0 B19R0.149 C#CCCCCCCCCCCCCCCCC(O)=O Amb19930518 [0,0,0,0,0,0|0,0,2]=2 1 B19R0.149 CCCCCC#CC#CCCCCCCCCC(=O)O Amb1149480 [0,0,0,0,0,0|0,0,4]=4 2 B19R0.149 CCCCCC#CCCCCCCCCCCC(O)=O Amb22350041 [0,0,0,0,0,0|0,0,2]=2 3 B19R0.149 CCCCCC#CC\C=C/CCCCCCCC(O)=O Amb21928954 [0,0,0,0,0,0|0,0,4]=4 4 B19R0.149 CCCCCC=CC=CCCCCCCCCC(=O)O Amb17611313 [0,0,0,0,0,0|0,0,4]=4 5 B19R0.149 CCCCCCCCCCC#CCCCCCC(=O)O Amb10072581 [0,0,0,0,0,0|0,0,2]=2 6 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)Cl Amb16232724 [0,0,0,0,0,0|1,0,0]=1 7 B19R0.149 CCCCCCCCCCCCCCCCCC(C)C Amb22730064 [0,0,0,0,0,0|2,0,1]=3 8 B19R0.149 CCCCCCCCCCCCCCCCCC(C)N Amb21953726 [0,0,0,0,0,0|2,0,1]=3 9 B19R0.149 CCCCCCCCCCCCCCCCCC(C)O Amb22369070 [0,0,0,0,0,0|1,0,1]=2 10 B19R0.149 CCCCCCCCCCCCCCCCCC(N)=S Amb22359769 [0,0,0,0,0,0|1,1,0]=2 11 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22336663 [0,0,0,0,0,0|0,0,0]=0 12 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22352822 [0,0,0,0,0,0|0,0,0]=0 13 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22353520 [0,0,0,0,0,0|0,0,0]=0 14 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22360658 [0,0,0,0,0,0|0,0,0]=0 15 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22360670 [0,0,0,0,0,0|0,0,0]=0 16 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22731026 [0,0,0,0,0,0|0,0,0]=0 17 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22735002 [0,0,0,0,0,0|0,0,0]=0 18 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb20246452 [0,0,0,0,0,0|0,0,1]=1 19 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb21962914 [0,0,0,0,0,0|0,0,1]=1 20 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22045499 [0,0,0,0,0,0|0,0,1]=1 21 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22052433 [0,0,0,0,0,0|0,0,1]=1 22 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22168327 [0,0,0,0,0,0|0,0,1]=1 23 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22276139 [0,0,0,0,0,0|0,0,1]=1 24 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22360648 [0,0,0,0,0,0|0,0,1]=1 25 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22552492 [0,0,0,0,0,0|0,0,1]=1 26 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22729061 [0,0,0,0,0,0|0,0,1]=1 27 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22729091 [0,0,0,0,0,0|0,0,1]=1 28 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22730641 [0,0,0,0,0,0|0,0,1]=1 29 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22730931 [0,0,0,0,0,0|0,0,1]=1 30 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22731292 [0,0,0,0,0,0|0,0,1]=1 31 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22731742 [0,0,0,0,0,0|0,0,1]=1 32 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22732275 [0,0,0,0,0,0|0,0,1]=1 33 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22732705 [0,0,0,0,0,0|0,0,1]=1 34 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22733869 [0,0,0,0,0,0|0,0,1]=1 35 B19R0.149 CCCCCCCCCCCCCCCCCC([O-])=O Amb22733890 [0,0,0,0,0,0|0,0,1]=1 36 B19R0.149 CCCCCCCCCCCCCCCCC[13C](=O)O Amb17620144 [0,0,0,0,0,0|0,0,0]=0 37 B19R0.149 CCCCCCCCCCCCCCCCC[14C](O)=O Amb22352519 [0,0,0,0,0,0|0,0,0]=0 38 B19R0.149 CCCCCCCCCCCCCCCCNC(C)C Amb16224853 [0,0,0,0,0,0|3,0,1]=4 39 B19R0.149 CCCCCCCCCCCCCCCCOC(=O)Cl Amb19944676 [0,0,0,0,0,0|2,0,0]=2 40 B19R0.149 CCCCCCCCCCCCCCCCSC(C)=O Amb22345982 [0,0,0,0,0,0|2,0,0]=2 41 B19R0.149 CCCCCCCCCCCCCCCC[13CH2]C(O)=O Amb22367350 [0,0,0,0,0,0|0,0,0]=0 42 B19R0.149 CCCCCCCCCCCCCCCC[13CH2][13C](O)=O Amb22367511 [0,0,0,0,0,0|0,0,0]=0 43 B19R0.149 CCCCCCCCCCCCC\C=C\C=C\C(O)=O Amb22001612 [0,0,0,0,0,0|0,0,4]=4 44 B19R0.149 CCCCCCCCCCCCSCCCCC(=O)O Amb1150949 [0,0,0,0,0,0|1,0,0]=1 45 B19R0.149 CCCCCCCCCCC\C=C/CCCCC(O)=O Amb22350254 [0,0,0,0,0,0|0,0,2]=2 46 B19R0.149 CCCCCCCCCCC\C=C\CCCCC(O)=O Amb22732392 [0,0,0,0,0,0|0,0,2]=2 47 B19R0.149 CCCCCCCCCC\C=C\CCCCOC(C)=O Amb22740021 [0,0,0,0,0,0|2,0,2]=4 48 B19R0.149 CCCCCCCCC\C=C/CCCCCCC(O)=O Amb21928953 [0,0,0,0,0,0|0,0,2]=2 49 B19R0.149 CCCCCCCCC\C=C/C\C=C/CCCC(O)=O Amb21928939 [0,0,0,0,0,0|0,0,4]=4 50 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)N Amb17618835 [0,0,0,0,0,0|1,0,2]=3 51 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22337682 [0,0,0,0,0,0|0,0,2]=2 52 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22351280 [0,0,0,0,0,0|0,0,2]=2 53 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22360659 [0,0,0,0,0,0|0,0,2]=2 54 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22432561 [0,0,0,0,0,0|0,0,2]=2 55 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22730958 [0,0,0,0,0,0|0,0,2]=2 56 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22733375 [0,0,0,0,0,0|0,0,2]=2 57 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22734450 [0,0,0,0,0,0|0,0,2]=2 58 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb19960036 [0,0,0,0,0,0|0,0,3]=3 59 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb20246443 [0,0,0,0,0,0|0,0,3]=3 60 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb21520391 [0,0,0,0,0,0|0,0,3]=3 61 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22338064 [0,0,0,0,0,0|0,0,3]=3 62 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22349267 [0,0,0,0,0,0|0,0,3]=3 63 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729194 [0,0,0,0,0,0|0,0,3]=3 64 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729375 [0,0,0,0,0,0|0,0,3]=3 65 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729952 [0,0,0,0,0,0|0,0,3]=3 66 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22730357 [0,0,0,0,0,0|0,0,3]=3 67 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22730716 [0,0,0,0,0,0|0,0,3]=3 68 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22731019 [0,0,0,0,0,0|0,0,3]=3 69 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22733452 [0,0,0,0,0,0|0,0,3]=3 70 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22733454 [0,0,0,0,0,0|0,0,3]=3 71 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22734062 [0,0,0,0,0,0|0,0,3]=3 72 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22734215 [0,0,0,0,0,0|0,0,3]=3 73 B19R0.149 CCCCCCCC\C=C/CCCCCCC[13C](=O)O Amb17618858 [0,0,0,0,0,0|0,0,2]=2 74 B19R0.149 CCCCCCCC\C=C/CCCCCCOC(C)=O Amb22740020 [0,0,0,0,0,0|2,0,2]=4 75 B19R0.149 CCCCCCCC\C=C/C\C=C/CCCCC(O)=O Amb21928932 [0,0,0,0,0,0|0,0,4]=4 76 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)Cl Amb20001478 [0,0,0,0,0,0|1,0,2]=3 77 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(O)=O Amb22369201 [0,0,0,0,0,0|0,0,2]=2 78 B19R0.149 CCCCCCCC\[13CH]=[13CH]/CCCCCCC[13C](O)=O Amb22353961 [0,0,0,0,0,0|0,0,2]=2 79 B19R0.149 CCCCCCCC\[13CH]=[13CH]/[13CH2][13CH2]CCC[13CH2][13CH2][13C](O)=O Amb22353878 [0,0,0,0,0,0|0,0,2]=2 80 B19R0.149 CCCCCCC\C=C\C=C\CCCCCCC(O)=O Amb21928936 [0,0,0,0,0,0|0,0,4]=4 81 B19R0.149 CCCCCCC\C=C\CCCCCCCCC(=O)Cl Amb22051697 [0,0,0,0,0,0|1,0,2]=3 82 B19R0.149 CCCCCCC\C=C\CCCCCCCCC(O)=O Amb22040077 [0,0,0,0,0,0|0,0,2]=2 83 B19R0.149 CCCCCC\C=C/C=C\CCCCCCCC(O)=O Amb21928933 [0,0,0,0,0,0|0,0,4]=4 84 B19R0.149 CCCCCC\C=C/CCCCCCCCCC(=O)Cl Amb22349882 [0,0,0,0,0,0|1,0,2]=3 85 B19R0.149 CCCCCC\C=C/CCCCCCCCOC(C)=O Amb22740022 [0,0,0,0,0,0|2,0,2]=4 86 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(O)=O Amb21928935 [0,0,0,0,0,0|0,0,4]=4 87 B19R0.149 CCCCCC\C=C\C=C\CCCCCCCC(O)=O Amb21928938 [0,0,0,0,0,0|0,0,4]=4 88 B19R0.149 CCCCCC\C=C\CCCCCCCCC[13C](O)=O Amb22338962 [0,0,0,0,0,0|0,0,2]=2 89 B19R0.149 CCCCCC\C=C\CCCCCCCCOC(C)=O Amb22740023 [0,0,0,0,0,0|2,0,2]=4 90 B19R0.149 CCCCC\C=C\C=C\CCCCCCCCC(O)=O Amb22054759 [0,0,0,0,0,0|0,0,4]=4 91 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(O)=O Amb22359883 [0,0,0,0,0,0|0,0,4]=4 92 B19R0.149 CCCC\C=C/CCCCCCCCCCOC(=O)C Amb13883680 [0,0,0,0,0,0|2,0,2]=4 93 B19R0.149 CCCC\C=C\C=C\CCCCCCCCCC(O)=O Amb21928937 [0,0,0,0,0,0|0,0,4]=4 94 B19R0.149 CCCC\C=C\CCCCCCCCCCCC(O)=O Amb22348161 [0,0,0,0,0,0|0,0,2]=2 95 B19R0.149 CCCC\C=C\CCCCCCCCCCOC(C)=O Amb22740019 [0,0,0,0,0,0|2,0,2]=4 96 B19R0.149 ICCCCCCCCCCCCCCCCC(=O)O Amb10071542 [0,0,0,0,0,0|1,0,0]=1 97 B19R0.149 OC(=O)CCCCCCCCCCCCCCCCBr Amb19887564 [0,0,0,0,0,0|1,0,0]=1 98 B19R0.149 [13CH3]C[13CH2]C[13CH2]C[13CH2]C\[13CH]=C/[13CH2]C[13CH2]C[13CH2]C[13CH2]C([O-])=O Amb22367644 [0,0,0,0,0,0|0,0,3]=3 99 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22353668 [0,0,0,0,0,0|0,0,0]=0 100 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]\[13CH]=[13CH]/[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]C(O)=O Amb21928779 [0,0,0,0,0,0|0,0,2]=2 101 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]\[13CH]=[13CH]/[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22366940 [0,0,0,0,0,0|0,0,2]=2 102 B18R0.176 C=CCCCCCCCCCCCCCCC(=O)O Amb10071540 [1,0,0,0,0,0|0,0,2]=3 103 B18R0.176 CCCCCCCCCCCCCCCCC(=O)Cl Amb20672053 [1,0,0,0,0,0|1,0,0]=2 104 B18R0.176 CCCCCCCCCCCCCCCCC(C)=O Amb22350513 [1,0,0,0,0,0|1,0,0]=2 105 B18R0.176 CCCCCCCCCCCCCCCCC(C)C Amb22730065 [1,0,0,0,0,0|2,0,1]=4 106 B18R0.176 CCCCCCCCCCCCCCCCC(O)=O Amb22338458 [1,0,0,0,0,0|0,0,0]=1 107 B18R0.176 CCCCCCCCCCCCCCCCC([O-])=O Amb22357986 [1,0,0,0,0,0|0,0,1]=2 108 B18R0.176 CCCCCCCCCCCCCCCCC([O-])=O Amb22728751 [1,0,0,0,0,0|0,0,1]=2 109 B18R0.176 CCCCCCCCCCCCCCCOC(C)=O Amb22350236 [1,0,0,0,0,0|2,0,0]=3 110 B18R0.176 CCCCCC\C=C\CCCCCCCCC(O)=O Amb21928721 [1,0,0,0,0,0|0,0,2]=3 111 B18R0.176 OC(=O)CCCCCCCCCCCCCCCS Amb22336970 [1,0,0,0,0,0|1,0,0]=2 112 B18R0.221 C=CCCCCCCCCCCCCCCCC=C Amb22641572 [1,0,0,0,0,0|1,0,2]=4 113 B18R0.221 C=CCCCCCCCCCCCCCCCCBr Amb24323318 [1,0,0,0,0,0|2,0,0]=3 114 B18R0.221 CCCCCCC#CCCCCCCCCCCO Amb22352551 [1,0,0,0,0,0|0,0,3]=4 115 B18R0.221 CCCCCCCCCCCCCCCCCC#N Amb17689214 [1,0,0,0,0,0|1,0,1]=3 116 B18R0.221 CCCCCCCCCCCCCCCCCC=O Amb17673738 [1,0,0,0,0,0|0,0,0]=1 117 B18R0.221 CCCCCCCCCCCCCCCCCCC Amb1785843 [1,0,0,0,0,0|1,0,1]=3 118 B18R0.221 CCCCCCCCCCCCCCCCCCN Amb22730201 [1,0,0,0,0,0|1,0,1]=3 119 B18R0.221 CCCCCCCCCCCCCCCCCCO Amb22735007 [1,0,0,0,0,0|0,0,1]=2 120 B18R0.221 CCCCCCCCCCCCCCCCCC[SiH3] Amb19893969 [1,0,0,0,0,0|1,0,1]=3 121 B18R0.221 CCCCCCCCCCCCCCCCN=C=O Amb19886518 [1,0,0,0,0,0|1,0,1]=3 122 B18R0.221 CCCCCCCCCCCCCCCCNC=O Amb22052666 [1,0,0,0,0,0|1,0,0]=2 123 B18R0.221 CCCCCCCCCCCCCCCCNCC Amb20076173 [1,0,0,0,0,0|2,0,1]=4 124 B18R0.221 CCCCCCCCCCCCCCCCSC#C Amb1147551 [1,0,0,0,0,0|2,0,1]=4 125 B18R0.221 CCCCCCCCCCCCCCCC\C=C\O Amb21928947 [1,0,0,0,0,0|0,0,1]=2 126 B18R0.221 CCCCCCCCCCCCCCC\C=C\C=O Amb17618788 [1,0,0,0,0,0|0,0,2]=3 127 B18R0.221 CCCCCCCCCCCCCCC\C=C\CO Amb24053094 [1,0,0,0,0,0|0,0,3]=4 128 B18R0.221 CCCCCCCCCCC\C=C/CCCCCO Amb22362846 [1,0,0,0,0,0|0,0,3]=4 129 B18R0.221 CCCCCCCCCNCCCCCCCCC Amb15740839 [1,0,0,0,0,0|2,0,1]=4 130 B18R0.221 CCCCCCCC\C=C/CCCCCCCCO Amb22337889 [1,0,0,0,0,0|0,0,3]=4 131 B18R0.221 CCCCCC\C=C/CCCCCCCCCC=O Amb22740004 [1,0,0,0,0,0|0,0,2]=3 132 B18R0.221 CCCCCC\C=C/CCCCCCCCCCO Amb22732591 [1,0,0,0,0,0|0,0,3]=4 133 B18R0.221 CCCC\C=C/CCCCCCCCCCCCO Amb22740014 [1,0,0,0,0,0|0,0,3]=4 134 B18R0.221 CCCC\C=C\CCCCCCCCCCCC=O Amb22734028 [1,0,0,0,0,0|0,0,2]=3 135 B18R0.221 ClCCCCCCCCCCCCCCCCCCl Amb22641810 [1,0,0,0,0,0|2,0,1]=4 136 B18R0.221 O=CCCCCCCCCCCC\C=C/CCCC Amb17618794 [1,0,0,0,0,0|0,0,2]=3 137 B20R0.68 CCCCCCCCC(C)CCCCCCCCC(O)=O Amb21928871 [0,1,0,0,0,0|0,0,0]=1 138 B20R0.90 CCCCCCC(=O)CCCCCCCCCCC(=O)[O-] Amb17616394 [0,1,0,0,0,0|0,0,2]=3 139 B20R0.90 CCCCCCC(=O)CCCCCCCCCCC(O)=O Amb19132899 [0,1,0,0,0,0|0,0,1]=2 140 B20R0.90 CCCCCCC(=O)C\C=C/CCCCCCCC(O)=O Amb21928976 [0,1,0,0,0,0|0,0,3]=4 141 B20R0.90 CCCCCCC(O)C\C=C/CCCCCCCC([O-])=O Amb22732852 [0,1,0,0,0,0|0,0,3]=4 142 B20R0.90 CCCCCCC(O)C\C=C\CCCCCCCC(O)=O Amb22350077 [0,1,0,0,0,0|0,0,2]=3 143 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(O)=O Amb22348318 [0,1,0,0,0,0|0,0,2]=3 144 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC([O-])=O Amb22799892 [0,1,0,0,0,0|0,0,3]=4 145 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC([O-])=O Amb22800227 [0,1,0,0,0,0|0,0,3]=4 146 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC([O-])=O Amb22800949 [0,1,0,0,0,0|0,0,3]=4 147 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC([O-])=O Amb22801355 [0,1,0,0,0,0|0,0,3]=4 148 B20R0.2931 CCCCCCCCCCCCCCCC(=O)NC(N)=O Amb22366210 [0,1,0,0,0,0|2,0,1]=4 149 B20R0.2931 CCCCCCCCCCCCCCCC(C)CC(O)=O Amb21935949 [0,1,0,0,0,0|0,0,0]=1 150 B20R0.2931 CCCCCCCCCCCCCCCC(O)CC(O)=O Amb22832001 [0,1,0,0,0,0|0,0,0]=1 151 B20R0.3034 BrCCCCCCCCCCCCCCCCC(=O)OC Amb10071546 [0,1,0,0,0,0|1,0,0]=2 152 B20R0.3034 CCCCCCCCCCC#CCCCCCC(=O)OC Amb22348204 [0,1,0,0,0,0|0,0,2]=3 153 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)C=C Amb21928895 [0,1,0,0,0,0|1,0,0]=2 154 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)CC Amb21618725 [0,1,0,0,0,0|1,0,0]=2 155 B20R0.3034 CCCCCCCCCCCCCCCCC[13C](=O)OC Amb17617764 [0,1,0,0,0,0|0,0,0]=1 156 B20R0.3034 CCCCCCCCCCCCCCCCNC(=O)CBr Amb19958271 [0,1,0,0,0,0|2,0,0]=3 157 B20R0.3034 CCCCCCCCCCCCCCCCOC(=O)C=C Amb22729711 [0,1,0,0,0,0|2,0,0]=3 158 B20R0.3034 CCCCCCCCCCCCCCC\C=C\C(=O)OC Amb21928946 [0,1,0,0,0,0|0,0,2]=3 159 B20R0.3034 CCCCCCCCCCC\C=C\CCCCC(=O)OC Amb22348220 [0,1,0,0,0,0|0,0,2]=3 160 B20R0.3034 CCCCCCCCCSCCCCCCCC(=O)OC Amb22352249 [0,1,0,0,0,0|1,0,0]=2 161 B20R0.3034 CCCCCCCC\C=C/CCCCCCC[13C](=O)OC Amb17618859 [0,1,0,0,0,0|0,0,2]=3 162 B20R0.3034 COC(=O)CCCCCCCCCCCCCCCCO Amb21928828 [0,1,0,0,0,0|1,0,0]=2 163 B20R0.3037 CCCCCCCCCCCCCCCCC(O)C(O)=O Amb21520312 [0,1,0,0,0,0|0,0,0]=1 164 B20R0.3037 CCCCCCCCCCCCCCCC[C@@H](O)C(O)=O Amb22801224 [0,1,0,0,0,0|0,0,0]=1 165 B20R0.3037 CCCCCCCC\C=C/CCCCCCC(O)C(O)=O Amb22055483 [0,1,0,0,0,0|0,0,2]=3 166 B20R0.10422 CCCCCCCCCCCC(=O)CCCCCC(O)=O Amb22504072 [0,1,0,0,0,0|0,0,1]=2 167 B20R0.22238 CCCCCCCCCCCCC(CCCCC(=O)O)O Amb10810452 [0,1,0,0,0,0|0,0,0]=1 168 B20R0.22238 CCCCCCCCCCCCC(\C=C\CCC(=O)O)O Amb15770290 [0,1,0,0,0,0|0,0,2]=3 169 B20R0.26099 CCC(C)CCCCCCCCCCCCCCC(O)=O Amb21928872 [0,1,0,0,0,0|0,0,0]=1 170 B20R0.26099 ClCC(CCCCCCCCCCCCCCC(=O)O)Cl Amb10071529 [0,1,0,0,0,0|1,0,0]=2 171 B20R0.31940 CCCCCCCCCCCCCCC#CC#CC(O)=O Amb22735101 [0,1,0,0,0,0|0,0,3]=4 172 B20R0.31940 CCCCCCCCCCCCCCCCCCB(O)O Amb13890352 [0,1,0,0,0,0|1,0,1]=3 173 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)Cl Amb22360628 [0,1,0,0,0,0|1,0,0]=2 174 B20R0.31940 CCCCCCCCCCCCCCCCCCC([O-])=O Amb22357987 [0,1,0,0,0,0|0,0,1]=2 175 B20R0.31940 CCCCCCCCCCCCCCCCCCN(C)C Amb16224855 [0,1,0,0,0,0|3,0,0]=4 176 B20R0.31940 CCCCCCCCCCCCCCCCCC[SiH](C)C Amb22353420 [0,1,0,0,0,0|2,1,0]=4 177 B20R0.31940 CCCCCCCCCCCCCCCCCOC(C)=O Amb24325170 [0,1,0,0,0,0|1,0,0]=2 178 B20R0.31940 CCCCCCCC\C=C/CCCCCCCCC(O)=O Amb21520326 [0,1,0,0,0,0|0,0,1]=2 179 B20R0.31940 CCCCC\C=C/CCCCCCCCCCOC(=O)C Amb10563794 [0,1,0,0,0,0|1,0,2]=4 180 B20R0.32509 CCCCCCCCCCCCCCCCC[N+](C)(C)C Amb24325192 [0,1,0,0,0,0|3,0,0]=4 181 B20R0.32509 CCCCCCCCCCCCCCCCOP(O)(O)=O Amb24118057 [0,1,0,0,0,0|2,0,0]=3 182 B20R0.32509 CCCCCCCCCCCCCCCCOP([O-])(O)=O Amb22641439 [0,1,0,0,0,0|2,0,0]=3 183 B20R0.32509 CCCCCCCCCCCCCCCCSS(=O)(=O)C Amb17614922 [0,1,0,0,0,0|2,0,1]=4 184 B20R0.35227 CC(C)CCCCCCCCCCCCCCCC(O)=O Amb21928873 [0,1,0,0,0,0|0,0,0]=1 185 B20R0.35227 OC(=O)CCCCCCCCCCCCCCCC(O)=O Amb24184044 [0,1,0,0,0,0|1,0,1]=3 186 B20R1.31096 OC(=O)CCCCCCCCCCCC[C@@H]1CCC=C1 Amb21856064 [0,0,0,1,0,0|0,0,2]=3 187 B17R0.43 BrCCCCCCCCCCCCCCC(=O)O Amb16231526 [2,0,0,0,0,0|1,0,0]=3 188 B17R0.43 C#CCCCCCCCCCCCCCC(O)=O Amb22642012 [2,0,0,0,0,0|0,0,2]=4 189 B17R0.43 CCCCCCCCCCCCCCCC(=O)S Amb22056243 [2,0,0,0,0,0|0,1,0]=3 190 B17R0.43 CCCCCCCCCCCCCCCC(=S)O Amb15691801 [2,0,0,0,0,0|0,1,0]=3 191 B17R0.43 CCCCCCCCCCCCCCCC(O)=O Amb22348427 [2,0,0,0,0,0|0,0,0]=2 192 B17R0.43 CCCCCCCCCCCCCCCC(O)=O Amb22349954 [2,0,0,0,0,0|0,0,0]=2 193 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22350518 [2,0,0,0,0,0|0,0,1]=3 194 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22361255 [2,0,0,0,0,0|0,0,1]=3 195 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22730103 [2,0,0,0,0,0|0,0,1]=3 196 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22732179 [2,0,0,0,0,0|0,0,1]=3 197 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22732274 [2,0,0,0,0,0|0,0,1]=3 198 B17R0.43 CCCCCCCCCCCCCCC[13C](O)=O Amb21928730 [2,0,0,0,0,0|0,0,0]=2 199 B17R0.43 CCCCCCCCCCCCCCC[13C]([O-])=O Amb22338989 [2,0,0,0,0,0|0,0,1]=3 200 B17R0.43 CCCCCCCCCCCCCCC[14C](O)=O Amb22352207 [2,0,0,0,0,0|0,0,0]=2 201 B17R0.43 CCCCCCCCCCCCCCOC(=O)Cl Amb22002450 [2,0,0,0,0,0|2,0,0]=4 202 B17R0.43 CCCCCCCCCCCCCC[13CH2]C(O)=O Amb22337967 [2,0,0,0,0,0|0,0,0]=2 203 B17R0.43 CCCCCCCCCCCCCC[13CH2][13C](O)=O Amb22363190 [2,0,0,0,0,0|0,0,0]=2 204 B17R0.43 CCCCCCCCCCCCC\C=C\C(O)=O Amb22732588 [2,0,0,0,0,0|0,0,2]=4 205 B17R0.43 CCCCCCCCCCCCSCCC(=O)N Amb1150923 [2,0,0,0,0,0|2,0,0]=4 206 B17R0.43 CCCCCCCCCCCCSCCC(=O)O Amb1038996 [2,0,0,0,0,0|1,0,0]=3 207 B17R0.43 CCCCCCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22369000 [2,0,0,0,0,0|0,0,0]=2 208 B17R0.43 CCCCCCCCC\C=C/CCCCC(O)=O Amb21928725 [2,0,0,0,0,0|0,0,2]=4 209 B17R0.43 CCCCCCCCSCCCCCCC(=O)O Amb1038998 [2,0,0,0,0,0|1,0,0]=3 210 B17R0.43 CCCCCCCC\C=C/CCCCCC(O)=O Amb21928726 [2,0,0,0,0,0|0,0,2]=4 211 B17R0.43 CCCCCC\C=C\CCCCCCCC(O)=O Amb22729016 [2,0,0,0,0,0|0,0,2]=4 212 B17R0.43 CCCC\C=C/CCCCCCCCCC(O)=O Amb21928729 [2,0,0,0,0,0|0,0,2]=4 213 B17R0.43 OC(=O)CCCCCCCCCCCCCCS Amb22336885 [2,0,0,0,0,0|1,0,0]=3 214 B17R0.43 [13CH3]CCCCCCCCCCCCCCC(O)=O Amb22367411 [2,0,0,0,0,0|0,0,0]=2 215 B17R0.43 [13CH3]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C(O)=O Amb22367412 [2,0,0,0,0,0|0,0,0]=2 216 B17R0.43 [13CH3]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C([O-])=O Amb22362703 [2,0,0,0,0,0|0,0,1]=3 217 B17R0.43 [13CH3][13CH2]CCCCCCCCCCCCCC(O)=O Amb22367398 [2,0,0,0,0,0|0,0,0]=2 218 B17R0.43 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22353663 [2,0,0,0,0,0|0,0,0]=2 219 B17R0.117 BrCCCCCCCCCCCCCCCCBr Amb22388776 [2,0,0,0,0,0|2,0,0]=4 220 B17R0.117 CCCCCCCCCCCCCCCCC#N Amb22366784 [2,0,0,0,0,0|1,0,1]=4 221 B17R0.117 CCCCCCCCCCCCCCCCC=C Amb22730877 [2,0,0,0,0,0|0,0,1]=3 222 B17R0.117 CCCCCCCCCCCCCCCCC=O Amb17939324 [2,0,0,0,0,0|0,0,0]=2 223 B17R0.117 CCCCCCCCCCCCCCCCCC Amb22338200 [2,0,0,0,0,0|0,0,1]=3 224 B17R0.117 CCCCCCCCCCCCCCCCCN Amb17674227 [2,0,0,0,0,0|1,0,0]=3 225 B17R0.117 CCCCCCCCCCCCCCCCC[14CH3] Amb22731702 [2,0,0,0,0,0|0,0,1]=3 226 B17R0.117 CCCCCCCCCCCCCCCCNC Amb22369363 [2,0,0,0,0,0|1,0,1]=4 227 B17R0.117 CCCCCCCCCCCCCCCC[Hg]Br Amb22347120 [2,0,0,0,0,0|2,0,0]=4 228 B17R0.117 CCCCCCCCCCCCCCCN=C=O Amb22351995 [2,0,0,0,0,0|1,0,1]=4 229 B17R0.117 ClCCCCCCCCCCCCCCCCBr Amb22369179 [2,0,0,0,0,0|2,0,0]=4 230 B17R0.117 OCCCCCCCCCCCCCCCCO Amb21936051 [2,0,0,0,0,0|1,0,0]=3 231 B17R0.117 OCCCCCCCCCCCCCCCCS Amb2447019 [2,0,0,0,0,0|1,0,0]=3 232 B17R0.117 SCCCCCCCCCCCCCCCCS Amb20672054 [2,0,0,0,0,0|1,1,0]=4 233 B19R0.35 CCCCCCCCCCCCCCC(O)CC(O)=O Amb21928750 [1,1,0,0,0,0|0,0,0]=2 234 B19R0.148 BrCCCCCCCCCCCCCCCC(=O)OC Amb10071547 [1,1,0,0,0,0|1,0,0]=3 235 B19R0.148 CCCCCCCCCCCCCCCCC(=O)C=C Amb10562279 [1,1,0,0,0,0|1,0,0]=3 236 B19R0.148 CCCCCCCCCCCCCCCC[C@@H](O)CO Amb22799651 [1,1,0,0,0,0|0,0,2]=4 237 B19R0.148 CCCCCCCCCC\C=C/CCCCC(=O)OC Amb22731087 [1,1,0,0,0,0|0,0,2]=4 238 B19R0.148 CCCCCC\C=C/CCCCCCCCC(=O)OC Amb22352444 [1,1,0,0,0,0|0,0,2]=4 239 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(O)=O Amb22729956 [1,1,0,0,0,0|1,0,1]=4 240 B19R0.443 CC(C)CCCCCCCCCCCCCCC(O)=O Amb21928808 [1,1,0,0,0,0|0,0,0]=2 241 B19R0.443 CC(CCCCCCCCCCCCCCC(=O)O)Br Amb10071513 [1,1,0,0,0,0|0,0,0]=2 242 B19R0.3040 CCCC(F)CCCCCCCSCCCCC(O)=O Amb20241157 [1,1,0,0,0,0|1,0,0]=3 243 B19R0.3102 CCCCCCCCCCCCCCCCP(C)(C)=O Amb22359039 [1,1,0,0,0,0|2,0,0]=4 244 B19R0.3102 CCCCCCCCCCCCCCCCP(O)(O)=O Amb22388779 [1,1,0,0,0,0|1,0,0]=3 245 B19R0.3102 CCCCCCCCCCCCCCCCS([O-])(=O)=O Amb22346276 [1,1,0,0,0,0|1,0,1]=4 246 B19R0.3102 CCCCCCCCCCCCCCCC[Si](C)(O)O Amb22351315 [1,1,0,0,0,0|0,1,1]=4 247 B19R0.21384 CCC(C)CCCCCCCCCCCCCC(O)=O Amb21928806 [1,1,0,0,0,0|0,0,0]=2 248 B19R0.26214 CCCCCCCCCC(=O)NCCCCCC(=O)O Amb1039625 [1,1,0,0,0,0|1,0,1]=4 249 B19R0.36 BrCCCCCCCCCCCCCCCCCCBr Amb22350564 [1,1,0,0,0,0|1,0,1]=4 250 B19R0.36 CCCCCCCCCCCCCCCCCCC=C Amb19930180 [1,1,0,0,0,0|1,0,0]=3 251 B19R0.36 CCCCCCCCCCCCCCCCCCCBr Amb22359552 [1,1,0,0,0,0|1,0,1]=4 252 B19R0.36 CCCCCCCCCCCCCCCCCCCN Amb22729932 [1,1,0,0,0,0|1,0,1]=4 253 B19R0.36 CCCCCCCCCCCCCCCCCCNC Amb16224854 [1,1,0,0,0,0|1,0,1]=4 254 B19R0.36 CCCCCCCCCCCCCCCCCC[Hg]Br Amb22347121 [1,1,0,0,0,0|1,0,1]=4 255 B19R0.36 CCCCCCCCCCCCCCCCCC[Hg]Cl Amb22359880 [1,1,0,0,0,0|1,0,1]=4 256 B19R0.36 CCCCCCCCCCCCCCCCCC[Mg]Cl Amb22338248 [1,1,0,0,0,0|1,0,1]=4 257 B19R0.36 CCCCCCCCCCCCCCCCC\C=C\O Amb21928928 [1,1,0,0,0,0|0,0,0]=2 258 B19R0.36 CCCCCCCCCCCCCCCCNCCC Amb20076260 [1,1,0,0,0,0|1,0,1]=4 259 B19R0.36 CCCCCCCCCCCCCCCCOCCO Amb22264987 [1,1,0,0,0,0|0,0,1]=3 260 B19R0.36 ClCCCCCCCCCCCCCCCCCCCl Amb22641806 [1,1,0,0,0,0|1,0,1]=4 261 B19R0.36 OCCCCCCCCCCCCCCCCCCO Amb17672295 [1,1,0,0,0,0|0,0,1]=3 262 B19R0.18065 CCCCCCC(O)CCCCCCCCCCCO Amb22362911 [1,1,0,0,0,0|0,0,1]=3 263 B19R0.23229 CCCCCCCCCCC(CCCCCCCC)O Amb10564568 [1,1,0,0,0,0|1,0,1]=4 264 B19R0.26208 CCCCCCCCCC(CCCCCCCCC)O Amb10555978 [1,1,0,0,0,0|1,0,1]=4 265 B21R0.9111 CCCCCCCCC(O)C(O)CCCCCCCC([O-])=O Amb22167663 [0,2,0,0,0,0|0,0,1]=3 266 B21R0.9111 CCCCCCCC[C@@H](O)[C@@H](O)CCCCCCCC(O)=O Amb22799607 [0,2,0,0,0,0|0,0,0]=2 267 B21R0.9111 CCCCCCCC[C@@H](O)[C@H](O)CCCCCCCC(O)=O Amb22800265 [0,2,0,0,0,0|0,0,0]=2 268 B21R0.9111 [2H]C(CCCCCCCC(C)=O)C([2H])CCCCCCCO Amb21928944 [0,2,0,0,0,0|2,0,0]=4 269 B21R0.9111 [2H]\C(\CCCCCCCC(O)=O)=C(/[2H])\CCCCCCCC Amb21928934 [0,2,0,0,0,0|0,0,2]=4 270 B21R0.21192 CCCCCCC(=O)CCCCCCCCCCC(=O)OC Amb19133172 [0,2,0,0,0,0|0,0,1]=3 271 B21R0.21192 CCCCCCC(O)CCCCCCCCCCC(=O)OC Amb21928839 [0,2,0,0,0,0|0,0,0]=2 272 B21R0.21192 CCCCCCC(O)C\C=C\CCCCCCCC(=O)OC Amb22350251 [0,2,0,0,0,0|0,0,2]=4 273 B21R0.25505 CCCCCCCCCCCCCC(=O)CCCC(=O)OC Amb22338457 [0,2,0,0,0,0|0,0,1]=3 274 B21R0.36393 CCCCCCCCCCCCCCCC(O)CC(=O)OC Amb21928834 [0,2,0,0,0,0|0,0,0]=2 275 B21R0.2907 CCCCCCCC/C=C/CCCCCCCC(=O)OC=C Amb17672569 [0,2,0,0,0,0|0,0,2]=4 276 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)NCO Amb22002301 [0,2,0,0,0,0|0,0,0]=2 277 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)OC=C Amb17672567 [0,2,0,0,0,0|0,0,0]=2 278 B21R0.2907 CCCCCCCCCCCCCCCCNC(=O)CC#N Amb1103420 [0,2,0,0,0,0|2,0,0]=4 279 B21R0.2907 CCCCCCCCCCC\C=C\CCCCC(=O)OCC Amb22350169 [0,2,0,0,0,0|0,0,2]=4 280 B21R0.2907 CNCC(=O)NCCCCCCCCCCCCCCCC Amb20141781 [0,2,0,0,0,0|2,0,0]=4 281 B21R0.2929 CCCCCCCCCC(=O)CCCCCCCC(=O)OC Amb22336641 [0,2,0,0,0,0|0,0,1]=3 282 B21R0.2973 CCCCCCCCCCCCCCCCC(O)C(=O)OC Amb21928833 [0,2,0,0,0,0|0,0,0]=2 283 B21R0.9167 CCCCCCCCCCCC(=O)CCCCCC(=O)OC Amb22338212 [0,2,0,0,0,0|0,0,1]=3 284 B21R0.24664 CCC(C)CCCCCCCCCCCCCCC(=O)OC Amb21928859 [0,2,0,0,0,0|0,0,0]=2 285 B21R0.24664 COC(=O)CCCCCCCCCCCCCCC(=O)OC Amb21928632 [0,2,0,0,0,0|1,0,1]=4 286 B21R0.30140 COC(=O)CCCCCCCCCCCCCCCC(C)C Amb21928854 [0,2,0,0,0,0|0,0,0]=2 287 B21R0.36766 CCCCCCCCCCCCCCCCCCC(=O)OC Amb18511748 [0,2,0,0,0,0|0,0,0]=2 288 B21R0.36766 CCCCCCCCCCCCCCCCCCC(CO)O Amb17613629 [0,2,0,0,0,0|0,0,2]=4 289 B21R0.36766 CCCCCCCCCCCCCCCCOCC(N)CO Amb22388872 [0,2,0,0,0,0|1,0,1]=4 290 B21R0.36766 CCCCCCCCCCCCCCCCOC[C@@H](O)CO Amb22799483 [0,2,0,0,0,0|0,0,2]=4 291 B21R0.36766 CNC(=O)CNCCCCCCCCCCCCCCCC Amb19967290 [0,2,0,0,0,0|1,0,0]=3 292 B21R0.36769 CC(=C)C(=O)NCCCCCCCCCCCCCCCC Amb17934061 [0,2,0,0,0,0|2,0,0]=4 293 B21R0.36769 CC(=C)C(=O)OCCCCCCCCCCCCCCCC Amb22338301 [0,2,0,0,0,0|2,0,0]=4 294 B21R0.36769 CCCCCCCCCCCCCCCCOC(=O)C(C)O Amb24323313 [0,2,0,0,0,0|1,0,0]=3 295 B21R0.9296 CCCCCCCCCCCCCCCCC(CC)C(O)=O Amb21935946 [0,2,0,0,0,0|0,0,0]=2 296 B21R0.37123 CCCCCCCCCCCCCCCCC(Cl)(Cl)C(O)=O Amb22732343 [0,2,0,0,0,0|0,0,0]=2 297 B21R0.37123 CCCCCCCC\C=C/CCCCCCC(C(=O)O)(O)C Amb17615537 [0,2,0,0,0,0|0,0,2]=4 298 B21R0.37123 [2H]C([2H])(CCCCCCCCCCCCCCCC)C(O)=O Amb22351672 [0,2,0,0,0,0|0,0,0]=2 299 B21R0.36773 CCCCCCCCCCCCCCCC(=O)OCC(O)=O Amb17939795 [0,2,0,0,0,0|0,0,1]=3 300 B21R0.25377 NCCCCCCCCCCCC(=O)CCCCCC(O)=O Amb22347542 [0,2,0,0,0,0|0,0,1]=3 301 B21R0.81 BrCCCCCCCCCCCCCCCCCCC(=O)O Amb10071516 [0,2,0,0,0,0|0,0,0]=2 302 B21R0.81 CCCCCCCCC#CCC#CCCCCCCC(O)=O Amb22732907 [0,2,0,0,0,0|0,0,2]=4 303 B21R0.81 CCCCCCCCCCCCC#CC#CCCCC(O)=O Amb19883855 [0,2,0,0,0,0|0,0,2]=4 304 B21R0.81 CCCCCCCCCCCCCCCCCCOC(=O)Cl Amb22002449 [0,2,0,0,0,0|1,0,0]=3 305 B21R0.81 CCCCCCCCCCCCCCCCC\C=C\C(O)=O Amb21928703 [0,2,0,0,0,0|0,0,0]=2 306 B21R0.81 CCCCCCCCCCCCCCCCNCCC(N)=O Amb20171942 [0,2,0,0,0,0|1,0,0]=3 307 B21R0.81 CCCCCCCCCCCCCC\C=C/CCCC(O)=O Amb22734942 [0,2,0,0,0,0|0,0,0]=2 308 B21R0.81 CCCCCCCCCC\C=C/CCCCCCCC(O)=O Amb21928704 [0,2,0,0,0,0|0,0,0]=2 309 B21R0.81 CCCCCCCCSCCCCCCCCCCC([O-])=O Amb22358876 [0,2,0,0,0,0|0,0,1]=3 310 B21R0.81 CCCCCCCC\C=C/CCCCCCCCCC(O)=O Amb22337523 [0,2,0,0,0,0|0,0,0]=2 311 B21R0.81 CCCCCCCC\C=C/CCCCCCCCOC(=O)N Amb10844664 [0,2,0,0,0,0|1,0,1]=4 312 B21R0.81 CCCCCCCC\C=C/CCCC\C=C/CCCC(O)=O Amb22055168 [0,2,0,0,0,0|0,0,2]=4 313 B21R0.81 CCCCCCCC\C=C\CCCCCCCCCC(=O)Cl Amb22729131 [0,2,0,0,0,0|1,0,0]=3 314 B21R0.81 CCCCCCCC\C=C\CCCCCCCCCC(O)=O Amb22361233 [0,2,0,0,0,0|0,0,0]=2 315 B21R0.81 CCCCCCC\C=C/C\C=C/CCCCCCCC(O)=O Amb21928667 [0,2,0,0,0,0|0,0,2]=4 316 B21R0.81 CCCCCC\C=C/CCCCCCCCCCCC(O)=O Amb22349782 [0,2,0,0,0,0|0,0,0]=2 317 B21R0.81 CCCCC\C=C/CCCCCCCCCCCCC(O)=O Amb21928622 [0,2,0,0,0,0|0,0,0]=2 318 B21R0.81 CCCCC\C=C/CCCCCCC\C=C/CCCC(O)=O Amb21928679 [0,2,0,0,0,0|0,0,2]=4 319 B21R0.81 CCCCC\C=C/CCCC\C=C/CCCCCCC(O)=O Amb21928680 [0,2,0,0,0,0|0,0,2]=4 320 B21R0.81 CCCCC\C=C\C\C=C\CCCCCCCCCC(O)=O Amb21928664 [0,2,0,0,0,0|0,0,2]=4 321 B21R0.81 CCCC\C=C/CCCCCCCCCCCCOC(C)=O Amb22732435 [0,2,0,0,0,0|1,0,1]=4 322 B21R0.9014 CC(C)CCCCCCCCCCCCCCCCC(O)=O Amb21928820 [0,2,0,0,0,0|0,0,0]=2 323 B21R0.9014 OC(=O)CCCCCCCCCCCCCCCCC(=O)O Amb10070432 [0,2,0,0,0,0|0,0,1]=3 324 B21R0.36399 CCCCCCCCCCCCCCCCCCP(=O)(O)O Amb16231488 [0,2,0,0,0,0|1,0,0]=3 325 B21R0.36399 CCCCCCCCCCCCCCCCCCS(=O)(=O)Cl Amb22045155 [0,2,0,0,0,0|1,0,1]=4 326 B21R0.36399 CCCCCCCCCCCCCCCCCC[Si](O)(O)O Amb22731662 [0,2,0,0,0,0|0,1,1]=4 327 B21R0.36399 CCCCCCCCCCCCCCCCCOS([O-])(=O)=O Amb22730858 [0,2,0,0,0,0|1,0,1]=4 328 B21R0.39788 OC(=O)CCCCCCCCCCCCCCCP(O)(O)=O Amb22336934 [0,2,0,0,0,0|2,0,0]=4 329 B21R0.39788 [2H]C([2H])([2H])CCCCCCCCCCCCCCCC(O)=O Amb21928719 [0,2,0,0,0,0|1,0,0]=3 330 B19R1.274 CCCCCCCCCCCCCC1OC(=O)C=C1 Amb17779781 [1,0,0,1,0,0|0,0,2]=4 331 B19R1.274 CCCCCCCCCCCCC[C@@H]1CCC(=O)O1 Amb24309496 [1,0,0,1,0,0|0,0,0]=2 332 B19R1.46520 CCCCCCCCCCCCCCCCC1CO1 Amb10807770 [1,0,0,1,0,0|1,0,1]=4 333 B19R1.46541 CCCCCCC1CC1CCCCCCCC(O)=O Amb22731768 [1,0,0,1,0,0|0,0,0]=2 334 B19R1.49447 OC(=O)CCCNC1CCCCCCCCCCC1 Amb23918289 [1,0,0,1,0,0|1,0,0]=3 335 B19R1.275 CCCCCCCCCCCCCC1CCCCC1 Amb22732441 [1,0,0,1,0,0|1,0,1]=4 336 B19R1.27373 CCCCCCCCCCCCC1CCCCC1=O Amb23967660 [1,0,0,1,0,0|0,0,0]=2 337 B19R1.46528 CCCCCCCCCCCCCCC1CCC1=O Amb22731416 [1,0,0,1,0,0|0,0,0]=2 338 B21R1.17805 CCCCCCCCC=1CC1CCCCCCCC(O)=O Amb20240506 [0,1,0,1,0,0|0,0,1]=3 339 B21R1.17805 CCCCCCCC[C@@H]1O[C@@H]1CCCCCCCC(O)=O Amb19132128 [0,1,0,1,0,0|0,0,0]=2 340 B21R1.17805 CCCCCCCC[C@@H]1O[C@H]1CCCCCCCC(=O)O Amb17613729 [0,1,0,1,0,0|0,0,0]=2 341 B21R1.4643069 OC(=O)CCCCCCCNC(=O)C1CCCCCCC1 Amb24941730 [0,1,0,1,0,0|1,0,1]=4 342 B21R1.1037565 O=C(NC1CCCCCCCCCCC1)CCCC(=O)O Amb1821556 [0,1,0,1,0,0|1,0,1]=4 343 B21R1.290332 CCCCCCC1CCC(O)C1CCCCCCC(O)=O Amb22235800 [0,1,0,1,0,0|0,0,0]=2 344 B21R1.17781 CCCCCCCCCCCCCCCCCCC1CO1 Amb22730432 [0,1,0,1,0,0|1,0,1]=4 345 B21R1.17781 CCCCCCCCCCCCCCCCOCC1CO1 Amb22338349 [0,1,0,1,0,0|1,0,1]=4 346 B21R2.12802 OC(=O)CCCCN1CCCC1CCC2CCCCC2 Amb24867776 [0,0,0,2,0,0|1,0,0]=3 347 B21R2.109886 C[C@@H]1CCCN1CCCCCCN2CCC[C@H]2C(O)=O Amb23401373 [0,0,0,2,0,0|2,0,0]=4