0 B8R0.4 C=CC=CCCCCC CNP0389218.0 [0,0,0,0,0,0|1,0,1]=2 1 B8R0.4 C=CCCCCCCC CNP0317850.0 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.4 C=CCCCCCCO CNP0610530.0 [0,0,0,0,0,0|0,0,4]=4 3 B8R0.4 CC#CCCCCCC CNP0610539.0 [0,0,0,0,0,0|1,0,3]=4 4 B8R0.4 CC=C=CCCCCC CNP0555445.0 [0,0,0,0,0,0|1,0,2]=3 5 B8R0.4 CC=CC#CCCCC CNP0343796.0 [0,0,0,0,0,0|1,0,3]=4 6 B8R0.4 CC=CC=CCCCO CNP0492923.0 [0,0,0,0,0,0|2,0,2]=4 7 B8R0.4 CC=CCCC=CC=O CNP0002598.0 [0,0,0,0,0,0|0,0,4]=4 8 B8R0.4 CC=CCCC=CCO CNP0076887.0 [0,0,0,0,0,0|0,0,2]=2 9 B8R0.4 CC=CCCCCCC CNP0241269.0 [0,0,0,0,0,0|1,0,2]=3 10 B8R0.4 CC=CCCCCCO CNP0534658.0 [0,0,0,0,0,0|0,0,4]=4 11 B8R0.4 CC=CSSCCCC CNP0612155.0 [0,0,0,0,0,0|3,0,1]=4 12 B8R0.4 CCC=CC=CCCO CNP0339953.0 [0,0,0,0,0,0|0,0,4]=4 13 B8R0.4 CCC=CCC=CCO CNP0338368.0 [0,0,0,0,0,0|0,0,2]=2 14 B8R0.4 CCC=CCCCC=O CNP0002614.0 [0,0,0,0,0,0|2,0,1]=3 15 B8R0.4 CCC=CCCCCC CNP0539420.0 [0,0,0,0,0,0|1,0,0]=1 16 B8R0.4 CCC=CCCCCO CNP0192139.0 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.4 CCC=CCCOC=O CNP0053041.0 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.4 CCCC#CCCCC CNP0399647.0 [0,0,0,0,0,0|1,0,3]=4 19 B8R0.4 CCCC=CC=CC=O CNP0226923.0 [0,0,0,0,0,0|0,0,4]=4 20 B8R0.4 CCCC=CC=CCO CNP0175481.0 [0,0,0,0,0,0|0,0,2]=2 21 B8R0.4 CCCC=CCCCC CNP0594829.0 [0,0,0,0,0,0|1,0,2]=3 22 B8R0.4 CCCC=CCCCO CNP0085599.0 [0,0,0,0,0,0|0,0,4]=4 23 B8R0.4 CCCCC=CCC=O CNP0207183.0 [0,0,0,0,0,0|0,0,4]=4 24 B8R0.4 CCCCC=CCCO CNP0221419.0 [0,0,0,0,0,0|0,0,2]=2 25 B8R0.4 CCCCC=COC=O CNP0604660.0 [0,0,0,0,0,0|1,0,3]=4 26 B8R0.4 CCCCCC=CC=O CNP0192932.0 [0,0,0,0,0,0|0,0,2]=2 27 B8R0.4 CCCCCC=CCO CNP0113756.0 [0,0,0,0,0,0|0,0,0]=0 28 B8R0.4 CCCCCCC=CO CNP0605778.0 [0,0,0,0,0,0|0,0,2]=2 29 B8R0.4 CCCCCCC=NO CNP0389770.0 [0,0,0,0,0,0|1,0,1]=2 30 B8R0.4 CCCCCCCC#N CNP0112630.0 [0,0,0,0,0,0|1,0,3]=4 31 B8R0.4 CCCCCCCC=O CNP0146292.0 [0,0,0,0,0,0|0,0,4]=4 32 B8R0.4 CCCCCCCCC CNP0402619.0 [0,0,0,0,0,0|1,0,2]=3 33 B8R0.4 CCCCCCCCN CNP0065900.0 [0,0,0,0,0,0|1,0,2]=3 34 B8R0.4 CCCCCCCCO CNP0368614.0 [0,0,0,0,0,0|0,0,2]=2 35 B8R0.4 CCCCCCCNC CNP0216624.0 [0,0,0,0,0,0|2,0,2]=4 36 B8R0.4 CCCCCCCOO CNP0566054.0 [0,0,0,0,0,0|1,0,2]=3 37 B8R0.4 CCCCCCC[11CH]=O CNP0546456.0 [0,0,0,0,0,0|0,0,4]=4 38 B8R0.4 CCCCCCN=C=S CNP0253332.0 [0,0,0,0,0,0|1,1,2]=4 39 B8R0.4 CCCCCCOC=O CNP0086211.0 [0,0,0,0,0,0|1,0,3]=4 40 B8R0.4 CCCCCCOCC CNP0609034.0 [0,0,0,0,0,0|2,0,1]=3 41 B8R0.4 CCCCCCSSC CNP0510251.0 [0,0,0,0,0,0|3,0,1]=4 42 B8R0.4 CCCCNCCCC CNP0203128.0 [0,0,0,0,0,0|2,0,2]=4 43 B8R0.4 CCCCOCCCC CNP0077266.0 [0,0,0,0,0,0|2,0,2]=4 44 B8R0.4 CCCCOCCCO CNP0141373.0 [0,0,0,0,0,0|1,0,2]=3 45 B8R0.4 CCCCSCCCC CNP0370059.0 [0,0,0,0,0,0|2,0,2]=4 46 B8R0.4 CCCCSSCCC CNP0003137.0 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.4 CCNCCCNCC CNP0239670.0 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.4 CCOCCOCCO CNP0079970.0 [0,0,0,0,0,0|2,0,1]=3 49 B8R0.4 CSCCCCC=NO CNP0070910.0 [0,0,0,0,0,0|2,0,1]=3 50 B8R0.4 CSCCCN=CC=S CNP0098576.0 [0,0,0,0,0,0|2,1,1]=4 51 B8R0.4 CSCCC[N+]=CC=S CNP0575670.0 [0,0,0,0,0,0|2,1,1]=4 52 B7R0.1 C#CC=CCCCC CNP0076122.0 [1,0,0,0,0,0|1,0,1]=3 53 B7R0.1 C=CC=CCCCC CNP0084214.0 [1,0,0,0,0,0|0,0,2]=3 54 B7R0.1 C=CCCCC=CC CNP0076717.0 [1,0,0,0,0,0|0,0,2]=3 55 B7R0.1 C=CCCCCCC CNP0246919.0 [1,0,0,0,0,0|0,0,2]=3 56 B7R0.1 C=CCCCCCO CNP0075956.0 [1,0,0,0,0,0|0,0,3]=4 57 B7R0.1 CC=CC=CCCC CNP0275494.0 [1,0,0,0,0,0|0,0,2]=3 58 B7R0.1 CC=CCC=CCO CNP0168622.0 [1,0,0,0,0,0|0,0,2]=3 59 B7R0.1 CC=CCCC=CC CNP0082120.0 [1,0,0,0,0,0|0,0,2]=3 60 B7R0.1 CC=CCCCCC CNP0199237.0 [1,0,0,0,0,0|0,0,0]=1 61 B7R0.1 CC=CCSCCC CNP0536250.0 [1,0,0,0,0,0|1,0,0]=2 62 B7R0.1 CC=CSSCCC CNP0421889.0 [1,0,0,0,0,0|2,0,0]=3 63 B7R0.1 CCC#CC=CCO CNP0417978.0 [1,0,0,0,0,0|0,0,2]=3 64 B7R0.1 CCC#CCCCC CNP0602501.0 [1,0,0,0,0,0|0,0,3]=4 65 B7R0.1 CCC=CC=CCC CNP0546897.0 [1,0,0,0,0,0|1,0,2]=4 66 B7R0.1 CCC=CC=CCO CNP0332799.0 [1,0,0,0,0,0|0,0,2]=3 67 B7R0.1 CCC=CCCC=O CNP0265888.0 [1,0,0,0,0,0|2,0,1]=4 68 B7R0.1 CCC=CCCCC CNP0084702.0 [1,0,0,0,0,0|1,0,0]=2 69 B7R0.1 CCC=CCCCO CNP0003503.0 [1,0,0,0,0,0|2,0,0]=3 70 B7R0.1 CCCC=CC=CO CNP0524724.0 [1,0,0,0,0,0|0,0,2]=3 71 B7R0.1 CCCC=CCCC CNP0541880.0 [1,0,0,0,0,0|1,0,2]=4 72 B7R0.1 CCCC=CCCO CNP0287313.0 [1,0,0,0,0,0|0,0,2]=3 73 B7R0.1 CCCCC=CC=O CNP0210810.0 [1,0,0,0,0,0|0,0,2]=3 74 B7R0.1 CCCCC=CCO CNP0191159.0 [1,0,0,0,0,0|0,0,0]=1 75 B7R0.1 CCCCCCC#N CNP0186663.0 [1,0,0,0,0,0|1,0,2]=4 76 B7R0.1 CCCCCCC=O CNP0243745.0 [1,0,0,0,0,0|0,0,2]=3 77 B7R0.1 CCCCCCCC CNP0286567.0 [1,0,0,0,0,0|0,0,2]=3 78 B7R0.1 CCCCCCCN CNP0186919.0 [1,0,0,0,0,0|1,0,1]=3 79 B7R0.1 CCCCCCCO CNP0329737.0 [1,0,0,0,0,0|0,0,1]=2 80 B7R0.1 CCCCCCNC CNP0413437.0 [1,0,0,0,0,0|1,0,1]=3 81 B7R0.1 CCCCCN=C=S CNP0391667.0 [1,0,0,0,0,0|1,1,1]=4 82 B7R0.1 CCCCCOC=O CNP0294368.0 [1,0,0,0,0,0|1,0,1]=3 83 B7R0.1 CCCCCOCC CNP0520137.0 [1,0,0,0,0,0|1,0,1]=3 84 B7R0.1 CCCCCON=O CNP0511882.0 [1,0,0,0,0,0|2,0,1]=4 85 B7R0.1 CCCCCSSC CNP0201479.0 [1,0,0,0,0,0|2,0,0]=3 86 B7R0.1 CCCCN=CC=S CNP0423600.0 [1,0,0,0,0,0|1,1,0]=3 87 B7R0.1 CCCCNCCO CNP0185911.0 [1,0,0,0,0,0|1,0,1]=3 88 B7R0.1 CCCCOCCO CNP0080154.0 [1,0,0,0,0,0|1,0,1]=3 89 B7R0.1 CCCC[N+]=CC=S CNP0578229.0 [1,0,0,0,0,0|1,1,0]=3 90 B7R0.1 CCNCCCCN CNP0107714.0 [1,0,0,0,0,0|2,0,1]=4 91 B7R0.1 CCNCCNCC CNP0103183.0 [1,0,0,0,0,0|2,0,1]=4 92 B7R0.1 CNCCCCCN CNP0390055.0 [1,0,0,0,0,0|2,0,1]=4 93 B7R0.1 CNCCCCNC CNP0145070.0 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.1 COCCOCCO CNP0610336.0 [1,0,0,0,0,0|2,0,1]=4 95 B7R0.1 CSCCCC=NO CNP0610383.0 [1,0,0,0,0,0|2,0,0]=3 96 B7R0.1 NCCCCCCN CNP0230906.0 [1,0,0,0,0,0|2,0,1]=4 97 B7R0.1 NCCCCCCO CNP0568466.0 [1,0,0,0,0,0|1,0,1]=3 98 B7R0.1 NCCCCCNO CNP0455910.0 [1,0,0,0,0,0|2,0,1]=4 99 B7R0.1 OCCCCCCBr CNP0593386.0 [1,0,0,0,0,0|1,0,1]=3 100 B7R0.1 OCCCCCCO CNP0080019.0 [1,0,0,0,0,0|1,0,1]=3 101 B7R0.1 OCCCCCCS CNP0154751.0 [1,0,0,0,0,0|1,0,1]=3 102 B7R0.1 OCCCSCCO CNP0079791.0 [1,0,0,0,0,0|2,0,1]=4 103 B7R0.1 SCCCCCCS CNP0089642.0 [1,0,0,0,0,0|1,1,1]=4 104 B9R0.2 C=C/C=C\CCC[C@@H](C)O CNP0169759.1 [0,1,0,0,0,0|1,0,1]=3 105 B9R0.2 C=C/C=C\CCC[C@H](C)O CNP0169759.2 [0,1,0,0,0,0|1,0,1]=3 106 B9R0.2 CC(=O)CCCCCCO CNP0501685.0 [0,1,0,0,0,0|0,0,3]=4 107 B9R0.2 CC=CCCC=CC(=O)O CNP0585544.0 [0,1,0,0,0,0|0,0,3]=4 108 B9R0.2 CCC=CCCCC(=O)O CNP0227056.0 [0,1,0,0,0,0|2,0,1]=4 109 B9R0.2 CCC=CCCOC(=O)C CNP0265323.0 [0,1,0,0,0,0|2,0,1]=4 110 B9R0.2 CCCC=CC=CC(=O)O CNP0529774.0 [0,1,0,0,0,0|0,0,3]=4 111 B9R0.2 CCCCC=CCC(=O)O CNP0229088.0 [0,1,0,0,0,0|0,0,3]=4 112 B9R0.2 CCCCCC=CC(=O)C CNP0269922.0 [0,1,0,0,0,0|0,0,2]=3 113 B9R0.2 CCCCCC=CC(=O)O CNP0184671.0 [0,1,0,0,0,0|0,0,1]=2 114 B9R0.2 CCCCCCCC(=O)O CNP0295653.0 [0,1,0,0,0,0|0,0,3]=4 115 B9R0.2 CCCCCCCC(C)C CNP0389961.0 [0,1,0,0,0,0|1,0,2]=4 116 B9R0.2 CCCCCCC[C@@H](C)O CNP0111016.1 [0,1,0,0,0,0|0,0,2]=3 117 B9R0.2 CCCCCCC[C@H](C)O CNP0111016.2 [0,1,0,0,0,0|0,0,2]=3 118 B9R0.2 CCCCCCC[N+](=O)O CNP0592647.0 [0,1,0,0,0,0|1,0,2]=4 119 B9R0.5 C=CCC(=O)CCCCC CNP0108996.0 [0,1,0,0,0,0|1,0,2]=4 120 B9R0.5 C=COC(=O)CCCCC CNP0521245.0 [0,1,0,0,0,0|2,0,1]=4 121 B9R0.5 CC=CC(=O)CCCCC CNP0176491.0 [0,1,0,0,0,0|1,0,1]=3 122 B9R0.5 CC=CC(=O)OCCCC CNP0017670.0 [0,1,0,0,0,0|2,0,1]=4 123 B9R0.5 CCC=CCC(=O)OCC CNP0055106.0 [0,1,0,0,0,0|2,0,1]=4 124 B9R0.5 CCC=CCC(O)CCO CNP0003570.0 [0,1,0,0,0,0|2,0,0]=3 125 B9R0.5 CCCCCC(=O)CCC CNP0331420.0 [0,1,0,0,0,0|1,0,1]=3 126 B9R0.5 CCCCCC(=O)CCO CNP0135586.0 [0,1,0,0,0,0|0,0,1]=2 127 B9R0.5 CCCCCC(=O)OCC CNP0149883.0 [0,1,0,0,0,0|2,0,0]=3 128 B9R0.5 CCCCC[C@H](C)CCC CNP0345469.1 [0,1,0,0,0,0|1,0,2]=4 129 B9R0.5 CCCCC[C@H](O)/C=C/I CNP0530671.1 [0,1,0,0,0,0|1,0,2]=4 130 B9R0.5 CCCCC[C@H](O)CCC CNP0294811.1 [0,1,0,0,0,0|1,0,2]=4 131 B9R0.5 CCCCC[C@H](O)CCO CNP0370820.1 [0,1,0,0,0,0|0,0,2]=3 132 B9R0.5 CCCCOC(=O)CCC CNP0123594.0 [0,1,0,0,0,0|2,0,1]=4 133 B9R0.5 CCOC(=O)CCCSC CNP0002800.0 [0,1,0,0,0,0|3,0,0]=4 134 B9R0.18 CCCCC(=O)C=CC=O CNP0505457.0 [0,1,0,0,0,0|0,0,3]=4 135 B9R0.45 C#CC=CCCCCCC CNP0397372.0 [0,1,0,0,0,0|1,0,1]=3 136 B9R0.45 C#CCCCCCCCC CNP0272182.0 [0,1,0,0,0,0|1,0,2]=4 137 B9R0.45 C=CC=CC=CCCCC CNP0611960.0 [0,1,0,0,0,0|1,0,2]=4 138 B9R0.45 C=CC=CCCCCCC CNP0513469.0 [0,1,0,0,0,0|1,0,1]=3 139 B9R0.45 C=CCCCCC=CC=O CNP0336922.0 [0,1,0,0,0,0|0,0,3]=4 140 B9R0.45 C=CCCCCCCCC CNP0330037.0 [0,1,0,0,0,0|1,0,2]=4 141 B9R0.45 C=CCCCCCCCO CNP0326407.0 [0,1,0,0,0,0|0,0,3]=4 142 B9R0.45 CC=CC=CCCCCC CNP0327405.0 [0,1,0,0,0,0|1,0,1]=3 143 B9R0.45 CCC#CCCCCCC CNP0606734.0 [0,1,0,0,0,0|1,0,2]=4 144 B9R0.45 CCC=CCC=CCC=O CNP0146228.0 [0,1,0,0,0,0|0,0,3]=4 145 B9R0.45 CCC=CCC=CCCO CNP0184621.0 [0,1,0,0,0,0|0,0,2]=3 146 B9R0.45 CCC=CCCC=CC=O CNP0253048.0 [0,1,0,0,0,0|0,0,3]=4 147 B9R0.45 CCC=CCCC=CCO CNP0250471.0 [0,1,0,0,0,0|0,0,1]=2 148 B9R0.45 CCC=CCCCCC=O CNP0136988.0 [0,1,0,0,0,0|1,0,1]=3 149 B9R0.45 CCC=CCCCCCC CNP0223572.0 [0,1,0,0,0,0|1,0,0]=2 150 B9R0.45 CCC=CCCCCCO CNP0246173.0 [0,1,0,0,0,0|1,0,0]=2 151 B9R0.45 CCCC#CCCCCC CNP0576219.0 [0,1,0,0,0,0|1,0,2]=4 152 B9R0.45 CCCC=CCCCCC CNP0076954.0 [0,1,0,0,0,0|1,0,0]=2 153 B9R0.45 CCCCC=CC=CC=O CNP0175411.0 [0,1,0,0,0,0|0,0,3]=4 154 B9R0.45 CCCCC=CC=CCO CNP0116173.0 [0,1,0,0,0,0|0,0,1]=2 155 B9R0.45 CCCCC=CCCC=O CNP0314028.0 [0,1,0,0,0,0|0,0,3]=4 156 B9R0.45 CCCCCC=CCC=O CNP0158662.0 [0,1,0,0,0,0|0,0,1]=2 157 B9R0.45 CCCCCC=CCCO CNP0111850.0 [0,1,0,0,0,0|0,0,0]=1 158 B9R0.45 CCCCCCC#CCO CNP0485953.0 [0,1,0,0,0,0|0,0,2]=3 159 B9R0.45 CCCCCCC=CC=O CNP0163216.0 [0,1,0,0,0,0|0,0,2]=3 160 B9R0.45 CCCCCCC=CCO CNP0303395.0 [0,1,0,0,0,0|0,0,0]=1 161 B9R0.45 CCCCCCCC=C=O CNP0527715.0 [0,1,0,0,0,0|0,0,3]=4 162 B9R0.45 CCCCCCCC=CO CNP0085832.0 [0,1,0,0,0,0|0,0,2]=3 163 B9R0.45 CCCCCCCC=NO CNP0247046.0 [0,1,0,0,0,0|1,0,1]=3 164 B9R0.45 CCCCCCCCC#N CNP0309769.0 [0,1,0,0,0,0|1,0,2]=4 165 B9R0.45 CCCCCCCCC=O CNP0328165.0 [0,1,0,0,0,0|0,0,3]=4 166 B9R0.45 CCCCCCCCCC CNP0279708.0 [0,1,0,0,0,0|1,0,2]=4 167 B9R0.45 CCCCCCCCCI CNP0565198.0 [0,1,0,0,0,0|1,0,2]=4 168 B9R0.45 CCCCCCCCCO CNP0307663.0 [0,1,0,0,0,0|0,0,2]=3 169 B9R0.45 CCCCCCCCOC CNP0305574.0 [0,1,0,0,0,0|0,0,2]=3 170 B9R0.45 CCCCCCCOCC CNP0144632.0 [0,1,0,0,0,0|1,0,2]=4 171 B9R0.45 CCCCCCOCCC CNP0488672.0 [0,1,0,0,0,0|1,0,2]=4 172 B9R0.45 CCCCCOCCCC CNP0134382.0 [0,1,0,0,0,0|1,0,2]=4 173 B9R0.45 CCCCOCCCCO CNP0571704.0 [0,1,0,0,0,0|0,0,2]=3 174 B9R0.45 CCOCCOCCOC CNP0567615.0 [0,1,0,0,0,0|2,0,1]=4 175 B9R0.45 CSCCCCCC=NO CNP0405939.0 [0,1,0,0,0,0|1,0,1]=3 176 B9R0.45 NCCCCCCCCN CNP0462737.0 [0,1,0,0,0,0|1,0,2]=4 177 B9R0.45 OCCCCCCCCO CNP0076363.0 [0,1,0,0,0,0|0,0,2]=3 178 B9R0.45 OCCOCCOCCO CNP0560711.0 [0,1,0,0,0,0|2,0,1]=4 179 B9R0.45 SCCCCCCCCS CNP0058300.0 [0,1,0,0,0,0|0,1,2]=4 180 B9R0.46 C=CC(=O)CCCCCC CNP0199222.0 [0,1,0,0,0,0|1,0,2]=4 181 B9R0.46 CCC(=O)C=CC=CCO CNP0451824.0 [0,1,0,0,0,0|0,0,3]=4 182 B9R0.46 CCC=CCCC(=O)OC CNP0175025.0 [0,1,0,0,0,0|2,0,1]=4 183 B9R0.46 CCCCC=CC(=O)OC CNP0002590.0 [0,1,0,0,0,0|2,0,1]=4 184 B9R0.46 CCCCCC=C(C)C=O CNP0094185.0 [0,1,0,0,0,0|0,0,2]=3 185 B9R0.46 CCCCCCC(=NO)C CNP0380359.0 [0,1,0,0,0,0|1,0,1]=3 186 B9R0.46 CCCCCCC(=O)CC CNP0226154.0 [0,1,0,0,0,0|1,0,1]=3 187 B9R0.46 CCCCCCC(=O)NN CNP0349501.0 [0,1,0,0,0,0|2,0,1]=4 188 B9R0.46 CCCCCCC(=O)OC CNP0149439.0 [0,1,0,0,0,0|2,0,1]=4 189 B9R0.46 CCCCCCC(C)CO CNP0611666.0 [0,1,0,0,0,0|0,0,2]=3 190 B9R0.46 CCCCCC[C@@H](C)CC CNP0315749.1 [0,1,0,0,0,0|1,0,2]=4 191 B9R0.46 CCCCCC[C@@H](O)CC CNP0164339.1 [0,1,0,0,0,0|1,0,2]=4 192 B9R0.46 CCCCCC[C@@H](O)CO CNP0150758.1 [0,1,0,0,0,0|0,0,2]=3 193 B9R0.46 CCCCCC[C@H](O)CC CNP0164339.2 [0,1,0,0,0,0|1,0,2]=4 194 B9R0.46 CCCCCOC(=O)CC CNP0268077.0 [0,1,0,0,0,0|2,0,0]=3 195 B9R0.46 CC[C@H](C)CCCCCO CNP0220176.1 [0,1,0,0,0,0|0,0,2]=3 196 B9R0.46 CSCCCOC(=O)CS CNP0575609.0 [0,1,0,0,0,0|2,1,0]=4 197 B9R1.8 CC=CC1=NCCCC1 CNP0209420.0 [0,0,0,1,0,0|2,0,1]=4 198 B9R1.8 CCCC1=CCCCC1 CNP0080648.0 [0,0,0,1,0,0|1,0,2]=4 199 B9R1.8 CCCC1=NCCCC1 CNP0295908.0 [0,0,0,1,0,0|2,0,1]=4 200 B9R1.8 CCCC1CCCCC1 CNP0158548.0 [0,0,0,1,0,0|1,0,2]=4 201 B9R1.8 CCCN1CCCCC1 CNP0186645.0 [0,0,0,1,0,0|2,0,1]=4 202 B9R1.8 CCC[C@@H]1CCCCN1 CNP0295617.2 [0,0,0,1,0,0|1,0,2]=4 203 B9R1.8 CCC[C@H]1CCCCN1 CNP0295617.1 [0,0,0,1,0,0|1,0,2]=4 204 B9R1.8 NCCC1CCCCC1 CNP0424532.0 [0,0,0,1,0,0|1,0,2]=4 205 B9R1.8 OCCN1CCCCC1 CNP0303387.0 [0,0,0,1,0,0|1,0,1]=3 206 B9R1.8 OCC[C@@H]1CCCCN1 CNP0378251.2 [0,0,0,1,0,0|1,0,2]=4 207 B9R1.8 OCC[C@H]1CCCCN1 CNP0378251.1 [0,0,0,1,0,0|1,0,2]=4 208 B9R1.12 CCCCC1=CC=CO1 CNP0200391.0 [0,0,0,1,0,0|0,0,2]=3 209 B9R1.12 CCCCC1=CCCC1 CNP0610545.0 [0,0,0,1,0,0|1,0,2]=4 210 B9R1.12 CCCCC1=CN=CO1 CNP0072036.0 [0,0,0,1,0,0|1,0,2]=4 211 B9R1.12 CCCCC1=CSC=C1 CNP0227765.0 [0,0,0,1,0,0|2,0,1]=4 212 B9R1.12 CCCCC1NCCS1 CNP0050618.0 [0,0,0,1,0,0|1,1,1]=4 213 B9R1.12 CCCCN1C=CC=C1 CNP0209337.0 [0,0,0,1,0,0|2,0,1]=4 214 B9R1.12 CCCC[C@@H]1CCSC1 CNP0199750.1 [0,0,0,1,0,0|2,0,1]=4 215 B9R1.12 CCCC[C@H]1CCCO1 CNP0135592.1 [0,0,0,1,0,0|0,0,2]=3 216 B9R1.12 CCCSC1CCCC1 CNP0498612.0 [0,0,0,1,0,0|2,0,1]=4 217 B9R1.12 CCOCC1=CC=CO1 CNP0002487.0 [0,0,0,1,0,0|1,0,2]=4 218 B9R1.12 CCSCC1=CC=CO1 CNP0025241.0 [0,0,0,1,0,0|1,0,2]=4 219 B9R1.12 NCCCN1C=CCC1 CNP0592244.0 [0,0,0,1,0,0|3,0,0]=4 220 B9R1.14 CC[C@@H]1CCC=C1CO CNP0229914.1 [0,0,0,1,0,0|0,0,0]=1 221 B9R1.14 CC[C@H]1CCC=C1C=O CNP0161388.1 [0,0,0,1,0,0|0,0,2]=3 222 B9R1.15 CC[C@H]1CCCC[C@H]1C CNP0240068.1 [0,0,0,1,0,0|1,0,2]=4 223 B9R1.16 CCCCCC1CC1C CNP0611992.0 [0,0,0,1,0,0|1,0,2]=4 224 B9R1.17 CCCCC[C@@H]1CCS1 CNP0189963.1 [0,0,0,1,0,0|0,1,2]=4 225 B9R1.20 CCC1OC1C=CC=O CNP0007771.0 [0,0,0,1,0,0|1,0,2]=4 226 B9R1.50 CC1CCCCCCC1 CNP0421481.0 [0,0,0,1,0,0|1,0,2]=4 227 B9R1.103 C1CCCCCCCC1 CNP0112399.0 [0,0,0,1,0,0|1,0,2]=4 228 B6R0.6 C#CCCCCO CNP0289179.0 [2,0,0,0,0,0|0,0,2]=4 229 B6R0.6 C=CC=CCCC CNP0526826.0 [2,0,0,0,0,0|0,0,2]=4 230 B6R0.6 C=CCCC=CC CNP0426808.0 [2,0,0,0,0,0|0,0,2]=4 231 B6R0.6 C=CCCCC#N CNP0287374.0 [2,0,0,0,0,0|1,0,1]=4 232 B6R0.6 C=CCCCC=C CNP0115869.0 [2,0,0,0,0,0|0,0,2]=4 233 B6R0.6 C=CCCCCC CNP0226691.0 [2,0,0,0,0,0|0,0,0]=2 234 B6R0.6 C=CCCCCO CNP0162421.0 [2,0,0,0,0,0|1,0,0]=3 235 B6R0.6 C=CCOCCO CNP0248950.0 [2,0,0,0,0,0|2,0,0]=4 236 B6R0.6 C=CCSCCC CNP0150756.0 [2,0,0,0,0,0|1,0,0]=3 237 B6R0.6 C=COCCCC CNP0077236.0 [2,0,0,0,0,0|1,0,0]=3 238 B6R0.6 CC#CC=CCO CNP0610509.0 [2,0,0,0,0,0|0,0,2]=4 239 B6R0.6 CC#CCCCO CNP0320046.0 [2,0,0,0,0,0|0,0,2]=4 240 B6R0.6 CC=CC=CCC CNP0608489.0 [2,0,0,0,0,0|0,0,2]=4 241 B6R0.6 CC=CC=CCO CNP0292375.0 [2,0,0,0,0,0|0,0,2]=4 242 B6R0.6 CC=CCCC=O CNP0056069.0 [2,0,0,0,0,0|1,0,1]=4 243 B6R0.6 CC=CCCCC CNP0158475.0 [2,0,0,0,0,0|0,0,0]=2 244 B6R0.6 CC=CCCCO CNP0309139.0 [2,0,0,0,0,0|1,0,0]=3 245 B6R0.6 CC=CCSCC CNP0575773.0 [2,0,0,0,0,0|1,0,0]=3 246 B6R0.6 CC=CSCCC CNP0320861.0 [2,0,0,0,0,0|1,0,0]=3 247 B6R0.6 CC=CSSCC CNP0418756.0 [2,0,0,0,0,0|2,0,0]=4 248 B6R0.6 CCC#CCCO CNP0170517.0 [2,0,0,0,0,0|0,0,2]=4 249 B6R0.6 CCC=CCCC CNP0391454.0 [2,0,0,0,0,0|1,0,0]=3 250 B6R0.6 CCC=CCCO CNP0255718.0 [2,0,0,0,0,0|0,0,2]=4 251 B6R0.6 CCCC#CCO CNP0314465.0 [2,0,0,0,0,0|0,0,2]=4 252 B6R0.6 CCCC=CC=O CNP0263913.0 [2,0,0,0,0,0|0,0,2]=4 253 B6R0.6 CCCC=CCO CNP0254124.0 [2,0,0,0,0,0|0,0,0]=2 254 B6R0.6 CCCC=CNO CNP0162409.0 [2,0,0,0,0,0|1,0,0]=3 255 B6R0.6 CCCCC=CO CNP0511187.0 [2,0,0,0,0,0|0,0,0]=2 256 B6R0.6 CCCCC=NO CNP0149695.0 [2,0,0,0,0,0|1,0,0]=3 257 B6R0.6 CCCCCC#N CNP0412353.0 [2,0,0,0,0,0|1,0,1]=4 258 B6R0.6 CCCCCC=O CNP0304790.0 [2,0,0,0,0,0|0,0,1]=3 259 B6R0.6 CCCCCCC CNP0290800.0 [2,0,0,0,0,0|0,0,1]=3 260 B6R0.6 CCCCCCN CNP0213933.0 [2,0,0,0,0,0|1,0,0]=3 261 B6R0.6 CCCCCCO CNP0317600.0 [2,0,0,0,0,0|0,0,0]=2 262 B6R0.6 CCCCCCS CNP0167948.0 [2,0,0,0,0,0|0,1,0]=3 263 B6R0.6 CCCCCC[O-] CNP0579903.0 [2,0,0,0,0,0|0,0,1]=3 264 B6R0.6 CCCCCNC CNP0276164.0 [2,0,0,0,0,0|1,0,0]=3 265 B6R0.6 CCCCCOC CNP0358174.0 [2,0,0,0,0,0|1,0,0]=3 266 B6R0.6 CCCCCSC CNP0293012.0 [2,0,0,0,0,0|1,0,0]=3 267 B6R0.6 CCCCCSS CNP0228282.0 [2,0,0,0,0,0|1,1,0]=4 268 B6R0.6 CCCCNC=O CNP0082472.0 [2,0,0,0,0,0|1,0,1]=4 269 B6R0.6 CCCCOC=O CNP0282325.0 [2,0,0,0,0,0|1,0,1]=4 270 B6R0.6 CCCCSSC CNP0532819.0 [2,0,0,0,0,0|2,0,0]=4 271 B6R0.6 CCCNCCC CNP0129820.0 [2,0,0,0,0,0|1,0,1]=4 272 B6R0.6 CCCOCCO CNP0079853.0 [2,0,0,0,0,0|1,0,0]=3 273 B6R0.6 CCCSCCC CNP0173387.0 [2,0,0,0,0,0|1,0,1]=4 274 B6R0.6 CCOCCCO CNP0304052.0 [2,0,0,0,0,0|1,0,0]=3 275 B6R0.6 CCOCCCS CNP0267296.0 [2,0,0,0,0,0|1,1,0]=4 276 B6R0.6 CCSCCCO CNP0355297.0 [2,0,0,0,0,0|1,0,0]=3 277 B6R0.6 CNCCCCN CNP0157274.0 [2,0,0,0,0,0|2,0,0]=4 278 B6R0.6 COCCCCO CNP0570905.0 [2,0,0,0,0,0|1,0,0]=3 279 B6R0.6 CSCCCC=O CNP0002814.0 [2,0,0,0,0,0|1,0,1]=4 280 B6R0.6 CSCCCCO CNP0002400.0 [2,0,0,0,0,0|1,0,0]=3 281 B6R0.6 NCCCCC=O CNP0083786.0 [2,0,0,0,0,0|1,0,1]=4 282 B6R0.6 NCCCCCN CNP0184259.0 [2,0,0,0,0,0|2,0,0]=4 283 B6R0.6 NCCCCCO CNP0032450.0 [2,0,0,0,0,0|1,0,0]=3 284 B6R0.6 OCCCCCO CNP0201249.0 [2,0,0,0,0,0|1,0,0]=3 285 B6R0.6 OCCNCCO CNP0247543.0 [2,0,0,0,0,0|2,0,0]=4 286 B6R0.6 OCCOCCO CNP0333860.0 [2,0,0,0,0,0|2,0,0]=4 287 B6R0.6 OCCSCCO CNP0335773.0 [2,0,0,0,0,0|2,0,0]=4 288 B8R0.1 C/C=C/S[S@@+]([O-])CCC CNP0575690.1 [1,1,0,0,0,0|2,0,0]=4 289 B8R0.1 C/C=C/S[S@@H+]([O-])CCC CNP0552206.2 [1,1,0,0,0,0|2,0,0]=4 290 B8R0.1 C/C=C\S[S@@+]([O-])CCC CNP0575690.2 [1,1,0,0,0,0|2,0,0]=4 291 B8R0.1 C/C=C\S[S@@H+]([O-])CCC CNP0552206.1 [1,1,0,0,0,0|2,0,0]=4 292 B8R0.1 C=CCC(O)CCCC CNP0566566.0 [1,1,0,0,0,0|0,0,2]=4 293 B8R0.1 C=CCC[C@@H](O)CCC CNP0196626.2 [1,1,0,0,0,0|0,0,2]=4 294 B8R0.1 C=CCC[C@H](O)CCC CNP0196626.1 [1,1,0,0,0,0|0,0,2]=4 295 B8R0.1 CC=CC(=O)CCCC CNP0170062.0 [1,1,0,0,0,0|0,0,1]=3 296 B8R0.1 CC=CCC(O)CCC CNP0497599.0 [1,1,0,0,0,0|0,0,0]=2 297 B8R0.1 CC=C[S+]([O-])SCCC CNP0526768.0 [1,1,0,0,0,0|2,0,0]=4 298 B8R0.1 CCCC(S)CCOC CNP0309037.0 [1,1,0,0,0,0|1,0,1]=4 299 B8R0.1 CCCCC(=O)CCC CNP0094009.0 [1,1,0,0,0,0|1,0,1]=4 300 B8R0.1 CCCCC(=O)OCC CNP0305309.0 [1,1,0,0,0,0|2,0,0]=4 301 B8R0.1 CCCC[C@H](C)CCC CNP0319238.1 [1,1,0,0,0,0|0,0,2]=4 302 B8R0.1 CCCC[C@H](O)CCC CNP0195357.1 [1,1,0,0,0,0|0,0,2]=4 303 B8R0.1 CCC[C@@H](C)CCCO CNP0421179.1 [1,1,0,0,0,0|0,0,1]=3 304 B8R0.6 C/C=C/SS[C@@H](C)CC CNP0144239.2 [1,1,0,0,0,0|2,0,0]=4 305 B8R0.6 C/C=C/SS[C@H](C)CC CNP0144239.1 [1,1,0,0,0,0|2,0,0]=4 306 B8R0.6 C=C/C=C/C[C@@H](O)CC CNP0111880.1 [1,1,0,0,0,0|0,0,2]=4 307 B8R0.6 C=CC(=O)CCCCC CNP0297364.0 [1,1,0,0,0,0|0,0,1]=3 308 B8R0.6 C=CC(=O)OCCCC CNP0191898.0 [1,1,0,0,0,0|1,0,1]=4 309 B8R0.6 C=CC(O)CCC=CC CNP0288913.0 [1,1,0,0,0,0|0,0,2]=4 310 B8R0.6 C=C[C@@H](O)CCCCC CNP0246419.1 [1,1,0,0,0,0|0,0,2]=4 311 B8R0.6 C=C[C@H](O)CCCCC CNP0246419.2 [1,1,0,0,0,0|0,0,2]=4 312 B8R0.6 CC=C(O)CCCCC CNP0174345.0 [1,1,0,0,0,0|0,0,0]=2 313 B8R0.6 CCC(C)OCCCO CNP0593328.0 [1,1,0,0,0,0|1,0,1]=4 314 B8R0.6 CCCC=CC(=O)CC CNP0017905.0 [1,1,0,0,0,0|1,0,1]=4 315 B8R0.6 CCCCC=C(C)C=O CNP0586407.0 [1,1,0,0,0,0|0,0,2]=4 316 B8R0.6 CCCCCC(=NO)C CNP0241223.0 [1,1,0,0,0,0|1,0,0]=3 317 B8R0.6 CCCCCC(=O)CC CNP0381627.0 [1,1,0,0,0,0|0,0,1]=3 318 B8R0.6 CCCCCC(=O)CO CNP0546319.0 [1,1,0,0,0,0|0,0,0]=2 319 B8R0.6 CCCCCC(=O)OC CNP0192346.0 [1,1,0,0,0,0|1,0,0]=3 320 B8R0.6 CCCCCC(=O)SC CNP0018085.0 [1,1,0,0,0,0|1,0,0]=3 321 B8R0.6 CCCCCC(S)SC CNP0002612.0 [1,1,0,0,0,0|1,0,1]=4 322 B8R0.6 CCCCC[C@@H](O)CC CNP0204116.1 [1,1,0,0,0,0|0,0,2]=4 323 B8R0.6 CCCCC[C@H](C)CC CNP0121781.1 [1,1,0,0,0,0|0,0,2]=4 324 B8R0.6 CCCCC[C@H](O)CC CNP0204116.2 [1,1,0,0,0,0|0,0,2]=4 325 B8R0.6 CCCCC[C@H](O)CO CNP0528306.1 [1,1,0,0,0,0|0,0,1]=3 326 B8R0.6 CCCCNC(=N)NO CNP0535503.0 [1,1,0,0,0,0|2,0,0]=4 327 B8R0.6 CCCCOC(=O)CC CNP0139208.0 [1,1,0,0,0,0|1,0,1]=4 328 B8R0.6 CC[C@@H](C)CCCCO CNP0076966.2 [1,1,0,0,0,0|0,0,1]=3 329 B8R0.6 CC[C@H](C)CCCCO CNP0076966.1 [1,1,0,0,0,0|0,0,1]=3 330 B8R0.6 COC(=O)CCCSC CNP0313998.0 [1,1,0,0,0,0|2,0,0]=4 331 B8R0.6 COCCCC(=O)OC CNP0580088.0 [1,1,0,0,0,0|2,0,0]=4 332 B8R0.7 C=C(O)CCCCCC CNP0584840.0 [1,1,0,0,0,0|0,0,1]=3 333 B8R0.7 C=CCCCCC(C)O CNP0002843.0 [1,1,0,0,0,0|0,0,2]=4 334 B8R0.7 CC(=CCCCC=O)C CNP0514464.0 [1,1,0,0,0,0|1,0,1]=4 335 B8R0.7 CC(=O)NCCCCN CNP0279373.0 [1,1,0,0,0,0|2,0,0]=4 336 B8R0.7 CC(C)CCCCC=O CNP0244483.0 [1,1,0,0,0,0|0,0,2]=4 337 B8R0.7 CC(C)CCCCCO CNP0090200.0 [1,1,0,0,0,0|0,0,1]=3 338 B8R0.7 CC(C)OCCCCO CNP0461229.0 [1,1,0,0,0,0|1,0,1]=4 339 B8R0.7 CC/C=C/C=C/[C@H](C)O CNP0374184.1 [1,1,0,0,0,0|0,0,2]=4 340 B8R0.7 CC=CCCCC(=O)C CNP0074972.0 [1,1,0,0,0,0|0,0,1]=3 341 B8R0.7 CC=CCCCC(=O)O CNP0248463.0 [1,1,0,0,0,0|1,0,1]=4 342 B8R0.7 CCC=CCCC(=O)C CNP0225225.0 [1,1,0,0,0,0|1,0,1]=4 343 B8R0.7 CCCCC=CC(=O)C CNP0125606.0 [1,1,0,0,0,0|0,0,1]=3 344 B8R0.7 CCCCC=CC(=O)O CNP0199006.0 [1,1,0,0,0,0|0,0,1]=3 345 B8R0.7 CCCCC=CC(C)O CNP0003219.0 [1,1,0,0,0,0|0,0,0]=2 346 B8R0.7 CCCCCC=C(C)C CNP0153071.0 [1,1,0,0,0,0|0,0,0]=2 347 B8R0.7 CCCCCC=C(C)O CNP0546798.0 [1,1,0,0,0,0|0,0,0]=2 348 B8R0.7 CCCCCCC(=O)C CNP0325160.0 [1,1,0,0,0,0|0,0,1]=3 349 B8R0.7 CCCCCCC(=O)Cl CNP0211048.0 [1,1,0,0,0,0|0,0,2]=4 350 B8R0.7 CCCCCCC(=O)N CNP0248097.0 [1,1,0,0,0,0|0,0,2]=4 351 B8R0.7 CCCCCCC(=O)O CNP0141686.0 [1,1,0,0,0,0|0,0,1]=3 352 B8R0.7 CCCCCCC(C)C CNP0161146.0 [1,1,0,0,0,0|0,0,2]=4 353 B8R0.7 CCCCCC[C@@H](C)Cl CNP0248103.2 [1,1,0,0,0,0|0,0,2]=4 354 B8R0.7 CCCCCC[C@@H](C)O CNP0419289.1 [1,1,0,0,0,0|0,0,1]=3 355 B8R0.7 CCCCCC[C@H](C)Cl CNP0248103.1 [1,1,0,0,0,0|0,0,2]=4 356 B8R0.7 CCCCCC[C@H](C)O CNP0419289.2 [1,1,0,0,0,0|0,0,1]=3 357 B8R0.7 CCCCCC[N+](=O)O CNP0515303.0 [1,1,0,0,0,0|1,0,1]=4 358 B8R0.7 CCCCCOC(=O)C CNP0227990.0 [1,1,0,0,0,0|1,0,0]=3 359 B8R0.7 CCCCOCC(=O)O CNP0524848.0 [1,1,0,0,0,0|1,0,1]=4 360 B8R0.7 CCCCOCC(C)O CNP0506345.0 [1,1,0,0,0,0|1,0,1]=4 361 B8R0.7 CCCOCCC(=O)C CNP0376956.0 [1,1,0,0,0,0|1,0,1]=4 362 B8R0.7 CCOCC=CC(C)C CNP0076367.0 [1,1,0,0,0,0|2,0,0]=4 363 B8R0.7 COCCCOC(=O)C CNP0076800.0 [1,1,0,0,0,0|2,0,0]=4 364 B8R0.7 CSCCCOC(=O)C CNP0179840.0 [1,1,0,0,0,0|2,0,0]=4 365 B8R0.7 NCCCCCC(=O)O CNP0337210.0 [1,1,0,0,0,0|1,0,1]=4 366 B8R0.7 O=C(O)CCCCCO CNP0079830.0 [1,1,0,0,0,0|1,0,1]=4 367 B10R0.3 C=C(C)CCCC(=C)CCO CNP0253659.0 [0,2,0,0,0,0|0,0,2]=4 368 B10R0.3 C=C(CCO)CCCC(C)C CNP0310766.0 [0,2,0,0,0,0|0,0,1]=3 369 B10R0.3 CC(=CCCC(=CCO)C)C CNP0244258.0 [0,2,0,0,0,0|0,0,2]=4 370 B10R0.3 CC(=CCO)CCCC(C)C CNP0076235.0 [0,2,0,0,0,0|0,0,0]=2 371 B10R0.3 CC(C)CCC[C@@H](C)CCO CNP0232963.2 [0,2,0,0,0,0|0,0,2]=4 372 B10R0.3 CC(C)CCC[C@H](C)CCO CNP0232963.1 [0,2,0,0,0,0|0,0,2]=4 373 B10R0.3 CCOC(=O)CCCC(C)C CNP0181211.0 [0,2,0,0,0,0|2,0,0]=4 374 B10R0.3 CCOC(=O)CCCC(C)O CNP0612036.0 [0,2,0,0,0,0|2,0,0]=4 375 B10R0.3 C[C@H](O)CCC[C@@H](O)CCO CNP0334179.1 [0,2,0,0,0,0|0,0,2]=4 376 B10R0.4 CC(=O)CCCCCCCO CNP0300431.0 [0,2,0,0,0,0|0,0,2]=4 377 B10R0.4 CCC=CCCC=CC(=O)O CNP0115427.0 [0,2,0,0,0,0|0,0,2]=4 378 B10R0.4 CCCC=CCCCC(=O)C CNP0301086.0 [0,2,0,0,0,0|1,0,1]=4 379 B10R0.4 CCCCC=CC=CC(=O)O CNP0140423.0 [0,2,0,0,0,0|0,0,2]=4 380 B10R0.4 CCCCCC#CCC(=O)O CNP0483234.0 [0,2,0,0,0,0|0,0,2]=4 381 B10R0.4 CCCCCC=CCC(=O)Cl CNP0233284.0 [0,2,0,0,0,0|0,0,1]=3 382 B10R0.4 CCCCCC=CCC(=O)O CNP0118439.0 [0,2,0,0,0,0|0,0,0]=2 383 B10R0.4 CCCCCC=COC(=O)C CNP0612173.0 [0,2,0,0,0,0|0,0,2]=4 384 B10R0.4 CCCCCCC#C[C@H](C)O CNP0076972.1 [0,2,0,0,0,0|0,0,2]=4 385 B10R0.4 CCCCCCC=CC(=O)C CNP0080012.0 [0,2,0,0,0,0|0,0,2]=4 386 B10R0.4 CCCCCCC=CC(=O)Cl CNP0311075.0 [0,2,0,0,0,0|0,0,2]=4 387 B10R0.4 CCCCCCC=CC(=O)N CNP0333692.0 [0,2,0,0,0,0|0,0,2]=4 388 B10R0.4 CCCCCCC=CC(=O)O CNP0197358.0 [0,2,0,0,0,0|0,0,1]=3 389 B10R0.4 CCCCCCC=CC(C)O CNP0160624.0 [0,2,0,0,0,0|0,0,0]=2 390 B10R0.4 CCCCCCCCC(=O)O CNP0128686.0 [0,2,0,0,0,0|0,0,2]=4 391 B10R0.4 CCCCCCCC[C@@H](C)O CNP0256065.2 [0,2,0,0,0,0|0,0,2]=4 392 B10R0.4 CCCCCCCC[C@H](C)O CNP0256065.1 [0,2,0,0,0,0|0,0,2]=4 393 B10R0.4 CCCCOCCOC(C)O CNP0572466.0 [0,2,0,0,0,0|1,0,1]=4 394 B10R0.6 CCCCCC(=O)C=C(C)C CNP0610551.0 [0,2,0,0,0,0|1,0,1]=4 395 B10R0.6 CCCCCC(=O)CC(=O)O CNP0414310.0 [0,2,0,0,0,0|0,0,2]=4 396 B10R0.6 CCCCCC(=O)OC(C)C CNP0202716.0 [0,2,0,0,0,0|2,0,0]=4 397 B10R0.6 CCCCOC(=O)C[C@@H](C)O CNP0226564.2 [0,2,0,0,0,0|1,0,1]=4 398 B10R0.6 CCCCOC(=O)C[C@H](C)O CNP0226564.1 [0,2,0,0,0,0|1,0,1]=4 399 B10R0.55 CC(=CCCC=C(C)CO)C CNP0180707.0 [0,2,0,0,0,0|0,0,2]=4 400 B10R0.55 CC(C)CCCCC(C)CO CNP0444832.0 [0,2,0,0,0,0|0,0,2]=4 401 B10R0.55 CCC(C)CCCCC(C)O CNP0367529.0 [0,2,0,0,0,0|0,0,2]=4 402 B10R0.74 C=CC(O)CCCCCCC CNP0002593.0 [0,2,0,0,0,0|0,0,2]=4 403 B10R0.74 CCC=CCCCC(=O)OC CNP0397287.0 [0,2,0,0,0,0|1,0,1]=4 404 B10R0.74 CCC=CCCOC(=O)CC CNP0215397.0 [0,2,0,0,0,0|1,0,1]=4 405 B10R0.74 CCCCCC=CC(=O)OC CNP0344359.0 [0,2,0,0,0,0|0,0,1]=3 406 B10R0.74 CCCCCCCC(=NO)C CNP0204535.0 [0,2,0,0,0,0|1,0,1]=4 407 B10R0.74 CCCCCCCC(=O)CC CNP0252003.0 [0,2,0,0,0,0|1,0,1]=4 408 B10R0.74 CCCCCCCC(=O)OO CNP0355653.0 [0,2,0,0,0,0|1,0,1]=4 409 B10R0.74 CCCCCCCC(C)OC CNP0223394.0 [0,2,0,0,0,0|0,0,2]=4 410 B10R0.74 CCCCCCC[C@@H](O)CC CNP0233369.2 [0,2,0,0,0,0|0,0,2]=4 411 B10R0.74 CCCCCCC[C@H](O)CC CNP0233369.1 [0,2,0,0,0,0|0,0,2]=4 412 B10R0.74 CCCCCCOC(=O)CC CNP0139015.0 [0,2,0,0,0,0|1,0,1]=4 413 B10R0.75 CC(O)C(O)C=CC=CCO CNP0071798.0 [0,2,0,0,0,0|0,0,2]=4 414 B10R0.75 CCCCCCC(=O)C(=O)O CNP0261297.0 [0,2,0,0,0,0|0,0,2]=4 415 B10R0.75 CCCCCOC(=O)C(C)C CNP0172576.0 [0,2,0,0,0,0|2,0,0]=4 416 B10R0.97 CC(C)CCCCCC(C)O CNP0127696.0 [0,2,0,0,0,0|0,0,2]=4 417 B10R0.97 CC(O)CCCC=CC(=O)O CNP0535647.0 [0,2,0,0,0,0|0,0,1]=3 418 B10R0.1 CCC=CCCC(=O)OCC CNP0128665.0 [0,2,0,0,0,0|1,0,1]=4 419 B10R0.1 CCCC(=O)CCCCCO CNP0177163.0 [0,2,0,0,0,0|0,0,2]=4 420 B10R0.1 CCCC=CCC(C)CCC CNP0147977.0 [0,2,0,0,0,0|1,0,0]=3 421 B10R0.1 CCCCC=CC(=O)OCC CNP0074971.0 [0,2,0,0,0,0|1,0,1]=4 422 B10R0.1 CCCCCCC(=O)CCO CNP0040088.0 [0,2,0,0,0,0|0,0,1]=3 423 B10R0.1 CCCCCCC(=O)OCC CNP0228643.0 [0,2,0,0,0,0|1,0,1]=4 424 B10R0.1 CCCCCC[C@@H](O)CCO CNP0217557.2 [0,2,0,0,0,0|0,0,2]=4 425 B10R0.1 CCCCCC[C@H](O)CCO CNP0217557.1 [0,2,0,0,0,0|0,0,2]=4 426 B10R0.1 CCCCCOC(=O)CCC CNP0232104.0 [0,2,0,0,0,0|1,0,1]=4 427 B10R0.1 CCOC(=O)CCCCSC CNP0264286.0 [0,2,0,0,0,0|2,0,0]=4 428 B10R0.2 CCCC(O)CC(=O)OCC CNP0256152.0 [0,2,0,0,0,0|2,0,0]=4 429 B10R0.19 CCCCC(O)C(=O)OCC CNP0612227.0 [0,2,0,0,0,0|2,0,0]=4 430 B10R0.19 CCCC[C@H](Br)C(=O)OCC CNP0154903.1 [0,2,0,0,0,0|2,0,0]=4 431 B10R0.83 CC=C(C)C(=O)CCCCC CNP0394780.0 [0,2,0,0,0,0|1,0,1]=4 432 B10R0.91 C=CCOC(=O)CCCCC CNP0190608.0 [0,2,0,0,0,0|2,0,0]=4 433 B10R0.91 C=CCSC(=O)CCCCC CNP0018361.0 [0,2,0,0,0,0|2,0,0]=4 434 B10R0.91 CCC=CC(=O)CCCCC CNP0076921.0 [0,2,0,0,0,0|1,0,0]=3 435 B10R0.91 CCCCC(=O)CCCCO CNP0289121.0 [0,2,0,0,0,0|0,0,2]=4 436 B10R0.91 CCCCCC(=O)C#CCO CNP0412381.0 [0,2,0,0,0,0|0,0,1]=3 437 B10R0.91 CCCCCC(=O)C=CC=O CNP0346772.0 [0,2,0,0,0,0|0,0,2]=4 438 B10R0.91 CCCCCC(=O)C=CCO CNP0135755.0 [0,2,0,0,0,0|0,0,0]=2 439 B10R0.91 CCCCCC(=O)CCC=O CNP0301067.0 [0,2,0,0,0,0|0,0,2]=4 440 B10R0.91 CCCCCC(=O)CCCC CNP0609052.0 [0,2,0,0,0,0|1,0,1]=4 441 B10R0.91 CCCCCC(=O)OCCC CNP0003080.0 [0,2,0,0,0,0|1,0,1]=4 442 B10R0.91 CCCCCC(=O)OCSC CNP0354839.0 [0,2,0,0,0,0|1,1,0]=4 443 B10R0.91 CCCCCC(=O)SCCC CNP0018084.0 [0,2,0,0,0,0|1,0,1]=4 444 B10R0.91 CCCCC[C@@H](C)CCCO CNP0181655.1 [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|0,0,2]=4 446 B10R0.91 CCCCC[C@H](C)CCCO CNP0181655.2 [0,2,0,0,0,0|0,0,2]=4 447 B10R0.91 CCCCC[C@H](O)/C=C/C=O CNP0377024.1 [0,2,0,0,0,0|0,0,2]=4 448 B10R0.71 C#CC=CC#CCCCCC CNP0547253.0 [0,2,0,0,0,0|1,0,1]=4 449 B10R0.71 C=CC=CC=CCCCCC CNP0263390.0 [0,2,0,0,0,0|1,0,1]=4 450 B10R0.71 C=CCC=CCCCCCC CNP0017831.0 [0,2,0,0,0,0|1,0,0]=3 451 B10R0.71 C=CCCC=CCCCCC CNP0165546.0 [0,2,0,0,0,0|1,0,0]=3 452 B10R0.71 C=CCCCCCC=CC=O CNP0192326.0 [0,2,0,0,0,0|0,0,2]=4 453 B10R0.71 C=CCCCCCCCCO CNP0359327.0 [0,2,0,0,0,0|0,0,2]=4 454 B10R0.71 CCC#CC=CCCCCC CNP0109430.0 [0,2,0,0,0,0|1,0,0]=3 455 B10R0.71 CCC=CCC=CCCCO CNP0129828.0 [0,2,0,0,0,0|0,0,2]=4 456 B10R0.71 CCC=CCCCC=CCO CNP0166267.0 [0,2,0,0,0,0|0,0,0]=2 457 B10R0.71 CCC=CCCCCCCC CNP0194721.0 [0,2,0,0,0,0|1,0,0]=3 458 B10R0.71 CCC=CCCCCCCO CNP0316558.0 [0,2,0,0,0,0|1,0,0]=3 459 B10R0.71 CCCC#CC#CC=CCO CNP0140972.0 [0,2,0,0,0,0|0,0,2]=4 460 B10R0.71 CCCC=CC#CC=CCO CNP0251903.0 [0,2,0,0,0,0|0,0,2]=4 461 B10R0.71 CCCC=CCCCCC=O CNP0001519.0 [0,2,0,0,0,0|1,0,1]=4 462 B10R0.71 CCCC=CCCCCCC CNP0153165.0 [0,2,0,0,0,0|1,0,0]=3 463 B10R0.71 CCCC=CCOCCCC CNP0076694.0 [0,2,0,0,0,0|1,0,0]=3 464 B10R0.71 CCCCC=CCCCCC CNP0245948.0 [0,2,0,0,0,0|1,0,0]=3 465 B10R0.71 CCCCC=CCCCCO CNP0201281.0 [0,2,0,0,0,0|0,0,2]=4 466 B10R0.71 CCCCCC=CC=CC=O CNP0213382.0 [0,2,0,0,0,0|0,0,2]=4 467 B10R0.71 CCCCCC=CC=CCO CNP0002926.0 [0,2,0,0,0,0|0,0,0]=2 468 B10R0.71 CCCCCC=CCCC=O CNP0153870.0 [0,2,0,0,0,0|0,0,1]=3 469 B10R0.71 CCCCCC=CCCCO CNP0003298.0 [0,2,0,0,0,0|0,0,0]=2 470 B10R0.71 CCCCCCC=CCCO CNP0105271.0 [0,2,0,0,0,0|0,0,0]=2 471 B10R0.71 CCCCCCCC#CCO CNP0354632.0 [0,2,0,0,0,0|0,0,2]=4 472 B10R0.71 CCCCCCCC=CC=O CNP0164061.0 [0,2,0,0,0,0|0,0,2]=4 473 B10R0.71 CCCCCCCC=CCO CNP0212450.0 [0,2,0,0,0,0|0,0,0]=2 474 B10R0.71 CCCCCCCCC=NO CNP0307594.0 [0,2,0,0,0,0|0,0,2]=4 475 B10R0.71 CCCCCCCCCCO CNP0305576.0 [0,2,0,0,0,0|0,0,2]=4 476 B10R0.71 CCCCCCCCCOC CNP0246631.0 [0,2,0,0,0,0|0,0,2]=4 477 B10R0.71 CCCCCCCCOC=O CNP0223737.0 [0,2,0,0,0,0|0,0,2]=4 478 B10R0.71 CCCCCCCCOCC CNP0319929.0 [0,2,0,0,0,0|0,0,2]=4 479 B10R0.71 CCCCOCCOCCO CNP0079968.0 [0,2,0,0,0,0|0,0,2]=4 480 B10R0.71 COCCOCCOCCO CNP0413334.0 [0,2,0,0,0,0|1,0,1]=4 481 B10R0.71 CSCCCCCCC=NO CNP0274006.0 [0,2,0,0,0,0|1,0,1]=4 482 B10R0.71 OCCCCCCCCCO CNP0496013.0 [0,2,0,0,0,0|0,0,2]=4 483 B10R0.41 CCCCCCC(=NO)CC CNP0390787.0 [0,2,0,0,0,0|1,0,1]=4 484 B10R0.59 CC/C(=C/CC[C@@H](O)CC)/C CNP0213896.1 [0,2,0,0,0,0|1,0,0]=3 485 B10R0.59 CC/C(=C/CC[C@H](O)CC)/C CNP0213896.2 [0,2,0,0,0,0|1,0,0]=3 486 B10R0.59 CC=C(C)CCC=C(C)CO CNP0514784.0 [0,2,0,0,0,0|0,0,2]=4 487 B8R1.2 C=CC1=CCCCC1 CNP0552641.0 [1,0,0,1,0,0|0,0,2]=4 488 B8R1.2 CCC1=CCCCC1 CNP0080676.0 [1,0,0,1,0,0|1,0,0]=3 489 B8R1.2 CCC1CCCCC1 CNP0300322.0 [1,0,0,1,0,0|0,0,2]=4 490 B8R1.2 CC[C@@H]1CC=CSS1 CNP0334028.1 [1,0,0,1,0,0|1,1,0]=4 491 B8R1.2 CC[C@@H]1CCCCO1 CNP0273678.2 [1,0,0,1,0,0|0,0,1]=3 492 B8R1.2 CC[C@H]1C=CCCC1 CNP0103483.1 [1,0,0,1,0,0|0,0,2]=4 493 B8R1.2 CC[C@H]1CCCCO1 CNP0273678.1 [1,0,0,1,0,0|0,0,1]=3 494 B8R1.2 CNC1CCCCC1 CNP0474937.0 [1,0,0,1,0,0|1,0,1]=4 495 B8R1.2 COC1=CCCCC1 CNP0354574.0 [1,0,0,1,0,0|1,0,1]=4 496 B8R1.2 N=C=C1CCCCC1 CNP0105477.0 [1,0,0,1,0,0|1,0,1]=4 497 B8R1.2 NCC1CCCCC1 CNP0581484.0 [1,0,0,1,0,0|1,0,1]=4 498 B8R1.2 O=CC1=CCCCC1 CNP0075083.0 [1,0,0,1,0,0|0,0,2]=4 499 B8R1.2 O=CC1CC=CCC1 CNP0106039.0 [1,0,0,1,0,0|1,0,1]=4 500 B8R1.2 O=CC1CCCCC1 CNP0419979.0 [1,0,0,1,0,0|0,0,2]=4 501 B8R1.2 O=CN1CCCCC1 CNP0187689.0 [1,0,0,1,0,0|1,0,1]=4 502 B8R1.2 OCC1=CC=CCC1 CNP0584064.0 [1,0,0,1,0,0|0,0,2]=4 503 B8R1.2 OCC1=CCCCC1 CNP0075365.0 [1,0,0,1,0,0|0,0,0]=2 504 B8R1.2 OCC1C=CCCC1 CNP0213790.0 [1,0,0,1,0,0|0,0,2]=4 505 B8R1.2 OCC1CCCCN1 CNP0335046.0 [1,0,0,1,0,0|1,0,1]=4 506 B8R1.2 OC[C@@H]1CC=CCC1 CNP0119836.2 [1,0,0,1,0,0|1,0,0]=3 507 B8R1.2 OC[C@@H]1CCCOC1 CNP0568032.1 [1,0,0,1,0,0|1,0,1]=4 508 B8R1.2 OC[C@H]1CC=CCC1 CNP0119836.1 [1,0,0,1,0,0|1,0,0]=3 509 B8R1.2 OC[C@H]1CCCCO1 CNP0281977.1 [1,0,0,1,0,0|1,0,1]=4 510 B8R1.2 OC[C@H]1CCCOC1 CNP0568032.2 [1,0,0,1,0,0|1,0,1]=4 511 B8R1.2 ON=C1CCCCC1 CNP0102527.0 [1,0,0,1,0,0|1,0,0]=3 512 B8R1.5 C=C1CCCCC1C CNP0595985.0 [1,0,0,1,0,0|0,0,2]=4 513 B8R1.5 CC1=CCCC[C@@H]1O CNP0368729.1 [1,0,0,1,0,0|1,0,0]=3 514 B8R1.5 CC1CCCC=C1Cl CNP0566805.0 [1,0,0,1,0,0|1,0,0]=3 515 B8R1.5 CC1CCCCC1=O CNP0003363.0 [1,0,0,1,0,0|0,0,2]=4 516 B8R1.5 CC1CCCCC1O CNP0610101.0 [1,0,0,1,0,0|0,0,1]=3 517 B8R1.5 CC1CCCOC1=O CNP0340524.0 [1,0,0,1,0,0|1,0,1]=4 518 B8R1.5 C[C@@H]1CCCC[C@@H]1C CNP0309502.2 [1,0,0,1,0,0|0,0,2]=4 519 B8R1.5 C[C@@H]1CCCC[C@H]1C CNP0309502.1 [1,0,0,1,0,0|0,0,2]=4 520 B8R1.5 N[C@@H]1CCCC[C@@H]1O CNP0462389.2 [1,0,0,1,0,0|1,0,1]=4 521 B8R1.5 N[C@@H]1CCCC[C@H]1O CNP0462389.4 [1,0,0,1,0,0|1,0,1]=4 522 B8R1.5 N[C@H]1CCCC[C@@H]1O CNP0462389.1 [1,0,0,1,0,0|1,0,1]=4 523 B8R1.5 N[C@H]1CCCC[C@H]1O CNP0462389.3 [1,0,0,1,0,0|1,0,1]=4 524 B8R1.5 O=C1CCCC=C1O CNP0238036.0 [1,0,0,1,0,0|1,0,1]=4 525 B8R1.5 O[C@@H]1CCCC[C@@H]1O CNP0125386.2 [1,0,0,1,0,0|1,0,1]=4 526 B8R1.5 O[C@@H]1CCCC[C@H]1Cl CNP0338357.1 [1,0,0,1,0,0|1,0,1]=4 527 B8R1.5 O[C@@H]1CCCC[C@H]1O CNP0125386.1 [1,0,0,1,0,0|1,0,1]=4 528 B8R1.5 O[C@H]1CCCC[C@@H]1O CNP0125386.3 [1,0,0,1,0,0|1,0,1]=4 529 B8R1.8 CCC=C1CCCC1 CNP0325076.0 [1,0,0,1,0,0|1,0,0]=3 530 B8R1.8 CCCC1=CC=CO1 CNP0301120.0 [1,0,0,1,0,0|0,0,2]=4 531 B8R1.8 CCCC1CCCC1 CNP0271421.0 [1,0,0,1,0,0|0,0,2]=4 532 B8R1.8 O=CCC1CC=CC1 CNP0086435.0 [1,0,0,1,0,0|1,0,1]=4 533 B8R1.10 CCCCC1CCC1 CNP0281769.0 [1,0,0,1,0,0|0,0,2]=4 534 B8R1.11 CCC1=C(CCC1)C CNP0488475.0 [1,0,0,1,0,0|0,0,2]=4 535 B8R1.11 CCC1CCCC1=O CNP0494839.0 [1,0,0,1,0,0|0,0,2]=4 536 B8R1.11 CC[C@@H]1CC=CC1=O CNP0060906.1 [1,0,0,1,0,0|0,0,2]=4 537 B8R1.11 CC[C@@H]1CCC[C@H]1C CNP0227551.1 [1,0,0,1,0,0|0,0,2]=4 538 B8R1.11 CC[C@H]1CC=CC1=O CNP0060906.2 [1,0,0,1,0,0|0,0,2]=4 539 B8R1.11 CC[C@H]1CCNC1=O CNP0289303.1 [1,0,0,1,0,0|1,0,1]=4 540 B8R1.22 CC1CCCCCC1 CNP0214318.0 [1,0,0,1,0,0|0,0,2]=4 541 B8R1.22 NC1=NCCCCC1 CNP0446960.0 [1,0,0,1,0,0|2,0,0]=4 542 B8R1.22 NC1=[NH+]CCCCC1 CNP0594018.0 [1,0,0,1,0,0|2,0,0]=4 543 B8R1.22 O=C1CC=CCCC1 CNP0354385.0 [1,0,0,1,0,0|1,0,1]=4 544 B8R1.22 O=C1CCCCCC1 CNP0486939.0 [1,0,0,1,0,0|0,0,2]=4 545 B8R1.22 O=C1CCCCCN1 CNP0157959.0 [1,0,0,1,0,0|1,0,1]=4 546 B8R1.22 O=C1CCCCCO1 CNP0358428.0 [1,0,0,1,0,0|1,0,1]=4 547 B8R1.22 OC1=NCCCCC1 CNP0523769.0 [1,0,0,1,0,0|1,0,0]=3 548 B8R1.36 CCCCCC1CC1 CNP0610547.0 [1,0,0,1,0,0|0,0,2]=4 549 B8R1.36 CCCOCC1CO1 CNP0085753.0 [1,0,0,1,0,0|1,0,1]=4 550 B8R1.49 C1#CCCC=CCC1 CNP0593767.0 [1,0,0,1,0,0|0,0,2]=4 551 B8R1.49 C1=CCCCCC=C1 CNP0084968.0 [1,0,0,1,0,0|0,0,2]=4 552 B8R1.49 C1=CCCCCCC1 CNP0354381.0 [1,0,0,1,0,0|0,0,0]=2 553 B10R1.10 CCC[C@@H]1CC=CC(=O)O1 CNP0289173.2 [0,1,0,1,0,0|0,0,1]=3 554 B10R1.10 CCC[C@H]1CC=CC(=O)O1 CNP0289173.1 [0,1,0,1,0,0|0,0,1]=3 555 B10R1.16 CCCCC1=CC(=CO1)C CNP0574167.0 [0,1,0,1,0,0|0,0,2]=4 556 B10R1.16 CCCC[C@@H]1CCC(=O)O1 CNP0194903.2 [0,1,0,1,0,0|2,0,0]=4 557 B10R1.16 CCCC[C@H]1CCC(=O)O1 CNP0194903.1 [0,1,0,1,0,0|2,0,0]=4 558 B10R1.18 CC(C)CC1CC=CCC1 CNP0084870.0 [0,1,0,1,0,0|1,0,0]=3 559 B10R1.61 CC(C)[C@@H]1CCCC[C@@H]1O CNP0289802.3 [0,1,0,1,0,0|0,0,2]=4 560 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1O CNP0289802.4 [0,1,0,1,0,0|0,0,2]=4 561 B10R1.61 CC(C)[C@H]1CCCC[C@@H]1O CNP0289802.2 [0,1,0,1,0,0|0,0,2]=4 562 B10R1.61 CC(C)[C@H]1CCCC[C@H]1O CNP0289802.1 [0,1,0,1,0,0|0,0,2]=4 563 B10R1.78 O=C1CCC=CCCCC1 CNP0611873.0 [0,1,0,1,0,0|1,0,1]=4 564 B10R1.78 O=C1CCCCCCCC1 CNP0106072.0 [0,1,0,1,0,0|1,0,1]=4 565 B10R1.21 CCCCCC1=CC=CO1 CNP0210535.0 [0,1,0,1,0,0|0,0,1]=3 566 B10R1.21 CCCCCC1=CC=CS1 CNP0094840.0 [0,1,0,1,0,0|0,1,1]=4 567 B10R1.21 CCCCCC1=CN=CO1 CNP0197497.0 [0,1,0,1,0,0|0,0,1]=3 568 B10R1.21 CCCCCC1=NC=CO1 CNP0420572.0 [0,1,0,1,0,0|0,0,1]=3 569 B10R1.21 CCCCCC1=NC=CS1 CNP0002560.0 [0,1,0,1,0,0|0,1,1]=4 570 B10R1.25 CC[C@@H]1COC(=O)C[C@H]1O CNP0109096.1 [0,1,0,1,0,0|1,0,1]=4 571 B10R1.25 CC[C@H]1COC(=O)C[C@H]1O CNP0109096.2 [0,1,0,1,0,0|1,0,1]=4 572 B10R1.29 CCCCC1CCOC1=O CNP0086360.0 [0,1,0,1,0,0|2,0,0]=4 573 B10R1.4 C[C@@H]1COCC[C@@H]1CCO CNP0154189.2 [0,1,0,1,0,0|0,0,2]=4 574 B10R1.4 C[C@@H]1COCC[C@H]1CCO CNP0154189.4 [0,1,0,1,0,0|0,0,2]=4 575 B10R1.4 C[C@H]1COCC[C@@H]1CCO CNP0154189.1 [0,1,0,1,0,0|0,0,2]=4 576 B10R1.4 C[C@H]1COCC[C@H]1CCO CNP0154189.3 [0,1,0,1,0,0|0,0,2]=4 577 B10R1.17 CCCC=C1CCCCC1 CNP0297291.0 [0,1,0,1,0,0|1,0,0]=3 578 B10R1.161 OCC1CCCCCCC1 CNP0085931.0 [0,1,0,1,0,0|0,0,2]=4 579 B10R1.185 C1=CCCCCCCCC1 CNP0479476.0 [0,1,0,1,0,0|1,0,0]=3 580 B10R1.15 CC(=NO)C1CCCCC1 CNP0071065.0 [0,1,0,1,0,0|1,0,1]=4 581 B10R1.15 CCC(=C1CCCCN1)O CNP0382476.0 [0,1,0,1,0,0|2,0,0]=4 582 B10R2.7 C1=CC2CCCCC2C1 CNP0590216.0 [0,0,0,2,0,0|1,0,0]=3 583 B10R2.7 C1=CCC2=C(C1)CCC2 CNP0572732.0 [0,0,0,2,0,0|1,0,1]=4 584 B10R2.483 C1=CC2(CCCO2)OC1 CNP0547006.0 [0,0,0,2,0,0|1,0,0]=3 585 B10R2.2 O=C1C=C2CCCC2C1 CNP0500354.0 [0,0,0,2,0,0|0,0,2]=4