0,0,0|0,0,0]=2 318 B8R0.4 CC=CCCCCCO CNP0534658.0 [1,1,0,0,0,0|1,0,0]=3 319 B8R0.4 CC=CSSCCCC CNP0612155.0 [1,1,0,0,0,0|2,0,0]=4 320 B8R0.4 CCC=CCCCC=O CNP0002614.0 [1,1,0,0,0,0|1,0,1]=4 321 B8R0.4 CCC=CCCCCC CNP0539420.0 [1,1,0,0,0,0|0,0,2]=4 322 B8R0.4 CCCCC=CCC=O CNP0207183.0 [1,1,0,0,0,0|1,0,1]=4 323 B8R0.4 CCCCCC=CC=O CNP0192932.0 [1,1,0,0,0,0|0,0,1]=3 324 B8R0.4 CCCCCC=CCO CNP0113756.0 [1,1,0,0,0,0|0,0,2]=4 325 B8R0.4 CCCCCCC=CO CNP0605778.0 [1,1,0,0,0,0|0,0,0]=2 326 B8R0.4 CCCCCCC=NO CNP0389770.0 [1,1,0,0,0,0|1,0,0]=3 327 B8R0.4 CCCCCCCC#N CNP0112630.0 [1,1,0,0,0,0|0,0,2]=4 328 B8R0.4 CCCCCCCC=O CNP0146292.0 [1,1,0,0,0,0|0,0,1]=3 329 B8R0.4 CCCCCCCCC CNP0402619.0 [1,1,0,0,0,0|0,0,2]=4 330 B8R0.4 CCCCCCCCN CNP0065900.0 [1,1,0,0,0,0|0,0,2]=4 331 B8R0.4 CCCCCCCCO CNP0368614.0 [1,1,0,0,0,0|0,0,2]=4 332 B8R0.4 CCCCCCCNC CNP0216624.0 [1,1,0,0,0,0|0,0,2]=4 333 B8R0.4 CCCCCCCOO CNP0566054.0 [1,1,0,0,0,0|1,0,1]=4 334 B8R0.4 CCCCCCC[11CH]=O CNP0546456.0 [1,1,0,0,0,0|0,0,1]=3 335 B8R0.4 CCCCCCN=C=S CNP0253332.0 [1,1,0,0,0,0|1,0,1]=4 336 B8R0.4 CCCCCCOC=O CNP0086211.0 [1,1,0,0,0,0|1,0,0]=3 337 B8R0.4 CCCCCCOCC CNP0609034.0 [1,1,0,0,0,0|0,0,2]=4 338 B8R0.4 CCCCCCSSC CNP0510251.0 [1,1,0,0,0,0|1,0,1]=4 339 B8R0.4 CCCCNCCCC CNP0203128.0 [1,1,0,0,0,0|0,0,2]=4 340 B8R0.4 CCCCOCCCC CNP0077266.0 [1,1,0,0,0,0|0,0,2]=4 341 B8R0.4 CCCCOCCCO CNP0141373.0 [1,1,0,0,0,0|1,0,1]=4 342 B8R0.4 CCCCSCCCC CNP0370059.0 [1,1,0,0,0,0|0,0,2]=4 343 B8R0.4 CSCCCCC=NO CNP0070910.0 [1,1,0,0,0,0|2,0,0]=4 344 B8R0.4 CSCCCCCC#N CNP0267304.0 [1,1,0,0,0,0|1,0,1]=4 345 B8R0.4 CSCCCN=CC=S CNP0098576.0 [1,1,0,0,0,0|2,0,0]=4 346 B8R0.4 CSCCC[N+]=CC=S CNP0575670.0 [1,1,0,0,0,0|2,0,0]=4 347 B8R0.7 C=C(O)CCCCCC CNP0584840.0 [1,1,0,0,0,0|0,0,0]=2 348 B8R0.7 C=CCCCCC(=O)C CNP0179576.0 [1,1,0,0,0,0|0,0,1]=3 349 B8R0.7 C=CCCCCC(C)O CNP0002843.0 [1,1,0,0,0,0|0,0,0]=2 350 B8R0.7 C=CCCCOC(=O)C CNP0186159.0 [1,1,0,0,0,0|1,0,1]=4 351 B8R0.7 CC(C)CCCCC=O CNP0244483.0 [1,1,0,0,0,0|1,0,0]=3 352 B8R0.7 CC(C)CCCCCO CNP0090200.0 [1,1,0,0,0,0|1,0,1]=4 353 B8R0.7 CCCCCC=C(C)C CNP0153071.0 [1,1,0,0,0,0|0,0,2]=4 354 B8R0.7 CCCCCC=C(C)O CNP0546798.0 [1,1,0,0,0,0|0,0,2]=4 355 B8R0.7 CCCCCCC(=O)C CNP0325160.0 [1,1,0,0,0,0|0,0,1]=3 356 B8R0.7 CCCCCCC(=O)Cl CNP0211048.0 [1,1,0,0,0,0|1,0,0]=3 357 B8R0.7 CCCCCCC(=O)N CNP0248097.0 [1,1,0,0,0,0|1,0,0]=3 358 B8R0.7 CCCCCCC(=O)O CNP0141686.0 [1,1,0,0,0,0|1,0,0]=3 359 B8R0.7 CCCCCCC(C)C CNP0161146.0 [1,1,0,0,0,0|0,0,2]=4 360 B8R0.7 CCCCCC[C@@H](C)Cl CNP0248103.2 [1,1,0,0,0,0|0,0,2]=4 361 B8R0.7 CCCCCC[C@@H](C)O CNP0419289.1 [1,1,0,0,0,0|0,0,2]=4 362 B8R0.7 CCCCCC[C@H](C)Cl CNP0248103.1 [1,1,0,0,0,0|0,0,2]=4 363 B8R0.7 CCCCCC[C@H](C)O CNP0419289.2 [1,1,0,0,0,0|0,0,2]=4 364 B8R0.7 CCCCCC[N+](=O)O CNP0515303.0 [1,1,0,0,0,0|2,0,0]=4 365 B8R0.7 CCCCCC[N+](=O)[O-] CNP0518178.0 [1,1,0,0,0,0|2,0,0]=4 366 B8R0.7 CCCCCOC(=O)C CNP0227990.0 [1,1,0,0,0,0|1,0,1]=4 367 B8R0.7 CCCCOCC(=O)O CNP0524848.0 [1,1,0,0,0,0|2,0,0]=4 368 B8R0.7 CCCOCCC(=O)C CNP0376956.0 [1,1,0,0,0,0|1,0,1]=4 369 B8R0.7 NCCCCCC(=O)O CNP0337210.0 [1,1,0,0,0,0|2,0,0]=4 370 B8R0.7 O=C(O)CCCCCO CNP0079830.0 [1,1,0,0,0,0|2,0,0]=4 371 B8R0.3 CCC[C@@H](C)[C@@H](O)CC CNP0195480.3 [1,1,0,0,0,0|0,0,2]=4 372 B8R0.3 CCC[C@H](C)[C@@H](O)CC CNP0195480.2 [1,1,0,0,0,0|0,0,2]=4 373 B8R0.3 CCC[C@H](C)[C@H](O)CC CNP0195480.1 [1,1,0,0,0,0|0,0,2]=4 374 B8R0.8 CCCCC(O)C(C)C CNP0610502.0 [1,1,0,0,0,0|0,0,2]=4 375 B8R0.8 CCCC[C@@H](C)C(=O)O CNP0131779.1 [1,1,0,0,0,0|2,0,0]=4 376 B8R0.8 CCCC[C@@H](N)C(=O)O CNP0177876.2 [1,1,0,0,0,0|2,0,0]=4 377 B8R0.8 CCCC[C@H](Br)C(=O)Br CNP0017823.1 [1,1,0,0,0,0|2,0,0]=4 378 B8R0.8 CCCC[C@H](Br)C(=O)O CNP0017777.1 [1,1,0,0,0,0|2,0,0]=4 379 B8R0.8 CCCC[C@H](N)C(=O)O CNP0177876.1 [1,1,0,0,0,0|2,0,0]=4 380 B8R0.8 CCCC[C@H](O)C(=O)O CNP0296365.1 [1,1,0,0,0,0|1,0,0]=3 381 B8R0.8 CSCCC(O)C(=O)O CNP0398053.0 [1,1,0,0,0,0|2,0,0]=4 382 B8R0.8 NCCC[C@@H](O)C(=O)O CNP0154820.1 [1,1,0,0,0,0|2,0,0]=4 383 B8R0.9 C=CC(C)CCC(=C)C CNP0517819.0 [1,1,0,0,0,0|1,0,1]=4 384 B8R0.9 C=CC(C)CCC(=O)C CNP0480823.0 [1,1,0,0,0,0|1,0,1]=4 385 B8R0.9 CCC(O)CCC(C)C CNP0554641.0 [1,1,0,0,0,0|0,0,2]=4 386 B8R0.11 CCCCC(OC)OC CNP0417281.0 [1,1,0,0,0,0|1,0,1]=4 387 B8R0.11 CCCC[C@@H](C=O)CC CNP0164543.1 [1,1,0,0,0,0|2,0,0]=4 388 B8R0.11 CCCC[C@@H](CC)CO CNP0079888.1 [1,1,0,0,0,0|0,0,2]=4 389 B8R0.11 CCCC[C@H](C=O)CC CNP0164543.2 [1,1,0,0,0,0|2,0,0]=4 390 B8R0.11 CCCC[C@H](CC)CO CNP0079888.2 [1,1,0,0,0,0|0,0,2]=4 391 B8R0.19 CC[C@H](C)C[C@H](O)CC CNP0324526.1 [1,1,0,0,0,0|0,0,2]=4 392 B8R0.25 CCCCC(C)(C)C=O CNP0548345.0 [1,1,0,0,0,0|2,0,0]=4 393 B8R0.5 C=C(C)CC(C)CCC CNP0397067.0 [1,1,0,0,0,0|1,0,1]=4 394 B8R0.5 CCCC(C)CC(C)C CNP0086425.0 [1,1,0,0,0,0|1,0,1]=4 395 B8R0.5 CCCC(C)CC(C)O CNP0100557.0 [1,1,0,0,0,0|0,0,1]=3 396 B8R0.5 CCC[C@@H](O)CC(=O)O CNP0065850.1 [1,1,0,0,0,0|1,0,1]=4 397 B8R0.5 CCC[C@H](C)CC(=O)O CNP0320012.1 [1,1,0,0,0,0|1,0,1]=4 398 B8R0.5 CCC[C@H](O)CC(=O)O CNP0065850.2 [1,1,0,0,0,0|1,0,1]=4 399 B8R0.21 CCCCCC(C)(C)S CNP0505610.0 [1,1,0,0,0,0|0,1,1]=4 400 B8R0.28 C=C(C)CCC[C@H](C)O CNP0136592.1 [1,1,0,0,0,0|0,0,2]=4 401 B8R0.28 CC(C)CCCC(=O)O CNP0255582.0 [1,1,0,0,0,0|1,0,1]=4 402 B8R0.28 CC(C)CCCC(C)C CNP0166483.0 [1,1,0,0,0,0|1,0,1]=4 403 B8R0.28 CC(C)CCC[C@@H](C)N CNP0402006.1 [1,1,0,0,0,0|1,0,1]=4 404 B8R0.28 CC(C)CCC[C@H](C)N CNP0402006.2 [1,1,0,0,0,0|1,0,1]=4 405 B8R0.28 CC(C)CCC[C@H](C)O CNP0182781.1 [1,1,0,0,0,0|0,0,1]=3 406 B8R0.28 CC(O)COCC(C)O CNP0610078.0 [1,1,0,0,0,0|1,0,1]=4 407 B8R0.28 C[C@@H](O)CCCC(=O)O CNP0082052.1 [1,1,0,0,0,0|1,0,1]=4 408 B10R0.3 C[C@H](O)CCC[C@@H](O)CCO CNP0334179.1 [0,2,0,0,0,0|0,0,2]=4 409 B10R0.44 C=CC(=C)C[C@@H](O)CC(C)C CNP0236556.1 [0,2,0,0,0,0|1,0,1]=4 410 B10R0.44 C=C[C@@H](C)CC(=O)CC(C)C CNP0350392.1 [0,2,0,0,0,0|1,0,1]=4 411 B10R0.44 C=C[C@H](C)CC(=O)CC(C)C CNP0350392.2 [0,2,0,0,0,0|1,0,1]=4 412 B10R0.59 C=CC(=C)CCCC(C)CO CNP0575174.0 [0,2,0,0,0,0|1,0,1]=4 413 B10R0.59 CCC(C)CCCC(C)C=O CNP0002769.0 [0,2,0,0,0,0|2,0,0]=4 414 B10R0.60 C=CC(=C)CCCC(C)(C)O CNP0356911.0 [0,2,0,0,0,0|1,0,1]=4 415 B10R0.60 C=C[C@@H](C)CCCC(C)(C)O CNP0080125.1 [0,2,0,0,0,0|1,0,0]=3 416 B10R0.65 C=CC(C)(O)CCCC(C)C CNP0150178.0 [0,2,0,0,0,0|0,0,0]=2 417 B10R0.65 C=C[C@@](C)(O)CCC=C(C)C CNP0373115.2 [0,2,0,0,0,0|0,0,2]=4 418 B10R0.65 C=C[C@@](C)(O)CCCC(=C)C CNP0283677.1 [0,2,0,0,0,0|0,0,1]=3 419 B10R0.65 C=C[C@](C)(O)CCC=C(C)C CNP0373115.1 [0,2,0,0,0,0|0,0,2]=4 420 B10R0.65 CCC(C)(O)CCCC(C)C CNP0083056.0 [0,2,0,0,0,0|0,0,2]=4 421 B10R0.77 C=CC(CO)CCC=C(C)C CNP0602563.0 [0,2,0,0,0,0|0,0,2]=4 422 B10R0.82 C=C[C@@H](C)CCC(=O)C(C)C CNP0311508.1 [0,2,0,0,0,0|1,0,1]=4 423 B10R0.82 C=C[C@H](C)CCC(=O)C(C)C CNP0311508.2 [0,2,0,0,0,0|1,0,1]=4 424 B10R0.98 CC(C)CCCC(C)C(=O)O CNP0346887.0 [0,2,0,0,0,0|2,0,0]=4 425 B10R0.98 CC(C)CCC[C@H](N)C(=O)O CNP0379173.1 [0,2,0,0,0,0|2,0,0]=4 426 B10R0.1 CCCCCC[C@@H](C)NC=O CNP0510552.1 [0,2,0,0,0,0|2,0,0]=4 427 B10R0.1 CCCCCC[C@@H](O)CCC CNP0127008.1 [0,2,0,0,0,0|0,0,2]=4 428 B10R0.1 CCCCCC[C@@H](O)CCO CNP0217557.2 [0,2,0,0,0,0|0,0,2]=4 429 B10R0.1 CCCCCC[C@H](O)CCO CNP0217557.1 [0,2,0,0,0,0|0,0,2]=4 430 B10R0.6 CCCCCC(=O)C=C(C)C CNP0610551.0 [0,2,0,0,0,0|0,0,2]=4 431 B10R0.6 CCCCCC(C)CC(=O)O CNP0541477.0 [0,2,0,0,0,0|1,0,1]=4 432 B10R0.6 CCCCC[C@@H](O)CC(=O)O CNP0264958.1 [0,2,0,0,0,0|0,0,1]=3 433 B10R0.6 CCCCC[C@H](C)OC(=O)C CNP0202341.1 [0,2,0,0,0,0|1,0,1]=4 434 B10R0.6 CCCCC[C@H](O)CC(=O)O CNP0264958.2 [0,2,0,0,0,0|0,0,1]=3 435 B10R0.24 CCCCCC(CO)CCC CNP0552368.0 [0,2,0,0,0,0|0,0,2]=4 436 B10R0.83 CC=C(C)C(=O)CCCCC CNP0394780.0 [0,2,0,0,0,0|0,0,2]=4 437 B10R0.83 CCCCCC(N)C(=O)NC CNP0600257.0 [0,2,0,0,0,0|1,0,1]=4 438 B10R0.91 C#CCCCC(O)C=CC=O CNP0350601.0 [0,2,0,0,0,0|0,0,2]=4 439 B10R0.91 C=CCCC(C)CCCCC CNP0083054.0 [0,2,0,0,0,0|1,0,0]=3 440 B10R0.91 C=CCOC(=O)CCCCC CNP0190608.0 [0,2,0,0,0,0|0,0,2]=4 441 B10R0.91 C=CCSC(=O)CCCCC CNP0018361.0 [0,2,0,0,0,0|0,0,2]=4 442 B10R0.91 CCC=CC(=O)CCCCC CNP0076921.0 [0,2,0,0,0,0|0,0,2]=4 443 B10R0.91 CCCCCC(=O)C=CC=O CNP0346772.0 [0,2,0,0,0,0|0,0,2]=4 444 B10R0.91 CCCCCC(=O)C=CCO CNP0135755.0 [0,2,0,0,0,0|0,0,2]=4 445 B10R0.91 CCCCC[C@@H](O)/C=C/C=O CNP0377024.2 [0,2,0,0,0,0|0,0,0]=2 446 B10R0.91 CCCCC[C@H](O)/C=C/C=O CNP0377024.1 [0,2,0,0,0,0|0,0,0]=2 447 B10R0.35 CSCC(O)C(O)C(O)C=O CNP0437067.0 [0,2,0,0,0,0|2,0,0]=4 448 B10R0.81 CCCCC(Br)C(O)C(Br)Br CNP0017707.0 [0,2,0,0,0,0|1,0,1]=4 449 B10R0.85 C#CC(O)C(CC)CCCC CNP0600090.0 [0,2,0,0,0,0|0,0,2]=4 450 B10R0.124 CCCCC(Br)(Br)[C@@H](O)CBr CNP0283651.1 [0,2,0,0,0,0|1,0,1]=4 451 B10R0.41 CCCCCCC(OC)OC CNP0402550.0 [0,2,0,0,0,0|1,0,1]=4 452 B10R0.55 C=C[C@@H](O)CCCCC(=O)O CNP0323784.1 [0,2,0,0,0,0|0,0,1]=3 453 B10R0.74 C=CC(=O)CCCCCCC CNP0331135.0 [0,2,0,0,0,0|0,0,2]=4 454 B10R0.74 C=CC(O)CCCCCCC CNP0002593.0 [0,2,0,0,0,0|0,0,0]=2 455 B10R0.74 CCCCCCC[C@@H](O)CC CNP0233369.2 [0,2,0,0,0,0|0,0,2]=4 456 B10R0.74 CCCCCCC[C@H](O)CC CNP0233369.1 [0,2,0,0,0,0|0,0,2]=4 457 B10R0.74 NCCCCNCC(O)CN CNP0547539.0 [0,2,0,0,0,0|1,0,1]=4 458 B10R0.75 CCCCCC[C@@H](C)C(=O)O CNP0199181.1 [0,2,0,0,0,0|2,0,0]=4 459 B10R0.75 CCCCCC[C@@H](N)C(=O)O CNP0110183.2 [0,2,0,0,0,0|2,0,0]=4 460 B10R0.75 CCCCCC[C@@H](O)C(=O)O CNP0036697.1 [0,2,0,0,0,0|1,0,0]=3 461 B10R0.75 CCCCCC[C@H](N)C(=O)O CNP0110183.1 [0,2,0,0,0,0|2,0,0]=4 462 B10R0.75 CCCCCC[C@H](O)C(=O)O CNP0036697.2 [0,2,0,0,0,0|1,0,0]=3 463 B10R0.75 CCCCSC[C@H](N)C(=O)O CNP0563625.1 [0,2,0,0,0,0|2,0,0]=4 464 B10R0.75 CNCCCC[C@H](N)C(=O)O CNP0107109.1 [0,2,0,0,0,0|2,0,0]=4 465 B10R0.75 CSCCCC[C@H](N)C(=O)O CNP0359103.1 [0,2,0,0,0,0|2,0,0]=4 466 B10R0.75 NCCCCCC(N)C(=O)O CNP0609957.0 [0,2,0,0,0,0|2,0,0]=4 467 B10R0.86 CCCCCC(CC)C(=O)O CNP0026234.0 [0,2,0,0,0,0|0,0,2]=4 468 B10R0.86 CCCCCC(CO)C(=O)C CNP0002850.0 [0,2,0,0,0,0|0,0,1]=3 469 B10R0.86 NCCCC[C@H](NO)C(=O)O CNP0382420.1 [0,2,0,0,0,0|2,0,0]=4 470 B8R1.2 BrC[C@@H]1C=CCCC1 CNP0302852.1 [1,0,0,1,0,0|1,0,0]=3 471 B8R1.2 C=CC1=CCCCC1 CNP0552641.0 [1,0,0,1,0,0|0,0,2]=4 472 B8R1.2 CCC1=CCCCC1 CNP0080676.0 [1,0,0,1,0,0|0,0,2]=4 473 B8R1.2 CCC1CCCCC1 CNP0300322.0 [1,0,0,1,0,0|0,0,2]=4 474 B8R1.2 CC[C@@H]1C=CCSS1 CNP0292362.1 [1,0,0,1,0,0|2,0,0]=4 475 B8R1.2 CC[C@@H]1CCCCO1 CNP0273678.2 [1,0,0,1,0,0|1,0,1]=4 476 B8R1.2 CC[C@H]1C=CCCC1 CNP0103483.1 [1,0,0,1,0,0|0,0,0]=2 477 B8R1.2 CC[C@H]1CCCCO1 CNP0273678.1 [1,0,0,1,0,0|1,0,1]=4 478 B8R1.2 CNC1CCCCC1 CNP0474937.0 [1,0,0,1,0,0|1,0,1]=4 479 B8R1.2 NCC1CCCCC1 CNP0581484.0 [1,0,0,1,0,0|1,0,1]=4 480 B8R1.2 O=CC1CCCCC1 CNP0419979.0 [1,0,0,1,0,0|1,0,0]=3 481 B8R1.2 O=CN1CCCCC1 CNP0187689.0 [1,0,0,1,0,0|2,0,0]=4 482 B8R1.2 OCC1C=CCCC1 CNP0213790.0 [1,0,0,1,0,0|1,0,0]=3 483 B8R1.2 [C-]#[N+]C1CCCCC1 CNP0554147.0 [1,0,0,1,0,0|1,0,1]=4 484 B8R1.5 C=C1CCCCC1C CNP0595985.0 [1,0,0,1,0,0|0,0,0]=2 485 B8R1.5 CC1CCCC=C1Cl CNP0566805.0 [1,0,0,1,0,0|1,0,1]=4 486 B8R1.5 CC1CCCCC1=O CNP0003363.0 [1,0,0,1,0,0|1,0,0]=3 487 B8R1.5 CC1CCCCC1O CNP0610101.0 [1,0,0,1,0,0|1,0,1]=4 488 B8R1.5 CC1CCCOC1=O CNP0340524.0 [1,0,0,1,0,0|2,0,0]=4 489 B8R1.5 C[C@@H]1CCCC[C@@H]1C CNP0309502.2 [1,0,0,1,0,0|0,0,2]=4 490 B8R1.5 C[C@@H]1CCCC[C@H]1C CNP0309502.1 [1,0,0,1,0,0|0,0,2]=4 491 B8R1.5 O=C1CCCCC1O CNP0610127.0 [1,0,0,1,0,0|2,0,0]=4 492 B8R1.8 CCCC1CCCC1 CNP0271421.0 [1,0,0,1,0,0|0,0,2]=4 493 B8R1.8 CCCC1CCSS1 CNP0313862.0 [1,0,0,1,0,0|2,0,0]=4 494 B8R1.10 CCCCC1CCC1 CNP0281769.0 [1,0,0,1,0,0|0,0,2]=4 495 B8R1.11 CCC1=C(CCC1)C CNP0488475.0 [1,0,0,1,0,0|0,0,2]=4 496 B8R1.11 CCC1CCCC1=O CNP0494839.0 [1,0,0,1,0,0|1,0,0]=3 497 B8R1.11 CCC1SCCC1=O CNP0185206.0 [1,0,0,1,0,0|2,0,0]=4 498 B8R1.11 CC[C@@H]1CCC[C@H]1C CNP0227551.1 [1,0,0,1,0,0|0,0,2]=4 499 B8R1.11 CC[C@H]1CCNC1=O CNP0289303.1 [1,0,0,1,0,0|2,0,0]=4 500 B8R1.22 CC1CCCCCC1 CNP0214318.0 [1,0,0,1,0,0|0,0,2]=4 501 B8R1.22 NC1=NCCCCC1 CNP0446960.0 [1,0,0,1,0,0|2,0,0]=4 502 B8R1.22 NC1=[NH+]CCCCC1 CNP0594018.0 [1,0,0,1,0,0|2,0,0]=4 503 B8R1.22 O=C1CCCCCC1 CNP0486939.0 [1,0,0,1,0,0|1,0,0]=3 504 B8R1.22 O=C1CCCCCN1 CNP0157959.0 [1,0,0,1,0,0|2,0,0]=4 505 B8R1.22 O=C1CCCCCO1 CNP0358428.0 [1,0,0,1,0,0|2,0,0]=4 506 B8R1.22 OC1=NCCCCC1 CNP0523769.0 [1,0,0,1,0,0|2,0,0]=4 507 B8R1.36 CCCCCC1CC1 CNP0610547.0 [1,0,0,1,0,0|0,0,2]=4 508 B8R1.49 C1#CCCC=CCC1 CNP0593767.0 [1,0,0,1,0,0|0,0,2]=4 509 B8R1.49 C1=CCCCCC=C1 CNP0084968.0 [1,0,0,1,0,0|0,0,2]=4 510 B8R1.49 C1=CCCCCCC1 CNP0354381.0 [1,0,0,1,0,0|0,0,0]=2 511 B8R1.1 C=CC1OCC(O1)C CNP0506868.0 [1,0,0,1,0,0|1,0,0]=3 512 B8R1.1 CC1CCC(O1)CO CNP0511633.0 [1,0,0,1,0,0|1,0,1]=4 513 B8R1.1 CCC1CCC(O1)C CNP0586635.0 [1,0,0,1,0,0|0,0,2]=4 514 B8R1.3 C[C@H]1CC[C@@H](CC1)O CNP0179489.1 [1,0,0,1,0,0|0,0,2]=4 515 B8R1.40 C[C@H](C=O)CC1CC1 CNP0511698.1 [1,0,0,1,0,0|2,0,0]=4 516 B8R1.50 CC1CCC(C1=O)C CNP0569003.0 [1,0,0,1,0,0|2,0,0]=4 517 B8R1.50 CN1CC[C@H](C1=O)O CNP0148419.1 [1,0,0,1,0,0|2,0,0]=4 518 B8R1.50 C[C@H]1CC[C@H]([C@@H]1O)O CNP0330167.1 [1,0,0,1,0,0|1,0,1]=4 519 B8R1.4 CC1=CC(CCC1)C CNP0085833.0 [1,0,0,1,0,0|1,0,1]=4 520 B8R1.4 CC1=C[C@@H](CCC1)O CNP0215038.1 [1,0,0,1,0,0|0,0,1]=3 521 B8R1.4 C[C@@H]1CCCC(=O)O1 CNP0340427.1 [1,0,0,1,0,0|1,0,1]=4 522 B8R1.4 C[C@@H]1CCC[C@@H](C1)C CNP0169936.1 [1,0,0,1,0,0|1,0,1]=4 523 B8R1.4 C[C@@H]1CCC[C@@H](C1)O CNP0155717.1 [1,0,0,1,0,0|0,0,1]=3 524 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CNP0277987.1 [1,0,0,1,0,0|1,0,1]=4 525 B8R1.4 C[C@@H]1CCC[C@H](C1)C CNP0169936.2 [1,0,0,1,0,0|1,0,1]=4 526 B8R1.4 C[C@@H]1CCC[C@H](C1)O CNP0155717.2 [1,0,0,1,0,0|0,0,1]=3 527 B8R1.4 C[C@@H]1CCC[C@H](N1)C CNP0277987.2 [1,0,0,1,0,0|1,0,1]=4 528 B8R1.4 C[C@H]1CCCC(=O)O1 CNP0340427.2 [1,0,0,1,0,0|1,0,1]=4 529 B8R1.4 C[C@H]1CCC[C@@H](C1)O CNP0155717.3 [1,0,0,1,0,0|0,0,1]=3 530 B8R1.4 C[C@H]1CCC[C@H](C1)O CNP0155717.4 [1,0,0,1,0,0|0,0,1]=3 531 B8R1.4 C[C@H]1OCC[C@@H](O1)C CNP0515975.1 [1,0,0,1,0,0|1,0,1]=4 532 B8R1.7 CC(C)C1CCCC1 CNP0315126.0 [1,0,0,1,0,0|1,0,1]=4 533 B8R1.7 CC(O)C1CCCC1 CNP0082077.0 [1,0,0,1,0,0|0,0,1]=3 534 B8R1.7 O=C(O)C1CCCC1 CNP0135626.0 [1,0,0,1,0,0|1,0,1]=4 535 B8R1.19 C[C@H]1CCCC1(C)C CNP0142130.1 [1,0,0,1,0,0|1,0,1]=4 536 B8R1.72 CC1(CCCCC1)C CNP0281819.0 [1,0,0,1,0,0|1,0,1]=4 537 B8R1.72 CC1(CCCCC1)O CNP0084309.0 [1,0,0,1,0,0|0,0,1]=3 538 B10R1.13 C=C(C)[C@H]1C=C[C@@H](CC1)C CNP0320205.1 [0,1,0,1,0,0|1,0,1]=4 539 B10R1.13 C=C1C=C[C@@H](CC1)C(C)C CNP0204388.2 [0,1,0,1,0,0|1,0,1]=4 540 B10R1.13 C=C1C=C[C@H](CC1)C(C)C CNP0204388.1 [0,1,0,1,0,0|1,0,1]=4 541 B10R1.13 CC(=O)[C@H]1C=C[C@@H](CC1)C CNP0155762.1 [0,1,0,1,0,0|1,0,1]=4 542 B10R1.13 CC(C)C1CCC(CC1)O CNP0080136.0 [0,1,0,1,0,0|0,0,2]=4 543 B10R1.13 CC(C)[C@@H]1C=CC(=O)CC1 CNP0293305.1 [0,1,0,1,0,0|0,0,2]=4 544 B10R1.13 CC(C)[C@@H]1C=C[C@@H](CC1)C CNP0084021.1 [0,1,0,1,0,0|1,0,0]=3 545 B10R1.13 CC(C)[C@H]1C=CC(=O)CC1 CNP0293305.2 [0,1,0,1,0,0|0,0,2]=4 546 B10R1.13 C[C@@H](O)[C@H]1CC[C@@H](CC1)O CNP0080673.1 [0,1,0,1,0,0|0,0,2]=4 547 B10R1.301 C[C@@H]1CCCC(C1=O)(C)C CNP0229398.1 [0,1,0,1,0,0|2,0,0]=4 548 B10R1.301 C[C@H]1CCCC(C1=O)(C)C CNP0229398.2 [0,1,0,1,0,0|2,0,0]=4 549 B10R1.302 CC1(C=CC(=O)CCC1)C CNP0102920.0 [0,1,0,1,0,0|0,0,2]=4 550 B10R1.485 C=C[C@@]1(CCOC(=O)C1)O CNP0311946.1 [0,1,0,1,0,0|1,0,1]=4 551 B10R1.485 C=C[C@]1(CCOC(=O)C1)O CNP0311946.2 [0,1,0,1,0,0|1,0,1]=4 552 B10R1.485 CC[C@@]1(CCC[C@@H](C1)C)O CNP0046159.2 [0,1,0,1,0,0|0,0,2]=4 553 B10R1.485 CC[C@@]1(CCC[C@H](C1)C)O CNP0046159.3 [0,1,0,1,0,0|0,0,2]=4 554 B10R1.485 CC[C@]1(CCC[C@@H](C1)C)O CNP0046159.4 [0,1,0,1,0,0|0,0,2]=4 555 B10R1.485 CC[C@]1(CCC[C@H](C1)C)O CNP0046159.1 [0,1,0,1,0,0|0,0,2]=4 556 B10R1.10 C/C=C/[C@@H]1CCC[C@@H](N1)C CNP0335648.1 [0,1,0,1,0,0|1,0,0]=3 557 B10R1.10 C/C=C/[C@H]1CCC[C@H](N1)C CNP0335648.2 [0,1,0,1,0,0|1,0,0]=3 558 B10R1.21 CCCCCC1=CC=CO1 CNP0210535.0 [0,1,0,1,0,0|0,0,1]=3 559 B10R1.21 CCCCCC1=CC=CS1 CNP0094840.0 [0,1,0,1,0,0|0,1,1]=4 560 B10R1.21 CCCCCC1=CN=CO1 CNP0197497.0 [0,1,0,1,0,0|0,0,1]=3 561 B10R1.21 CCCCCC1=NC=CO1 CNP0420572.0 [0,1,0,1,0,0|0,0,1]=3 562 B10R1.21 CCCCCC1=NC=CS1 CNP0002560.0 [0,1,0,1,0,0|0,1,1]=4 563 B10R1.15 CC[C@@H](O)[C@@H]1CCCCN1 CNP0379746.1 [0,1,0,1,0,0|0,0,2]=4 564 B10R1.119 CN1C(=O)[C@@H](CC[C@H]1O)O CNP0116469.1 [0,1,0,1,0,0|2,0,0]=4 565 B10R1.230 C#C[C@@]1(CCCC[C@@H]1O)O CNP0175210.1 [0,1,0,1,0,0|0,0,2]=4 566 B10R1.300 C=C1CCCCCC1(C)O CNP0611548.0 [0,1,0,1,0,0|0,0,0]=2 567 B10R1.473 C#C[C@@]1(CC[C@@H](CC1)O)O CNP0148928.1 [0,1,0,1,0,0|0,0,2]=4 568 B10R1.1 CCC[C@@H]1CC[C@@H](CN1)O CNP0303716.2 [0,1,0,1,0,0|0,0,2]=4 569 B10R1.1 CCC[C@H]1CC[C@@H](CC1)O CNP0314418.1 [0,1,0,1,0,0|0,0,2]=4 570 B10R1.1 CCC[C@H]1CC[C@@H](CN1)O CNP0303716.1 [0,1,0,1,0,0|0,0,2]=4 571 B10R1.2 C[C@H]1CCC/C(=N/O)/C1=O CNP0226443.1 [0,1,0,1,0,0|1,0,1]=4 572 B10R1.161 OCC1CCCCCCC1 CNP0085931.0 [0,1,0,1,0,0|0,0,2]=4 573 B10R1.23 N[C@H](C(=O)O)C1CCCC1 CNP0276361.1 [0,1,0,1,0,0|2,0,0]=4 574 B10R1.113 C=C(C)C1=CC(CCC1)C CNP0596114.0 [0,1,0,1,0,0|1,0,1]=4 575 B10R1.113 C=C(C)[C@@H]1C=C(CCC1)C CNP0351688.1 [0,1,0,1,0,0|1,0,1]=4 576 B10R1.113 C=C(C)[C@H]1C=C(CCC1)C CNP0351688.2 [0,1,0,1,0,0|1,0,1]=4 577 B10R1.113 CC1CCC[C@@H](N1)C(=O)O CNP0227209.1 [0,1,0,1,0,0|2,0,0]=4 578 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O CNP0227209.2 [0,1,0,1,0,0|2,0,0]=4 579 B10R1.113 C[C@H]1CCC[C@@H](N1)C(=O)O CNP0227209.3 [0,1,0,1,0,0|2,0,0]=4 580 B10R1.348 O=C(O)C1CCCCCC1 CNP0331995.0 [0,1,0,1,0,0|2,0,0]=4 581 B10R1.348 O=C(O)[C@@H]1CCCCCN1 CNP0320968.2 [0,1,0,1,0,0|2,0,0]=4 582 B10R1.348 O=C(O)[C@H]1CCCCCN1 CNP0320968.1 [0,1,0,1,0,0|2,0,0]=4 583 B10R1.363 CC1(CCCCC1)C(=O)O CNP0464995.0 [0,1,0,1,0,0|2,0,0]=4 584 B10R1.363 NC1(CCCCC1)C(=O)O CNP0298480.0 [0,1,0,1,0,0|2,0,0]=4 585 B10R1.487 COC1(CCCCC1)OC CNP0076484.0 [0,1,0,1,0,0|1,0,1]=4 586 B10R1.487 OCC1(CCCCC1)CO CNP0499074.0 [0,1,0,1,0,0|1,0,1]=4 587 B10R2.62 O[C@@H]1C[C@H]2C=C[C@@H]1CC2 CNP0395567.1 [0,0,0,2,0,0|2,0,0]=4 588 B10R2.109 C=CC1CCC2OC2C1 CNP0491620.0 [0,0,0,2,0,0|2,0,0]=4 589 B10R2.179 CC12CCCC(C1O2)O CNP0426753.0 [0,0,0,2,0,0|1,0,1]=4 590 B10R2.244 O=C1NCCCC2C1O2 CNP0610958.0 [0,0,0,2,0,0|2,0,0]=4 591 B10R2.244 O=C1NCCC[C@@H]2[C@H]1O2 CNP0610958.1 [0,0,0,2,0,0|2,0,0]=4 592 B10R2.2 O=C1C=C2CCCC2C1 CNP0500354.0 [0,0,0,2,0,0|0,0,2]=4 593 B10R2.129 C=CC1(CC2CC1C2)O CNP0605479.0 [0,0,0,2,0,0|0,0,0]=2