0 B10R0.31 C=C(C)CC(N)CC(C)(C)C Amb27271686 [0,0,0,0,0,0|4,0,0]=4 1 B10R0.31 C=C(C)CC(O)CC(C)(C)C Amb27492003 [0,0,0,0,0,0|3,0,0]=3 2 B10R0.31 C=C(CC(C)=O)C[Si](C)(C)C Amb28080320 [0,0,0,0,0,0|3,0,1]=4 3 B10R0.31 CC(=O)CC(=O)CC(C)(C)C Amb28080364 [0,0,0,0,0,0|2,0,2]=4 4 B10R0.31 CC(=O)CC(C)CC(C)(C)C Amb27672633 [0,0,0,0,0,0|3,0,0]=3 5 B10R0.31 CC(=O)CC(C)O[Si](C)(C)C Amb27269959 [0,0,0,0,0,0|4,0,0]=4 6 B10R0.31 CC(=O)CC(N)CC(C)(C)C Amb27672754 [0,0,0,0,0,0|3,0,0]=3 7 B10R0.31 CC(=O)CN(C)CC(C)(C)C Amb18183220 [0,0,0,0,0,0|4,0,0]=4 8 B10R0.31 CC(=O)C[C@@H](O)CC(C)(C)C Amb27673853 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.31 CC(=O)C[C@H](C)CC(C)(C)C Amb28080250 [0,0,0,0,0,0|3,0,0]=3 10 B10R0.31 CC(=O)C[C@H](O)CC(C)(C)C Amb27673854 [0,0,0,0,0,0|2,0,0]=2 11 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C Amb9826353 [0,0,0,0,0,0|3,0,0]=3 12 B10R0.31 CC(=O)O[C@@H](C)C[N+](C)(C)C Amb26659920 [0,0,0,0,0,0|3,0,0]=3 13 B10R0.31 CC(=O)SC(C)CC(C)(C)C Amb28079284 [0,0,0,0,0,0|4,0,0]=4 14 B10R0.31 CC(C)(C)CC(N)CC(=O)O Amb18830328 [0,0,0,0,0,0|2,0,1]=3 15 B10R0.31 CC(C)(C)CC(N)CC(=O)O Amb28652902 [0,0,0,0,0,0|2,0,1]=3 16 B10R0.31 CC(C)(C)CC(N)CC(N)=O Amb26076807 [0,0,0,0,0,0|3,0,0]=3 17 B10R0.31 CC(C)(C)CC(O)CC(=O)O Amb18315668 [0,0,0,0,0,0|1,0,1]=2 18 B10R0.31 CC(C)(C)C[C@@H](O)CC(=O)O Amb33380585 [0,0,0,0,0,0|1,0,1]=2 19 B10R0.31 CC(C)(C)C[C@H](O)CC(=O)O Amb33380584 [0,0,0,0,0,0|1,0,1]=2 20 B10R0.31 CC(C)(C)OC(=O)CC(=O)[O-] Amb33719318 [0,0,0,0,0,0|2,0,2]=4 21 B10R0.31 CC(CC(=O)Cl)CC(C)(C)C Amb2691152 [0,0,0,0,0,0|3,0,0]=3 22 B10R0.31 CC(CC(=O)O)CC(C)(C)C Amb2720439 [0,0,0,0,0,0|2,0,1]=3 23 B10R0.31 CC(CC(=O)O)NC(C)(C)C Amb17334468 [0,0,0,0,0,0|3,0,1]=4 24 B10R0.31 CC(CC(C)(C)C)NC(=O)Cl Amb35633426 [0,0,0,0,0,0|4,0,0]=4 25 B10R0.31 CC(CC(C)(C)C)NC(N)=O Amb28323990 [0,0,0,0,0,0|4,0,0]=4 26 B10R0.31 CC(CC(N)=O)CC(C)(C)C Amb27990240 [0,0,0,0,0,0|3,0,0]=3 27 B10R0.31 CC(CC(N)=O)NC(C)(C)C Amb17232263 [0,0,0,0,0,0|4,0,0]=4 28 B10R0.31 CC(C[N+](C)(C)C)OC(N)=O Amb8385027 [0,0,0,0,0,0|3,0,0]=3 29 B10R0.31 CN(C)CC(O)CC(C)(C)C Amb28079990 [0,0,0,0,0,0|4,0,0]=4 30 B10R0.31 CN(CC(=O)O)CC(C)(C)C Amb18800132 [0,0,0,0,0,0|3,0,1]=4 31 B10R0.31 CN(CC(=O)O)CC(C)(C)C Amb28652824 [0,0,0,0,0,0|3,0,1]=4 32 B10R0.31 CN(CC(N)=O)CC(C)(C)C Amb18799982 [0,0,0,0,0,0|4,0,0]=4 33 B10R0.31 CS(=O)(=O)CC(O)CC(=O)O Amb33056364 [0,0,0,0,0,0|3,0,1]=4 34 B10R0.31 CS(=O)(=O)C[C@@H](O)CC(=O)O Amb33481788 [0,0,0,0,0,0|3,0,1]=4 35 B10R0.31 CS(=O)(=O)C[C@H](O)CC(=O)O Amb33055950 [0,0,0,0,0,0|3,0,1]=4 36 B10R0.31 C[C@@H](CC(=O)O)OC(C)(C)C Amb27986820 [0,0,0,0,0,0|3,0,1]=4 37 B10R0.31 C[C@H](CC(=O)O)OC(C)(C)C Amb27986819 [0,0,0,0,0,0|3,0,1]=4 38 B10R0.31 C[C@H](C[N+](C)(C)C)OC(N)=O Amb17609377 [0,0,0,0,0,0|3,0,0]=3 39 B10R0.31 C[N+](C)(C)CC(Cl)CC(=O)O Amb28080266 [0,0,0,0,0,0|1,0,1]=2 40 B10R0.31 C[N+](C)(C)CC(O)CC(=O)O Amb4605818 [0,0,0,0,0,0|0,0,1]=1 41 B10R0.31 C[N+](C)(C)CC(O)CC(=O)[O-] Amb8383499 [0,0,0,0,0,0|0,0,0]=0 42 B10R0.31 C[N+](C)(C)CC(O)CC(=O)[O-] Amb8384249 [0,0,0,0,0,0|0,0,0]=0 43 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)O Amb22745454 [0,0,0,0,0,0|0,0,1]=1 44 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] Amb22230512 [0,0,0,0,0,0|0,0,0]=0 45 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] Amb6296945 [0,0,0,0,0,0|0,0,0]=0 46 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] Amb6600150 [0,0,0,0,0,0|0,0,0]=0 47 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O Amb22388510 [0,0,0,0,0,0|0,0,1]=1 48 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)O Amb8514771 [0,0,0,0,0,0|0,0,1]=1 49 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[O-] Amb6600027 [0,0,0,0,0,0|0,0,0]=0 50 B9R0.44 C#CCC(O)CC(C)(C)C Amb27768734 [1,0,0,0,0,0|2,0,1]=4 51 B9R0.44 C=CCC(N)CC(C)(C)C Amb27755806 [1,0,0,0,0,0|3,0,0]=4 52 B9R0.44 C=CCC(O)CC(C)(C)C Amb27442900 [1,0,0,0,0,0|2,0,0]=3 53 B9R0.44 CC(C)(C)CC(O)CC#N Amb24652007 [1,0,0,0,0,0|2,0,1]=4 54 B9R0.44 CC(C)(C)CC(O)CCN Amb22642672 [1,0,0,0,0,0|2,0,1]=4 55 B9R0.44 CC(C)(C)CC(O)CCO Amb23512817 [1,0,0,0,0,0|1,0,2]=4 56 B9R0.44 CC(C)(C)C[C@@H](O)CCN Amb33380582 [1,0,0,0,0,0|2,0,1]=4 57 B9R0.44 CC(C)(C)C[C@H](O)CCN Amb33380583 [1,0,0,0,0,0|2,0,1]=4 58 B9R0.44 CC(C)(C)C[C@H](O)CCO Amb28455675 [1,0,0,0,0,0|1,0,2]=4 59 B9R0.44 CC(CC=O)CC(C)(C)C Amb3939525 [1,0,0,0,0,0|2,0,0]=3 60 B9R0.44 CC(CC=O)O[Si](C)(C)C Amb28320574 [1,0,0,0,0,0|3,0,0]=4 61 B9R0.44 CCCC(O)C[N+](C)(C)C Amb27764769 [1,0,0,0,0,0|1,0,1]=3 62 B9R0.44 CNCC(O)CC(C)(C)C Amb18523862 [1,0,0,0,0,0|3,0,0]=4 63 B9R0.44 C[C@H](CC=O)CC(C)(C)C Amb27793117 [1,0,0,0,0,0|2,0,0]=3 64 B9R0.44 C[N+](C)(C)C[C@@H](O)CC#N Amb8515869 [1,0,0,0,0,0|1,0,1]=3 65 B9R0.44 C[Si](C)(C)CC(Cl)CN=O Amb27407086 [1,0,0,0,0,0|3,0,0]=4 66 B9R0.44 C\C=C\C(O)C[Si](C)(C)C Amb27812465 [1,0,0,0,0,0|2,0,1]=4 67 B9R0.53 C=C(C)CC(O)CN(C)C Amb27871979 [1,0,0,0,0,0|2,0,1]=4 68 B9R0.53 C=C(C)C[C@@H](O)CC(C)C Amb28050778 [1,0,0,0,0,0|3,0,0]=4 69 B9R0.53 CC(=O)CC(C)CC(C)C Amb20621119 [1,0,0,0,0,0|3,0,0]=4 70 B9R0.53 CC(=O)CC(C)CN(C)C Amb28252208 [1,0,0,0,0,0|2,0,1]=4 71 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [1,0,0,0,0,0|3,0,0]=4 72 B9R0.53 CC(=O)C[C@@H](O)CC(C)C Amb27471828 [1,0,0,0,0,0|2,0,0]=3 73 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [1,0,0,0,0,0|3,0,0]=4 74 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [1,0,0,0,0,0|2,0,1]=4 75 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [1,0,0,0,0,0|2,0,1]=4 76 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [1,0,0,0,0,0|3,0,0]=4 77 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [1,0,0,0,0,0|1,0,1]=3 78 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [1,0,0,0,0,0|2,0,1]=4 79 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [1,0,0,0,0,0|2,0,1]=4 80 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [1,0,0,0,0,0|1,0,1]=3 81 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [1,0,0,0,0,0|2,0,1]=4 82 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [1,0,0,0,0,0|2,0,1]=4 83 B9R0.53 CC(C)C[C@H](N)CC(N)=O Amb28120875 [1,0,0,0,0,0|3,0,0]=4 84 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [1,0,0,0,0,0|1,0,1]=3 85 B9R0.53 CC(CC(=O)O)CN(C)C Amb27948144 [1,0,0,0,0,0|1,0,2]=4 86 B9R0.53 CC(CC(=O)O)CN(C)C Amb32680754 [1,0,0,0,0,0|1,0,2]=4 87 B9R0.53 CN(C)CC(O)CC(=O)O Amb4477325 [1,0,0,0,0,0|0,0,2]=3 88 B9R0.53 CN(C)CC(O)CC(N)=S Amb27954030 [1,0,0,0,0,0|1,1,1]=4 89 B9R0.53 CN(C)C[C@H](O)CC(=O)O Amb10069803 [1,0,0,0,0,0|0,0,2]=3 90 B9R0.56 C=C(Br)CCCC(C)(C)C Amb27860453 [1,0,0,0,0,0|3,0,0]=4 91 B9R0.56 C=C(C)CCCC(C)(C)C Amb26001485 [1,0,0,0,0,0|3,0,0]=4 92 B9R0.56 C=C(Cl)CCCC(C)(C)C Amb28120618 [1,0,0,0,0,0|3,0,0]=4 93 B9R0.56 CC(=O)CCCC(C)(C)C Amb27466157 [1,0,0,0,0,0|2,0,0]=3 94 B9R0.56 CC(=O)CCCC(C)(C)O Amb17593627 [1,0,0,0,0,0|3,0,0]=4 95 B9R0.56 CC(=O)CCC[Si](C)(C)C Amb25879079 [1,0,0,0,0,0|2,0,0]=3 96 B9R0.56 CC(=O)CCNC(C)(C)C Amb24478983 [1,0,0,0,0,0|3,0,0]=4 97 B9R0.56 CC(=O)CCOC(C)(C)C Amb7793019 [1,0,0,0,0,0|3,0,0]=4 98 B9R0.56 CC(=O)NCC[Si](C)(C)C Amb27985894 [1,0,0,0,0,0|3,0,0]=4 99 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb3940923 [1,0,0,0,0,0|2,0,0]=3 100 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8514749 [1,0,0,0,0,0|2,0,0]=3 101 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8516476 [1,0,0,0,0,0|2,0,0]=3 102 B9R0.56 CC(=O)OCC[N+](C)(C)[O-] Amb28400650 [1,0,0,0,0,0|3,0,0]=4 103 B9R0.56 CC(=O)OCC[Si](C)(C)C Amb27155978 [1,0,0,0,0,0|3,0,0]=4 104 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb3429518 [1,0,0,0,0,0|2,0,0]=3 105 B9R0.56 CC(=O)SCC[Si](C)(C)C Amb27666582 [1,0,0,0,0,0|3,0,0]=4 106 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [1,0,0,0,0,0|1,0,1]=3 107 B9R0.56 CC(C)(C)CCCC(N)=O Amb25268901 [1,0,0,0,0,0|2,0,0]=3 108 B9R0.56 CC(C)(C)CCCS(=O)Cl Amb32720706 [1,0,0,0,0,0|3,0,0]=4 109 B9R0.56 CC(C)(C)CCCS(=O)[O-] Amb32754908 [1,0,0,0,0,0|2,0,0]=3 110 B9R0.56 CC(C)(C)CCCS(N)=O Amb32720707 [1,0,0,0,0,0|3,0,0]=4 111 B9R0.56 CC(C)(C)CCC[N+](=O)[O-] Amb33362527 [1,0,0,0,0,0|2,0,0]=3 112 B9R0.56 CC(C)(C)CCNC(=O)Cl Amb35625532 [1,0,0,0,0,0|3,0,0]=4 113 B9R0.56 CC(C)(C)CCOC(N)=O Amb24575181 [1,0,0,0,0,0|3,0,0]=4 114 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [1,0,0,0,0,0|2,0,1]=4 115 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [1,0,0,0,0,0|2,0,1]=4 116 B9R0.56 CC(C)(C)COCC(=O)Cl Amb21964966 [1,0,0,0,0,0|3,0,0]=4 117 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [1,0,0,0,0,0|2,0,1]=4 118 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [1,0,0,0,0,0|2,0,1]=4 119 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [1,0,0,0,0,0|2,0,1]=4 120 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.56 CC(C)(C)NCCC(N)=O Amb8842940 [1,0,0,0,0,0|3,0,0]=4 122 B9R0.56 CC(C)(C)OCCC(=O)O Amb2691288 [1,0,0,0,0,0|2,0,1]=4 123 B9R0.56 CC(C)(C)OCCC(N)=O Amb28398446 [1,0,0,0,0,0|3,0,0]=4 124 B9R0.56 CC(C)(C)OCCS(=O)[O-] Amb32754353 [1,0,0,0,0,0|3,0,0]=4 125 B9R0.56 CC(C)(C)OCC[N+](=O)[O-] Amb27244108 [1,0,0,0,0,0|3,0,0]=4 126 B9R0.56 CC(C)(C)SCCC(=O)O Amb6680208 [1,0,0,0,0,0|2,0,1]=4 127 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [1,0,0,0,0,0|2,0,1]=4 128 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.56 CC(C)(O)CCCC(=O)[O-] Amb32653027 [1,0,0,0,0,0|2,0,0]=3 130 B9R0.56 CC(Cl)CCC[N+](C)(C)C Amb27166118 [1,0,0,0,0,0|2,0,1]=4 131 B9R0.56 CC(O)CCC[N+](C)(C)C Amb27833684 [1,0,0,0,0,0|1,0,2]=4 132 B9R0.56 CN(C)(C)CCOC(N)=O Amb10241337 [1,0,0,0,0,0|2,0,1]=4 133 B9R0.56 C[N+](C)(C)CCCC(=O)O Amb9825976 [1,0,0,0,0,0|0,0,1]=2 134 B9R0.56 C[N+](C)(C)CCCC(=O)[O-] Amb25961797 [1,0,0,0,0,0|0,0,0]=1 135 B9R0.56 C[N+](C)(C)CCOC(N)=O Amb6296084 [1,0,0,0,0,0|2,0,0]=3 136 B9R0.56 C[N+](C)(C)CCOS(=O)[O-] Amb24681036 [1,0,0,0,0,0|2,0,0]=3 137 B9R0.56 C[N+](C)(C)C\C=C\C(=O)[O-] Amb22054782 [1,0,0,0,0,0|0,0,2]=3 138 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] Amb2099568 [1,0,0,0,0,0|1,0,0]=2 139 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] Amb28983712 [1,0,0,0,0,0|1,0,0]=2 140 B9R0.56 C[Si](C)(C)CCCC(=O)O Amb26455818 [1,0,0,0,0,0|1,0,1]=3 141 B9R0.56 C[Si](C)(C)CCOC(=O)Cl Amb33547034 [1,0,0,0,0,0|3,0,0]=4 142 B9R0.56 C[Si](C)(Cl)CCCC(=O)Cl Amb27623945 [1,0,0,0,0,0|3,0,0]=4 143 B11R0.51 CC(C(N)CC(=O)O)C(C)(C)C Amb32787951 [0,1,0,0,0,0|2,0,1]=4 144 B11R0.51 CC(C(N)CC(N)=O)C(C)(C)C Amb33255374 [0,1,0,0,0,0|3,0,0]=4 145 B11R0.51 CC([C@@H](N)CC(=O)O)C(C)(C)C Amb33254605 [0,1,0,0,0,0|2,0,1]=4 146 B11R0.51 CC([C@@H](N)CC(N)=O)C(C)(C)C Amb33255913 [0,1,0,0,0,0|3,0,0]=4 147 B11R0.51 CC([C@H](N)CC(=O)O)C(C)(C)C Amb33253926 [0,1,0,0,0,0|2,0,1]=4 148 B11R0.51 CC([C@H](N)CC(N)=O)C(C)(C)C Amb33255869 [0,1,0,0,0,0|3,0,0]=4 149 B11R0.119 COC(=O)CC(N)CC(C)(C)C Amb33164148 [0,1,0,0,0,0|2,0,1]=4 150 B11R0.119 COC(=O)CC(O)CC(C)(C)C Amb32953484 [0,1,0,0,0,0|1,0,1]=3 151 B11R0.119 COC(=O)C[C@@H](O)CC(C)(C)C Amb33359577 [0,1,0,0,0,0|1,0,1]=3 152 B11R0.119 COC(=O)C[C@H](O)CC(C)(C)C Amb33079036 [0,1,0,0,0,0|1,0,1]=3 153 B11R0.208 CC(C)(C)CC(C)(C)CC(=O)O Amb33429124 [0,1,0,0,0,0|2,0,1]=4 154 B11R0.208 CC(C)(C)CC(C)(N)CC(=O)O Amb32787983 [0,1,0,0,0,0|2,0,1]=4 155 B11R0.208 CC(C)(C)CC(C)(N)CC(N)=O Amb33255531 [0,1,0,0,0,0|3,0,0]=4 156 B11R0.208 CC(C)(C)CC(F)(F)CC(=O)O Amb32813869 [0,1,0,0,0,0|2,0,1]=4 157 B11R0.274 CC(C)(C)CC(CN)CC(=O)O Amb33475367 [0,1,0,0,0,0|2,0,1]=4 158 B11R0.300 COC(C)(C)CC(C)CC(=O)O Amb7797849 [0,1,0,0,0,0|2,0,1]=4 159 B11R0.300 COC(C)(C)CC(N)CC(=O)O Amb33255684 [0,1,0,0,0,0|2,0,1]=4 160 B11R0.300 COC(C)(C)CC(N)CC(N)=O Amb33254912 [0,1,0,0,0,0|3,0,0]=4 161 B11R0.300 COC(C)(C)CC(O)CC(=O)O Amb33172119 [0,1,0,0,0,0|1,0,1]=3 162 B11R0.300 COC(C)(C)C[C@@H](O)CC(=O)O Amb33195965 [0,1,0,0,0,0|1,0,1]=3 163 B11R0.300 COC(C)(C)C[C@H](O)CC(=O)O Amb33195963 [0,1,0,0,0,0|1,0,1]=3 164 B11R0.300 CSC(C)(C)CC(N)CC(=O)O Amb33308457 [0,1,0,0,0,0|2,0,1]=4 165 B11R0.300 CSC(C)(C)CC(N)CC(N)=O Amb33254250 [0,1,0,0,0,0|3,0,0]=4 166 B11R0.308 CC(C)(C)CC(O)C(N)C(=O)O Amb18197208 [0,1,0,0,0,0|1,0,1]=3 167 B11R0.308 CC(C)(C)CC(O)C(N)C(=O)O Amb33552671 [0,1,0,0,0,0|1,0,1]=3 168 B11R0.308 CC(CC(C)(C)C)C(C)C(=O)O Amb33738102 [0,1,0,0,0,0|2,0,1]=4 169 B11R0.308 CC(CC(C)(C)C)[C@@H](C)C(=O)O Amb33729603 [0,1,0,0,0,0|2,0,1]=4 170 B11R0.308 CC(CC(C)(C)C)[C@H](C)C(=O)O Amb33744365 [0,1,0,0,0,0|2,0,1]=4 171 B11R0.359 C[N+](C)(C)CC(O)CP(=O)([O-])O Amb32665991 [0,1,0,0,0,0|1,0,0]=2 172 B11R0.359 C[N+](C)(C)CC(O)C[N+](C)(C)C Amb33756893 [0,1,0,0,0,0|3,0,0]=4 173 B11R0.359 C[N+](C)(C)CC(O)C[N+](C)(C)C Amb9799773 [0,1,0,0,0,0|3,0,0]=4 174 B11R0.359 C[N+](C)(C)C[C@@H](O)CP(=O)([O-])O Amb19148285 [0,1,0,0,0,0|1,0,0]=2 175 B11R1.76 CC(C)(C)CC1CC(=O)CO1 Amb35726640 [0,0,0,1,0,0|2,0,0]=3 176 B11R1.76 CC(C)(C)CC1CC(=O)NN1 Amb35701153 [0,0,0,1,0,0|3,0,0]=4 177 B11R1.76 CC(C)(C)CC1CNC(=O)C1 Amb33529597 [0,0,0,1,0,0|3,0,0]=4 178 B11R1.76 C[N+](C)(C)CC1CC(O)CO1 Amb27416878 [0,0,0,1,0,0|1,0,2]=4 179 B11R1.76 C[N+](C)(C)C[C@@H]1CCC(=O)O1 Amb28464024 [0,0,0,1,0,0|3,0,0]=4 180 B11R1.76 C[N+](C)(C)C[C@H]1CNC(=O)O1 Amb27237605 [0,0,0,1,0,0|3,0,0]=4 181 B11R1.76 C[N+](C)(C)C[C@H]1C[C@@H](O)CO1 Amb27853784 [0,0,0,1,0,0|1,0,2]=4 182 B11R1.76 C[N+](C)(C)C[C@H]1C[C@H](O)CO1 Amb27853783 [0,0,0,1,0,0|1,0,2]=4 183 B11R1.488 C=C(C)C1CC(C)(C)CC1O Amb27823769 [0,0,0,1,0,0|3,0,0]=4 184 B11R1.488 CC1(C)CC(F)C(C(=O)O)C1 Amb28208602 [0,0,0,1,0,0|2,0,1]=4 185 B11R1.488 CC1(C)CC(O)C(C(=O)O)C1 Amb18126148 [0,0,0,1,0,0|1,0,1]=3 186 B11R1.488 CC1(C)C[C@@H](N)[C@H](C(=O)O)C1 Amb27231806 [0,0,0,1,0,0|2,0,1]=4 187 B11R1.488 CC1CC(C)(C)CC1[N+](=O)[O-] Amb33299034 [0,0,0,1,0,0|3,0,0]=4 188 B11R1.512 CC1(C)CNC(=O)CC(O)C1 Amb26327091 [0,0,0,1,0,0|2,0,0]=3 189 B11R1.512 CC1=CCC(C)(C)CC(O)C1 Amb27432187 [0,0,0,1,0,0|3,0,0]=4 190 B11R1.512 CC1CC(=O)CCC(C)(C)C1 Amb17593859 [0,0,0,1,0,0|3,0,0]=4 191 B11R1.514 CC(=O)C1C(C)C1[Si](C)(C)C Amb27974065 [0,0,0,1,0,0|3,0,0]=4 192 B11R1.583 CC(C)(C)CC1(C)CC(=O)N1 Amb28255761 [0,0,0,1,0,0|3,0,0]=4 193 B11R1.646 C[Si](C)(C)[C@H]1OC(=O)C[C@H]1O Amb28127367 [0,0,0,1,0,0|1,0,1]=3 194 B11R1.705 CC(C)(C)CC1CC1C(=O)O Amb18302717 [0,0,0,1,0,0|2,0,1]=4 195 B11R1.705 CC(C)(C)C[C@@H]1C[C@H]1C(=O)O Amb26446459 [0,0,0,1,0,0|2,0,1]=4 196 B11R1.710 CC(=O)CC1CCC(C)(C)C1 Amb33360818 [0,0,0,1,0,0|3,0,0]=4 197 B11R1.710 CC1(C)CCC(CC(=O)O)C1 Amb27669517 [0,0,0,1,0,0|2,0,1]=4 198 B11R1.710 CC1(C)CCC(C[N+](=O)[O-])C1 Amb33360160 [0,0,0,1,0,0|3,0,0]=4 199 B11R1.710 CC1(C)CNC(CC(=O)O)C1 Amb32834429 [0,0,0,1,0,0|2,0,1]=4 200 B11R1.710 CC1(C)CNC(CC(=O)O)C1 Amb33456407 [0,0,0,1,0,0|2,0,1]=4 201 B11R1.710 CC1(C)COC(CC(=O)O)C1 Amb32675272 [0,0,0,1,0,0|1,0,1]=3 202 B11R1.710 CC1(C)COC(CS(=O)Cl)C1 Amb32720722 [0,0,0,1,0,0|3,0,0]=4 203 B11R1.710 CC1(C)COC(CS(=O)[O-])C1 Amb32754938 [0,0,0,1,0,0|2,0,0]=3 204 B11R1.710 CC1(C)COC(CS(N)=O)C1 Amb32720729 [0,0,0,1,0,0|3,0,0]=4 205 B11R1.710 C[Si]1(C)CCC(CC(=O)O)C1 Amb29837978 [0,0,0,1,0,0|2,0,1]=4 206 B11R1.728 C=C(C)CC(O)CC1(C)CC1 Amb27673193 [0,0,0,1,0,0|3,0,0]=4 207 B11R1.1263 CC(CC(=O)O)C1CC1(C)C Amb27633520 [0,0,0,1,0,0|2,0,1]=4 208 B11R1.1263 CC1(C)CC1C(N)CC(=O)O Amb33308145 [0,0,0,1,0,0|2,0,1]=4 209 B11R1.1263 CC1(C)CC1C(N)CC(N)=O Amb33254205 [0,0,0,1,0,0|3,0,0]=4 210 B11R1.1263 CC1(C)CC1C(O)CC(=O)O Amb33036120 [0,0,0,1,0,0|1,0,1]=3 211 B11R1.1263 CC1(C)CC1[C@@H](N)CC(=O)O Amb33255871 [0,0,0,1,0,0|2,0,1]=4 212 B11R1.1263 CC1(C)CC1[C@@H](N)CC(N)=O Amb33308220 [0,0,0,1,0,0|3,0,0]=4 213 B11R1.1263 CC1(C)CC1[C@H](N)CC(=O)O Amb33254322 [0,0,0,1,0,0|2,0,1]=4 214 B11R1.1263 CC1(C)CC1[C@H](N)CC(N)=O Amb33255125 [0,0,0,1,0,0|3,0,0]=4 215 B11R1.1413 CC(=O)CC1(O)CC(C)(C)C1 Amb32943798 [0,0,0,1,0,0|2,0,0]=3 216 B11R1.1413 CC1(C)CC(N)(CC(=O)O)C1 Amb26532326 [0,0,0,1,0,0|2,0,1]=4 217 B11R1.1413 CC1(C)CC(N)(CC(N)=O)C1 Amb32787453 [0,0,0,1,0,0|3,0,0]=4 218 B9R0.10 C=C(C)C[C@H](O)C(C)(C)C Amb28293155 [0,0,0,0,1,0|3,0,0]=4 219 B9R0.10 CC(=O)CC(O)C(C)(C)C Amb28315879 [0,0,0,0,1,0|2,0,0]=3 220 B9R0.10 CC(=O)C[C@H](O)C(C)(C)C Amb27250072 [0,0,0,0,1,0|2,0,0]=3 221 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,0,0,0,1,0|2,0,1]=4 222 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,0,0,0,1,0|2,0,1]=4 223 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,0,0,0,1,0|3,0,0]=4 224 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,0,0,0,1,0|1,0,1]=3 225 B9R0.10 CC(C)(C)C(O)C[N+](=O)[O-] Amb27631975 [0,0,0,0,1,0|2,0,0]=3 226 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,0,0,0,1,0|2,0,1]=4 227 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,0,0,0,1,0|2,0,1]=4 228 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,0,0,0,1,0|1,0,1]=3 229 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,0,0,0,1,0|2,0,1]=4 230 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,0,0,0,1,0|1,0,1]=3 231 B9R0.10 CC(C)(C)[C@H]([NH3+])CC(=O)[O-] Amb22224981 [0,0,0,0,1,0|2,0,0]=3 232 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,0,0,0,1,0|2,0,1]=4 233 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,0,0,0,1,0|2,0,1]=4 234 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,0,0,0,1,0|2,0,1]=4 235 B9R0.10 CC(CC(=O)Cl)C(C)(C)C Amb27194252 [0,0,0,0,1,0|3,0,0]=4 236 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,0,0,0,1,0|2,0,1]=4 237 B9R0.10 CC(CC(N)=O)[Si](C)(C)C Amb27966699 [0,0,0,0,1,0|3,0,0]=4 238 B9R0.10 CC(CS(=O)[O-])C(C)(C)C Amb32755647 [0,0,0,0,1,0|3,0,0]=4 239 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,0,0,0,1,0|2,0,1]=4 240 B9R0.57 C=C(C)C(O)C[Si](C)(C)C Amb27756487 [0,0,0,0,1,0|3,0,0]=4 241 B9R0.57 CC(=O)C(Cl)CC(C)(C)C Amb25280760 [0,0,0,0,1,0|3,0,0]=4 242 B9R0.57 CC(=O)C(N)CC(C)(C)C Amb27959417 [0,0,0,0,1,0|3,0,0]=4 243 B9R0.57 CC(C)(C)CC(Cl)C(N)=O Amb18788248 [0,0,0,0,1,0|3,0,0]=4 244 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,0,0,0,1,0|2,0,1]=4 245 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,0,0,0,1,0|2,0,1]=4 246 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,0,0,0,1,0|3,0,0]=4 247 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,0,0,0,1,0|1,0,1]=3 248 B9R0.57 CC(C)(C)CC(O)C(N)=O Amb27482301 [0,0,0,0,1,0|2,0,0]=3 249 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,0,0,0,1,0|2,0,1]=4 250 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,0,0,0,1,0|2,0,1]=4 251 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,0,0,0,1,0|2,0,1]=4 252 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,0,0,0,1,0|2,0,1]=4 253 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] Amb33109899 [0,0,0,0,1,0|3,0,0]=4 254 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,0,0,0,1,0|2,0,1]=4 255 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,0,0,0,1,0|2,0,1]=4 256 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,0,0,0,1,0|2,0,1]=4 257 B9R0.57 CC(C[Si](C)(C)C)C(=O)O Amb28383938 [0,0,0,0,1,0|2,0,1]=4 258 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,0,0,0,1,0|2,0,1]=4 259 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,0,0,0,1,0|2,0,1]=4 260 B9R0.57 C[Si](C)(C)CC(N)C(=O)O Amb26361043 [0,0,0,0,1,0|2,0,1]=4 261 B9R0.57 C[Si](C)(C)CC(N)C(N)=O Amb33308618 [0,0,0,0,1,0|3,0,0]=4 262 B9R0.57 C[Si](C)(C)C[C@@H](N)C(=O)O Amb27658975 [0,0,0,0,1,0|2,0,1]=4 263 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O Amb24482244 [0,0,0,0,1,0|2,0,1]=4 264 B11R0.34 CC(C)(C)CC(N)CCC(=O)O Amb33203939 [0,0,0,0,0,1|2,0,1]=4 265 B11R0.34 C[N+](C)(C)CC(O)CCC(=O)[O-] Amb35750232 [0,0,0,0,0,1|0,0,0]=1 266 B11R0.337 CC(C)(C)OCC(N)CC(=O)O Amb33418836 [0,0,0,0,0,1|2,0,1]=4 267 B11R0.337 CC(C)(C)OCC(O)CC(=O)O Amb33326212 [0,0,0,0,0,1|1,0,1]=3 268 B11R0.337 CC(C)(C)OC[C@@H](O)CC(=O)O Amb33326210 [0,0,0,0,0,1|1,0,1]=3 269 B11R0.337 CC(C)(C)OC[C@H](N)CC(=O)O Amb33872291 [0,0,0,0,0,1|2,0,1]=4 270 B11R0.337 CC(C)(C)OC[C@H](N)CC(=O)O Amb35747672 [0,0,0,0,0,1|2,0,1]=4 271 B11R0.337 CC(C)(C)OC[C@H](O)CC(=O)O Amb33326209 [0,0,0,0,0,1|1,0,1]=3 272 B11R0.337 CC(COC(C)(C)C)CC(=O)O Amb33171489 [0,0,0,0,0,1|2,0,1]=4 273 B8R0.5 C=CC[C@@H](O)CC(C)C Amb28205994 [2,0,0,0,0,0|2,0,0]=4 274 B8R0.5 CC(C)CC(C)CC=O Amb18642682 [2,0,0,0,0,0|2,0,0]=4 275 B8R0.5 CC(CC=O)CN(C)C Amb28437243 [2,0,0,0,0,0|1,0,1]=4 276 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [2,0,0,0,0,0|1,0,1]=4 277 B8R0.5 CCCC(O)CC(C)=O Amb17593376 [2,0,0,0,0,0|2,0,0]=4 278 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [2,0,0,0,0,0|1,0,1]=4 279 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [2,0,0,0,0,0|2,0,0]=4 280 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [2,0,0,0,0,0|1,0,1]=4 281 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [2,0,0,0,0,0|0,0,2]=4 282 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [2,0,0,0,0,0|0,0,2]=4 283 B8R0.5 COCC(O)CC(=O)O Amb18832518 [2,0,0,0,0,0|1,0,1]=4 284 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [2,0,0,0,0,0|1,0,1]=4 285 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [2,0,0,0,0,0|1,0,1]=4 286 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [2,0,0,0,0,0|1,0,1]=4 287 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [2,0,0,0,0,0|1,0,1]=4 288 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [2,0,0,0,0,0|1,0,1]=4 289 B8R0.21 C=CCCCC(C)(C)C Amb24401111 [2,0,0,0,0,0|2,0,0]=4 290 B8R0.21 CC(C)(C)CCCC=O Amb10572631 [2,0,0,0,0,0|1,0,0]=3 291 B8R0.21 CC(C)(C)OCCC=O Amb27837421 [2,0,0,0,0,0|2,0,0]=4 292 B8R0.21 CC(C)(C)SCCC=O Amb27626394 [2,0,0,0,0,0|2,0,0]=4 293 B8R0.21 CC(C)(F)CCCC=O Amb26391695 [2,0,0,0,0,0|2,0,0]=4 294 B8R0.21 CCCCC[N+](C)(C)C Amb27403609 [2,0,0,0,0,0|1,0,1]=4 295 B8R0.21 C[N+](C)(C)CCCCCl Amb27613463 [2,0,0,0,0,0|1,0,1]=4 296 B8R0.21 C[N+](C)(C)CCCCN Amb27866246 [2,0,0,0,0,0|1,0,1]=4 297 B8R0.21 C[N+](C)(C)CCCCN Amb32661058 [2,0,0,0,0,0|1,0,1]=4 298 B8R0.21 C[N+](C)(C)CCCCN Amb32662609 [2,0,0,0,0,0|1,0,1]=4 299 B8R0.21 C[N+](C)(C)CCOC=O Amb28146044 [2,0,0,0,0,0|1,0,0]=3 300 B8R0.24 C=CC(O)CC(C)(C)C Amb24524557 [2,0,0,0,0,0|1,0,1]=4 301 B8R0.24 CC(C)(C)CC(O)CBr Amb33430166 [2,0,0,0,0,0|2,0,0]=4 302 B8R0.24 CC(C)(C)CC(O)CCl Amb26949752 [2,0,0,0,0,0|2,0,0]=4 303 B8R0.24 CC(C)(C)CC(O)CF Amb33380500 [2,0,0,0,0,0|2,0,0]=4 304 B8R0.24 CC(C)(C)CC(O)CN Amb19000297 [2,0,0,0,0,0|2,0,0]=4 305 B8R0.24 CC(C)(C)CC(O)CO Amb25778748 [2,0,0,0,0,0|1,0,1]=4 306 B8R0.24 CC(C)(C)C[C@@H](O)CN Amb33380586 [2,0,0,0,0,0|2,0,0]=4 307 B8R0.24 CC(C)(C)C[C@H](O)CN Amb33225145 [2,0,0,0,0,0|2,0,0]=4 308 B8R0.24 CC(C=O)CC(C)(C)C Amb17593351 [2,0,0,0,0,0|2,0,0]=4 309 B8R0.24 CC(CO)C[N+](C)(C)C Amb28050697 [2,0,0,0,0,0|1,0,1]=4 310 B8R0.24 CC[C@@H](O)CC(C)(C)C Amb27956604 [2,0,0,0,0,0|1,0,1]=4 311 B8R0.24 CC[C@H](O)CC(C)(C)C Amb27956605 [2,0,0,0,0,0|1,0,1]=4 312 B8R0.24 C[N+](C)(C)CC(O)CCl Amb8390707 [2,0,0,0,0,0|1,0,0]=3 313 B8R0.24 C[N+](C)(C)CC(O)CO Amb27982897 [2,0,0,0,0,0|0,0,1]=3 314 B8R0.24 C[N+](C)(C)CC(O)CO Amb30634320 [2,0,0,0,0,0|0,0,1]=3 315 B8R0.24 C[N+](C)(C)C[C@@H](O)CCl Amb26539671 [2,0,0,0,0,0|1,0,0]=3 316 B8R0.24 C[N+](C)(C)C[C@H](O)CCl Amb22351520 [2,0,0,0,0,0|1,0,0]=3 317 B8R0.24 C[Si](C)(C)CC(O)CO Amb22348110 [2,0,0,0,0,0|1,0,1]=4 318 B8R0.24 C[Si](C)(C)C[C@H](O)CO Amb27978541 [2,0,0,0,0,0|1,0,1]=4 319 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [2,0,0,0,0,0|2,0,0]=4 320 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [2,0,0,0,0,0|1,0,1]=4 321 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [2,0,0,0,0,0|1,0,1]=4 322 B8R0.28 CC(C)CCCS(=O)[O-] Amb32754454 [2,0,0,0,0,0|2,0,0]=4 323 B8R0.28 CC(C)CCC[N+](=O)[O-] Amb33226988 [2,0,0,0,0,0|2,0,0]=4 324 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [2,0,0,0,0,0|2,0,0]=4 325 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [2,0,0,0,0,0|1,0,1]=4 326 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [2,0,0,0,0,0|1,0,1]=4 327 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [2,0,0,0,0,0|0,0,2]=4 328 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [2,0,0,0,0,0|0,0,2]=4 329 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [2,0,0,0,0,0|1,0,1]=4 330 B8R0.28 CN(C)CCCS(=O)[O-] Amb32755542 [2,0,0,0,0,0|1,0,1]=4 331 B8R0.28 CN(C)CCC[N+](=O)[O-] Amb26394292 [2,0,0,0,0,0|1,0,1]=4 332 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [2,0,0,0,0,0|0,0,1]=3 333 B10R0.37 CC(C=O)C(C)CC(C)(C)C Amb18126026 [1,1,0,0,0,0|2,0,0]=4 334 B10R0.37 C[C@@H](CC(C)(C)C)C(Cl)C=O Amb27269193 [1,1,0,0,0,0|2,0,0]=4 335 B10R0.48 C=CCC(C)(O)CC(C)(C)C Amb28388041 [1,1,0,0,0,0|2,0,0]=4 336 B10R0.48 CC(C)(C)CC(C)(O)CC=O Amb28388051 [1,1,0,0,0,0|1,0,0]=3 337 B10R0.13 CC(=O)C(Cl)C(O)CC(C)C Amb27271144 [1,1,0,0,0,0|2,0,0]=4 338 B10R0.13 CC(=O)[C@@H](F)[C@@H](O)CC(C)C Amb27672403 [1,1,0,0,0,0|2,0,0]=4 339 B10R0.13 CC(=O)[C@@H](F)[C@H](O)CC(C)C Amb27672405 [1,1,0,0,0,0|2,0,0]=4 340 B10R0.13 CC(=O)[C@H](F)[C@H](O)CC(C)C Amb27672402 [1,1,0,0,0,0|2,0,0]=4 341 B10R0.13 CC(=O)[C@H](O)[C@@H](O)CC(C)C Amb27672506 [1,1,0,0,0,0|2,0,0]=4 342 B10R0.13 CC(C)CC(O)C(C)C(=O)O Amb18310730 [1,1,0,0,0,0|1,0,1]=4 343 B10R0.13 CC(C)CC(O)C(F)C(=O)O Amb33036201 [1,1,0,0,0,0|1,0,1]=4 344 B10R0.13 CC(C)CC(O)C(N)C(=O)O Amb26992515 [1,1,0,0,0,0|1,0,1]=4 345 B10R0.13 CC(C)CC(O)C(O)C(=O)O Amb27990260 [1,1,0,0,0,0|1,0,1]=4 346 B10R0.13 CC(C)C[C@@H](O)[C@@H](N)C(=O)O Amb27990182 [1,1,0,0,0,0|1,0,1]=4 347 B10R0.13 CC(C)C[C@@H](O)[C@H](N)C(=O)O Amb27990181 [1,1,0,0,0,0|1,0,1]=4 348 B10R0.13 CC(C)C[C@H](O)[C@H](N)C(=O)O Amb27271131 [1,1,0,0,0,0|1,0,1]=4 349 B10R0.44 CCC(C)CC(O)CC(=O)O Amb33036189 [1,1,0,0,0,0|1,0,1]=4 350 B10R0.44 COC(=O)CC(O)CC(C)C Amb33171598 [1,1,0,0,0,0|1,0,1]=4 351 B10R0.44 COC(=O)C[C@@H](O)CC(C)C Amb32953664 [1,1,0,0,0,0|1,0,1]=4 352 B10R0.44 COC(=O)C[C@H](O)CC(C)C Amb33448899 [1,1,0,0,0,0|1,0,1]=4 353 B10R0.70 COC(CC(C)C)CS(=O)[O-] Amb32755490 [1,1,0,0,0,0|2,0,0]=4 354 B10R0.165 CC(=O)CC(C)(O)CC(C)C Amb28080313 [1,1,0,0,0,0|2,0,0]=4 355 B10R0.165 CC(C)CC(C)(O)CC(=O)O Amb18310712 [1,1,0,0,0,0|1,0,1]=4 356 B10R0.12 CC(=O)SCC(C)[N+](C)(C)C Amb26083392 [1,1,0,0,0,0|2,0,0]=4 357 B10R0.12 CC(C)(C)C(Cl)CCC(=O)Cl Amb8631759 [1,1,0,0,0,0|2,0,0]=4 358 B10R0.12 CC(C)(C)C(N)CCC(=O)O Amb26083275 [1,1,0,0,0,0|1,0,1]=4 359 B10R0.12 CC(C)(C)C(N)CCC(N)=O Amb27989317 [1,1,0,0,0,0|2,0,0]=4 360 B10R0.12 CC(C)(C)C(O)CCC(=O)O Amb18797781 [1,1,0,0,0,0|1,0,1]=4 361 B10R0.12 CC(C)(C)C(O)CCC(=O)[O-] Amb33483277 [1,1,0,0,0,0|1,0,0]=3 362 B10R0.12 CC(C)(C)[C@H](O)CCC(=O)O Amb27990178 [1,1,0,0,0,0|1,0,1]=4 363 B10R0.12 CC(CCC(=O)O)C(C)(C)C Amb24755137 [1,1,0,0,0,0|1,0,1]=4 364 B10R0.60 C=CC(=O)NCC[N+](C)(C)C Amb27000073 [1,1,0,0,0,0|2,0,0]=4 365 B10R0.60 C=CC(=O)OCC[N+](C)(C)C Amb6609034 [1,1,0,0,0,0|2,0,0]=4 366 B10R0.60 CCC(=O)NCC[N+](C)(C)C Amb27672071 [1,1,0,0,0,0|2,0,0]=4 367 B10R0.60 CCC(=O)OCC[N+](C)(C)C Amb4008407 [1,1,0,0,0,0|2,0,0]=4 368 B10R0.60 CCC(=O)SCC[N+](C)(C)C Amb8513393 [1,1,0,0,0,0|2,0,0]=4 369 B10R0.60 CNC(=O)OCC[N+](C)(C)C Amb26990641 [1,1,0,0,0,0|2,0,0]=4 370 B10R0.60 COC(=O)CCC[N+](C)(C)C Amb15691776 [1,1,0,0,0,0|0,0,1]=3 371 B10R0.60 COC(=O)CCC[N+](C)(C)C Amb8397224 [1,1,0,0,0,0|0,0,1]=3 372 B10R0.60 COC(=O)CCN[N+](C)(C)C Amb1971469 [1,1,0,0,0,0|1,0,1]=4 373 B10R0.60 COC(=O)CCN[N+](C)(C)C Amb3986876 [1,1,0,0,0,0|1,0,1]=4 374 B10R0.60 COC(=O)CCN[N+](C)(C)C Amb6362296 [1,1,0,0,0,0|1,0,1]=4 375 B10R0.60 C[N+](C)(C)NCCC(=O)NN Amb3443958 [1,1,0,0,0,0|2,0,0]=4 376 B10R0.65 CC(=O)CCCC(C)(C)CO Amb28652998 [1,1,0,0,0,0|2,0,0]=4 377 B10R0.65 CC(C)(CO)CCCC(=O)O Amb33197662 [1,1,0,0,0,0|1,0,1]=4 378 B10R0.65 CCC(C)(C)CCCC(=O)O Amb16233621 [1,1,0,0,0,0|1,0,1]=4 379 B10R0.65 COC(C)(C)CCCC(=O)O Amb32953229 [1,1,0,0,0,0|1,0,1]=4 380 B10R0.65 COC(C)(C)CCCC(C)=O Amb33449993 [1,1,0,0,0,0|2,0,0]=4 381 B10R0.65 COC(C)(C)CCC[N+](=O)[O-] Amb33195585 [1,1,0,0,0,0|2,0,0]=4 382 B10R0.92 CC(C)(C)CCC(N)C(=O)O Amb18307415 [1,1,0,0,0,0|1,0,1]=4 383 B10R0.92 CC(C)(C)CCC(N)C(=O)O Amb32882445 [1,1,0,0,0,0|1,0,1]=4 384 B10R0.92 CC(C)(C)CCC(N)C(N)=O Amb27986986 [1,1,0,0,0,0|2,0,0]=4 385 B10R0.92 CC(C)(C)CCC(N)C(N)=O Amb33528956 [1,1,0,0,0,0|2,0,0]=4 386 B10R0.92 CC(C)(C)CCC(O)C(=O)O Amb27271609 [1,1,0,0,0,0|1,0,1]=4 387 B10R0.92 CC(C)(C)CC[C@@H](N)C(=O)O Amb25383852 [1,1,0,0,0,0|1,0,1]=4 388 B10R0.92 CC(C)(C)CC[C@H](N)C(=O)O Amb28386947 [1,1,0,0,0,0|1,0,1]=4 389 B10R0.92 CC(CCC(C)(C)C)C(=O)O Amb18307461 [1,1,0,0,0,0|1,0,1]=4 390 B10R0.92 C[C@@H](CCC(C)(C)C)C(=O)O Amb33744627 [1,1,0,0,0,0|1,0,1]=4 391 B10R0.92 C[C@H](CCC(C)(C)C)C(=O)O Amb33749381 [1,1,0,0,0,0|1,0,1]=4 392 B10R0.113 C[N+](C)(C)CCCS(=O)(=O)[O-] Amb24764422 [1,1,0,0,0,0|1,0,0]=3 393 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] Amb20242390 [1,1,0,0,0,0|2,0,0]=4 394 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] Amb27001360 [1,1,0,0,0,0|2,0,0]=4 395 B10R0.113 C[Si](C)(C)CCCS(=O)(=O)[O-] Amb2196500 [1,1,0,0,0,0|2,0,0]=4 396 B10R0.14 CC(C)(C)C(C)(O)CC(=O)O Amb18199841 [0,1,0,0,1,0|1,0,1]=4 397 B10R0.52 C=CC(=O)C[C@@H](O)C(C)(C)C Amb27673850 [0,1,0,0,1,0|2,0,0]=4 398 B10R0.52 C=CC(=O)C[C@H](O)C(C)(C)C Amb27673852 [0,1,0,0,1,0|2,0,0]=4 399 B10R0.52 CCC(=O)CC(O)C(C)(C)C Amb27672394 [0,1,0,0,1,0|2,0,0]=4 400 B10R0.52 CCC(=O)C[C@@H](O)C(C)(C)C Amb27672311 [0,1,0,0,1,0|2,0,0]=4 401 B10R0.52 CCC(=O)C[C@H](O)C(C)(C)C Amb27672312 [0,1,0,0,1,0|2,0,0]=4 402 B10R0.52 COC(=O)CC(O)C(C)(C)C Amb26658853 [0,1,0,0,1,0|1,0,1]=4 403 B10R0.52 COC(=O)C[C@@H](O)C(C)(C)C Amb26999435 [0,1,0,0,1,0|1,0,1]=4 404 B10R0.52 COC(=O)C[C@H](O)C(C)(C)C Amb25386090 [0,1,0,0,1,0|1,0,1]=4 405 B10R0.63 CC(C)(CO)C(O)CC(=O)O Amb33200304 [0,1,0,0,1,0|1,0,1]=4 406 B10R0.63 CC(C)(CO)[C@@H](O)CC(=O)O Amb33200303 [0,1,0,0,1,0|1,0,1]=4 407 B10R0.63 CC(C)(CO)[C@H](O)CC(=O)O Amb33200302 [0,1,0,0,1,0|1,0,1]=4 408 B10R0.63 CCC(C)(C)C(O)CC(=O)O Amb33358953 [0,1,0,0,1,0|1,0,1]=4 409 B10R0.63 CCC(C)(C)[C@@H](O)CC(=O)O Amb33267054 [0,1,0,0,1,0|1,0,1]=4 410 B10R0.63 CCC(C)(C)[C@H](O)CC(=O)O Amb33267052 [0,1,0,0,1,0|1,0,1]=4 411 B10R0.154 CC(C(=O)O)C(O)C(C)(C)C Amb18298163 [0,1,0,0,1,0|1,0,1]=4 412 B10R0.154 CC(C)(C)C(O)C(F)C(=O)O Amb33136390 [0,1,0,0,1,0|1,0,1]=4 413 B10R0.154 CC(C)(C)C(O)C(N)C(=O)O Amb18126286 [0,1,0,0,1,0|1,0,1]=4 414 B10R0.154 CC(C)(C)[C@H](O)[C@@H](N)C(=O)O Amb25723927 [0,1,0,0,1,0|1,0,1]=4 415 B10R0.154 C[C@H](C(=O)O)[C@H](O)C(C)(C)C Amb27966851 [0,1,0,0,1,0|1,0,1]=4 416 B10R0.67 CC(C)(CO)CC(O)C(=O)O Amb33200342 [0,1,0,0,1,0|1,0,1]=4 417 B10R0.67 CCC(C)(C)CC(O)C(=O)O Amb33267014 [0,1,0,0,1,0|1,0,1]=4 418 B10R0.67 COC(C)(C)CC(O)C(=O)O Amb26997370 [0,1,0,0,1,0|1,0,1]=4 419 B10R0.95 CC(C)(C)CC(CO)C(=O)O Amb27272417 [0,1,0,0,1,0|1,0,1]=4 420 B10R0.95 COC(CC(C)(C)C)C(=O)O Amb24750716 [0,1,0,0,1,0|1,0,1]=4 421 B10R0.163 CC(=O)C(C)(C)C[N+](C)(C)C Amb2780725 [0,1,0,0,1,0|2,0,0]=4 422 B10R0.163 CC(C)(C)CC(C)(O)C(=O)O Amb27985910 [0,1,0,0,1,0|1,0,1]=4 423 B12R0.484 COC(=O)CC(O)COC(C)(C)C Amb33172644 [0,1,0,0,0,1|1,0,1]=4 424 B12R0.484 COC(=O)C[C@@H](O)COC(C)(C)C Amb33080311 [0,1,0,0,0,1|1,0,1]=4 425 B12R0.484 COC(=O)C[C@H](O)COC(C)(C)C Amb33358385 [0,1,0,0,0,1|1,0,1]=4 426 B12R0.947 CC(C)(C)OCC(O)C(N)C(=O)O Amb33326215 [0,1,0,0,0,1|1,0,1]=4 427 B12R0.619 COC(=O)CC(O)CC(C)(C)OC Amb33171599 [0,2,0,0,0,0|1,0,1]=4 428 B12R0.619 COC(=O)C[C@@H](O)CC(C)(C)OC Amb33474022 [0,2,0,0,0,0|1,0,1]=4 429 B12R0.619 COC(=O)C[C@H](O)CC(C)(C)OC Amb32953862 [0,2,0,0,0,0|1,0,1]=4 430 B12R0.764 CC(C)(C)CC(O)(CN)CC(=O)O Amb33346955 [0,2,0,0,0,0|1,0,1]=4 431 B12R0.393 CC(C)(C)CC(CC(=O)O)C(=O)O Amb26304265 [0,2,0,0,0,0|1,0,1]=4 432 B12R0.594 COC(C)(C)CC(O)C(N)C(=O)O Amb33473886 [0,2,0,0,0,0|1,0,1]=4 433 B12R0.691 CC(C)(C)CC(O)C(F)(F)C(=O)O Amb19043551 [0,2,0,0,0,0|1,0,1]=4 434 B10R1.33 CC1CC(C)(C)CC1C=O Amb27198146 [1,0,0,1,0,0|2,0,0]=4 435 B10R1.65 CC(C)(C)[C@@H]1C=CC[C@@H]1O Amb27632011 [1,0,0,1,0,0|2,0,0]=4 436 B10R1.95 CC1(C)CCC(CC=O)C1 Amb33360171 [1,0,0,1,0,0|2,0,0]=4 437 B10R1.166 C[Si](C)(C)CC1CC1C=O Amb26875534 [1,0,0,1,0,0|2,0,0]=4 438 B10R1.166 C[Si](C)(C)C[C@@H]1C[C@@H]1C=O Amb27455487 [1,0,0,1,0,0|2,0,0]=4 439 B10R1.166 C[Si](C)(C)C[C@@H]1C[C@H]1C=O Amb24625760 [1,0,0,1,0,0|2,0,0]=4 440 B10R1.166 C[Si](C)(C)C[C@H]1C[C@H]1C=O Amb28322082 [1,0,0,1,0,0|2,0,0]=4 441 B10R1.281 C[N+](C)(C)CC1COCO1 Amb28368159 [1,0,0,1,0,0|2,0,0]=4 442 B10R1.329 CC1(C)CC(=O)CC(N)C1 Amb28411500 [1,0,0,1,0,0|2,0,0]=4 443 B10R1.329 CC1(C)CC(=O)C[C@@H](O)C1 Amb27614905 [1,0,0,1,0,0|1,0,0]=3 444 B10R1.329 CC1CC(=O)CC(C)(C)C1 Amb9703082 [1,0,0,1,0,0|2,0,0]=4 445 B10R1.329 C[C@@H]1CC(=O)CC(C)(C)C1 Amb28074776 [1,0,0,1,0,0|2,0,0]=4 446 B10R1.329 C[C@H]1CC(=O)CC(C)(C)C1 Amb26479464 [1,0,0,1,0,0|2,0,0]=4 447 B10R1.525 CC1(C)CC(O)(CC=O)C1 Amb27786595 [1,0,0,1,0,0|1,0,0]=3 448 B10R1.54 CC(=O)CC1CC(C)CO1 Amb27776049 [1,0,0,1,0,0|2,0,0]=4 449 B10R1.54 CC(C)CC1CC(=O)CO1 Amb35718942 [1,0,0,1,0,0|2,0,0]=4 450 B10R1.59 CC(C)C1NC(=O)CC1O Amb27605833 [1,0,0,1,0,0|2,0,0]=4 451 B10R1.59 CC(C)[C@@H]1NC(=O)C[C@H]1O Amb27780062 [1,0,0,1,0,0|2,0,0]=4 452 B10R1.59 CC(C)[C@H]1NC(=O)C[C@H]1O Amb27493519 [1,0,0,1,0,0|2,0,0]=4 453 B10R1.59 CC(C)[C@H]1OC(=O)C[C@H]1O Amb27653144 [1,0,0,1,0,0|1,0,1]=4 454 B10R1.110 CC1CC1C(O)CC(=O)O Amb33036107 [1,0,0,1,0,0|1,0,1]=4 455 B10R1.110 CC1CC1[C@@H](O)CC(=O)O Amb33144258 [1,0,0,1,0,0|1,0,1]=4 456 B10R1.110 CC1CC1[C@H](O)CC(=O)O Amb33144257 [1,0,0,1,0,0|1,0,1]=4 457 B10R1.268 O=C(O)CC(O)CC1CC1 Amb33036272 [1,0,0,1,0,0|1,0,1]=4 458 B10R1.268 O=C(O)C[C@@H](O)CC1CC1 Amb33361926 [1,0,0,1,0,0|1,0,1]=4 459 B10R1.268 O=C(O)C[C@H](O)CC1CC1 Amb33361927 [1,0,0,1,0,0|1,0,1]=4 460 B10R1.368 CC(=O)C1OC1CC(C)C Amb28126810 [1,0,0,1,0,0|2,0,0]=4 461 B10R1.368 CC(=O)CC1OC1C(C)C Amb27238111 [1,0,0,1,0,0|2,0,0]=4 462 B10R1.368 CC(C)CC1OC1C(=O)O Amb28397897 [1,0,0,1,0,0|1,0,1]=4 463 B10R1.55 CC(C)(C)C1CCC(=O)C1 Amb21959250 [1,0,0,1,0,0|2,0,0]=4 464 B10R1.55 CC(C)(C)C1CCC(=O)O1 Amb33483251 [1,0,0,1,0,0|1,0,1]=4 465 B10R1.302 CC1(C)CCCC(=O)CC1 Amb25843855 [1,0,0,1,0,0|2,0,0]=4 466 B10R1.302 C[N+]1(C)CCNC(=O)CC1 Amb27780856 [1,0,0,1,0,0|2,0,0]=4 467 B10R1.302 C[Si]1(C)CCCC(=O)CC1 Amb27211955 [1,0,0,1,0,0|2,0,0]=4 468 B10R1.347 CC(=O)C1CC1[Si](C)(C)C Amb26607826 [1,0,0,1,0,0|2,0,0]=4 469 B10R1.347 CC(=O)[C@@H]1C[C@H]1[Si](C)(C)C Amb25109566 [1,0,0,1,0,0|2,0,0]=4 470 B10R1.347 CC(=O)[C@H]1C[C@@H]1[Si](C)(C)C Amb27427937 [1,0,0,1,0,0|2,0,0]=4 471 B10R1.347 CC(C)(C)C1CC1C(=O)Cl Amb30038801 [1,0,0,1,0,0|2,0,0]=4 472 B10R1.347 CC(C)(C)C1CC1C(=O)O Amb27831925 [1,0,0,1,0,0|1,0,1]=4 473 B10R1.347 CC(C)(C)C1CC1C(N)=O Amb27864086 [1,0,0,1,0,0|2,0,0]=4 474 B10R1.347 CC(C)(C)[C@@H]1C[C@H]1C(=O)O Amb32660488 [1,0,0,1,0,0|1,0,1]=4 475 B10R1.347 CC(C)(C)[C@@H]1C[C@H]1C(N)=O Amb26914748 [1,0,0,1,0,0|2,0,0]=4 476 B10R1.347 C[Si](C)(C)C1CC1C(N)=O Amb26570967 [1,0,0,1,0,0|2,0,0]=4 477 B10R1.347 C[Si](C)(C)[C@H]1C[C@H]1C(=O)O Amb28385452 [1,0,0,1,0,0|1,0,1]=4 478 B10R1.350 CC1(CCCC(=O)O)CC1 Amb16232020 [1,0,0,1,0,0|1,0,1]=4 479 B10R1.352 CC1(C)CC1CCC(=O)O Amb25697470 [1,0,0,1,0,0|1,0,1]=4 480 B10R1.359 CC(=O)C1CCC(C)(C)C1 Amb25136434 [1,0,0,1,0,0|2,0,0]=4 481 B10R1.359 CC1(C)CCC(C(=O)O)C1 Amb33545093 [1,0,0,1,0,0|1,0,1]=4 482 B10R1.359 CC1(C)CCC([N+](=O)[O-])C1 Amb33299051 [1,0,0,1,0,0|2,0,0]=4 483 B10R1.359 C[Si]1(C)CCC(C(=O)O)C1 Amb29837961 [1,0,0,1,0,0|1,0,1]=4 484 B10R1.63 CC1(C)CCC(=O)CC1O Amb26044466 [0,0,0,1,1,0|2,0,0]=4 485 B10R1.63 CC1(C)COC(=O)CC1O Amb27752312 [0,0,0,1,1,0|1,0,1]=4 486 B10R1.267 CC1(C(O)CC(=O)O)CC1 Amb33036241 [0,0,0,1,1,0|1,0,1]=4 487 B10R1.267 CC1([C@@H](O)CC(=O)O)CC1 Amb33195454 [0,0,0,1,1,0|1,0,1]=4 488 B10R1.267 CC1([C@H](O)CC(=O)O)CC1 Amb33313123 [0,0,0,1,1,0|1,0,1]=4 489 B10R1.84 CC(C)(C)C1NC(=O)C1O Amb27845513 [0,0,0,1,1,0|2,0,0]=4 490 B10R1.147 CC1(C)CCC(=O)C(O)C1 Amb24706062 [0,0,0,1,1,0|2,0,0]=4 491 B10R1.147 CC1C[N+](C)(C)CCC1=O Amb1099362 [0,0,0,1,1,0|2,0,0]=4 492 B10R1.147 CC1C[N+](C)(C)CCC1=O Amb22445818 [0,0,0,1,1,0|2,0,0]=4 493 B10R1.203 CC1(CC(O)C(=O)O)CC1 Amb28428408 [0,0,0,1,1,0|1,0,1]=4 494 B10R1.203 CC1(C[C@@H](O)C(=O)O)CC1 Amb28050040 [0,0,0,1,1,0|1,0,1]=4 495 B10R1.494 CC(=O)C(O)C1CC1(C)C Amb27212866 [0,0,0,1,1,0|2,0,0]=4 496 B10R1.566 CC1(C)CC(O)(C(=O)O)C1 Amb27953290 [0,0,0,1,1,0|1,0,1]=4 497 B12R1.128 CC(C)(C)[C@@H]1CC(=O)CC[C@H]1O Amb28052251 [0,0,0,1,0,1|2,0,0]=4 498 B12R1.844 CC(=O)O[C@H]1C[Si](C)(C)C[C@@H]1O Amb27451992 [0,0,0,1,0,1|2,0,0]=4 499 B12R1.1806 CC1(C)COC(CCC(=O)O)C1 Amb25342863 [0,0,0,1,0,1|1,0,1]=4 500 B12R1.3005 CC1(C)CC(O)CC(C(=O)O)C1 Amb24459861 [0,0,0,1,0,1|1,0,1]=4 501 B12R1.102 CC(C)(C)[C@@H]1C[C@@H](O)CC(=O)O1 Amb27206572 [0,0,0,1,0,1|1,0,1]=4 502 B12R1.350 CC1(C)CC[C@@H](O)[C@@H](C(=O)O)C1 Amb27632473 [0,0,0,1,0,1|1,0,1]=4 503 B12R1.350 CC1(C)CC[C@@H](O)[C@H](C(=O)O)C1 Amb27637699 [0,0,0,1,0,1|1,0,1]=4 504 B12R1.1819 CC1(C)CCC(CC(=O)O)OC1 Amb32676800 [0,0,0,1,0,1|1,0,1]=4 505 B12R1.1819 CC1(C)CCC(CS(=O)[O-])OC1 Amb32755752 [0,0,0,1,0,1|2,0,0]=4 506 B12R1.1819 CC1(C)COC(CC(=O)O)CN1 Amb2699614 [0,0,0,1,0,1|1,0,1]=4 507 B12R1.1819 CC1(C)COC(CC(=O)O)CN1 Amb35750096 [0,0,0,1,0,1|1,0,1]=4 508 B12R1.1819 CC1(C)COC(CC(N)=O)OC1 Amb27592500 [0,0,0,1,0,1|2,0,0]=4 509 B12R1.1819 CC1(C)COC(C[N+](=O)[O-])OC1 Amb25051768 [0,0,0,1,0,1|2,0,0]=4 510 B12R1.1819 CC1(C)CO[C@@H](CC(=O)O)CN1 Amb2699609 [0,0,0,1,0,1|1,0,1]=4 511 B12R1.1819 CC1(C)CO[C@H](CC(=O)O)CN1 Amb22747814 [0,0,0,1,0,1|1,0,1]=4 512 B12R1.1831 CC(=O)CC1(O)CCC(C)(C)C1 Amb32943792 [0,0,0,1,0,1|2,0,0]=4 513 B12R1.1831 CC1(C)CC(O)(CC(=O)O)CO1 Amb25228643 [0,0,0,1,0,1|1,0,1]=4 514 B12R1.126 CC(C)(C)C1CCC(=O)CC1O Amb25287274 [0,1,0,1,0,0|2,0,0]=4 515 B12R1.126 CC(C)(C)C1COC(=O)CC1O Amb27775418 [0,1,0,1,0,0|1,0,1]=4 516 B12R1.126 CC(C)(C)[C@@H]1COC(=O)C[C@@H]1O Amb27422557 [0,1,0,1,0,0|1,0,1]=4 517 B12R1.126 CC(C)(C)[C@H]1CCC(=O)C[C@H]1O Amb27668836 [0,1,0,1,0,0|2,0,0]=4 518 B12R1.837 CC(C1CC(=O)CO1)C(C)(C)C Amb35718681 [0,1,0,1,0,0|2,0,0]=4 519 B12R1.119 CC(C)(C)CC1CC(=O)C=CO1 Amb27949863 [0,1,0,1,0,0|2,0,0]=4 520 B12R1.361 COC(=O)C1CC(C)(C)CC1O Amb24537798 [0,1,0,1,0,0|1,0,1]=4 521 B12R1.193 COC(C)(C)CC1CC(=O)CO1 Amb35718623 [0,1,0,1,0,0|2,0,0]=4 522 B12R1.193 CSC(C)(C)CC1CC(=O)CO1 Amb35593779 [0,1,0,1,0,0|2,0,0]=4 523 B12R1.853 CC(C)(C)C1OC(=O)C(O)C1O Amb27615545 [0,1,0,1,0,0|1,0,1]=4 524 B12R1.2203 CC(C(=O)O)C1CC(C)(C)CO1 Amb33744669 [0,1,0,1,0,0|1,0,1]=4 525 B12R1.2203 C[C@@H](C(=O)O)C1CC(C)(C)CO1 Amb33738421 [0,1,0,1,0,0|1,0,1]=4 526 B12R1.2203 C[C@H](C(=O)O)C1CC(C)(C)CO1 Amb33744940 [0,1,0,1,0,0|1,0,1]=4 527 B12R1.4004 CC1(C)CC(O)(C(O)C(=O)O)C1 Amb32946635 [0,1,0,1,0,0|1,0,1]=4 528 B12R2.2922 CC1(C)CC2(CC(=O)CO2)C1 Amb35718692 [0,0,0,2,0,0|2,0,0]=4 529 B12R2.5482 CC1(C)CCC(=O)C2OC2C1 Amb22356971 [0,0,0,2,0,0|2,0,0]=4 530 B12R2.3612 O=C(O)CC1CC2(CC2)CO1 Amb35746888 [0,0,0,2,0,0|1,0,1]=4 531 B12R2.5090 O=C(O)CC(O)C1CC12CC2 Amb33036117 [0,0,0,2,0,0|1,0,1]=4 532 B8R0.14 C=CCC(O)C(C)(C)C Amb4020594 [1,0,0,0,1,0|2,0,0]=4 533 B8R0.14 C=CC[C@@H](O)[Si](C)(C)C Amb27205846 [1,0,0,0,1,0|2,0,0]=4 534 B8R0.14 C=CC[C@H](O)C(C)(C)C Amb27805795 [1,0,0,0,1,0|2,0,0]=4 535 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [1,0,0,0,1,0|2,0,0]=4 536 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [1,0,0,0,1,0|2,0,0]=4 537 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [1,0,0,0,1,0|2,0,0]=4 538 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [1,0,0,0,1,0|1,0,1]=4 539 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [1,0,0,0,1,0|1,0,1]=4 540 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [1,0,0,0,1,0|1,0,0]=3 541 B8R0.23 CC(C)CC(O)[N+](=O)[O-] Amb27162218 [1,0,0,0,1,0|2,0,0]=4 542 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [1,0,0,0,1,0|1,0,1]=4 543 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [1,0,0,0,1,0|1,0,1]=4 544 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [1,0,0,0,1,0|1,0,1]=4 545 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [1,0,0,0,1,0|2,0,0]=4 546 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [1,0,0,0,1,0|1,0,1]=4 547 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [1,0,0,0,1,0|0,0,2]=4 548 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [1,0,0,0,1,0|0,0,2]=4 549 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [1,0,0,0,1,0|2,0,0]=4 550 B8R0.29 CC(=O)CC[N+](C)(C)C Amb4015632 [1,0,0,0,1,0|1,0,0]=3 551 B8R0.29 CC(=O)CC[Si](C)(C)C Amb28324359 [1,0,0,0,1,0|2,0,0]=4 552 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [1,0,0,0,1,0|2,0,0]=4 553 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [1,0,0,0,1,0|1,0,1]=4 554 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [1,0,0,0,1,0|2,0,0]=4 555 B8R0.29 CC(C)(C)CCS(=O)[O-] Amb26987947 [1,0,0,0,1,0|2,0,0]=4 556 B8R0.29 CC(C)(C)CC[N+](=O)[O-] Amb32954794 [1,0,0,0,1,0|2,0,0]=4 557 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [1,0,0,0,1,0|2,0,0]=4 558 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [1,0,0,0,1,0|0,0,1]=3 559 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [1,0,0,0,1,0|0,0,1]=3 560 B8R0.29 C[N+](C)(C)CCC(=O)[O-] Amb26420871 [1,0,0,0,1,0|0,0,0]=2 561 B8R0.29 C[N+](C)(C)\C=C\C(=O)[O-] Amb26944755 [1,0,0,0,1,0|0,0,2]=4 562 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [1,0,0,0,1,0|1,0,1]=4 563 B8R0.29 C[Si](C)(C)CCC(=O)Cl Amb27187901 [1,0,0,0,1,0|2,0,0]=4 564 B8R0.27 CC(=O)C(O)C(C)(C)C Amb27805300 [0,0,0,0,2,0|2,0,0]=4 565 B8R0.27 CC(=O)[C@@H](O)C(C)(C)C Amb27256659 [0,0,0,0,2,0|2,0,0]=4 566 B8R0.27 CC(C)(C)C(O)C(=O)O Amb19299856 [0,0,0,0,2,0|1,0,1]=4 567 B8R0.27 CC(C)(C)C(O)C(N)=O Amb27963620 [0,0,0,0,2,0|2,0,0]=4 568 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O Amb22225174 [0,0,0,0,2,0|1,0,1]=4 569 B8R0.27 CC(C)(C)[C@H](O)C(=O)O Amb10603129 [0,0,0,0,2,0|1,0,1]=4 570 B10R0.96 CC(C)CC(O)CCC(=O)O Amb18797782 [1,0,0,0,0,1|1,0,1]=4 571 B10R0.96 CC(C)CC(O)CNC(N)=O Amb27988588 [1,0,0,0,0,1|2,0,0]=4 572 B10R0.96 CC(C)OCC(O)CC(=O)O Amb33448479 [1,0,0,0,0,1|1,0,1]=4 573 B10R0.96 CC(C)OC[C@@H](O)CC(=O)O Amb33274503 [1,0,0,0,0,1|1,0,1]=4 574 B10R0.96 CC(C)OC[C@H](O)CC(=O)O Amb33274501 [1,0,0,0,0,1|1,0,1]=4 575 B10R0.96 CN(C)CCC(O)CC(=O)O Amb33272268 [1,0,0,0,0,1|0,0,2]=4 576 B10R0.96 CN(C)CC[C@@H](O)CC(=O)O Amb33272267 [1,0,0,0,0,1|0,0,2]=4 577 B10R0.96 CN(C)CC[C@H](O)CC(=O)O Amb33272266 [1,0,0,0,0,1|0,0,2]=4 578 B10R0.15 CC(=O)CCCOC(C)(C)C Amb9660029 [1,0,0,0,0,1|2,0,0]=4 579 B10R0.15 CC(C)(C)CCCCC(=O)O Amb17593968 [1,0,0,0,0,1|1,0,1]=4 580 B10R0.15 CC(C)(C)CCCNC(N)=O Amb27490770 [1,0,0,0,0,1|2,0,0]=4 581 B10R0.15 CC(C)(C)OCCCC(=O)O Amb9208481 [1,0,0,0,0,1|1,0,1]=4 582 B10R0.15 CC(C)(C)OCCC[N+](=O)[O-] Amb33326189 [1,0,0,0,0,1|2,0,0]=4 583 B10R0.15 CC(C)(C)SCCCC(=O)O Amb6680211 [1,0,0,0,0,1|1,0,1]=4 584 B10R0.15 C[N+](C)(C)CCCCC(=O)O Amb33735069 [1,0,0,0,0,1|0,0,1]=3 585 B12R0.66 CC(=O)C[C@@H](O)CC#C[Si](C)(C)C Amb27486586 [0,0,0,0,0,2|2,0,0]=4