0 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [0,0,0,0,0,0|1,0,2]=3 1 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [0,0,0,0,0,0|0,0,4]=4 4 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [0,0,0,0,0,0|0,0,4]=4 5 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [0,0,0,0,0,0|4,0,0]=4 6 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,0,0,0,0,0|4,0,0]=4 7 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,0,0,0,0,0|1,0,2]=3 8 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,0,0,0,0,0|1,0,2]=3 10 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,0,0,0,0,0|1,0,2]=3 11 B7R0.2 C=CC(O)CC(N)=O Amb25799663 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,0,0,0,0,0|1,0,2]=3 13 B7R0.2 C=CN(Br)CC(O)=O Amb24629979 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,0,0,0,0,0|1,0,2]=3 15 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,0,0,0,0,0|1,0,2]=3 16 B7R0.2 CC(=C)CC(N)CO Amb24665584 [0,0,0,0,0,0|4,0,0]=4 17 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [0,0,0,0,0,0|4,0,0]=4 18 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,0,0,0,0,0|4,0,0]=4 19 B7R0.2 CC(=CC(C)=O)NC Amb25850096 [0,0,0,0,0,0|2,0,2]=4 20 B7R0.2 CC(=CC(C)=O)OC Amb24583696 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.2 CC(=CC(N)=O)OC Amb25128053 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.2 CC(=CC(O)=O)C#C Amb25687994 [0,0,0,0,0,0|0,0,4]=4 23 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [0,0,0,0,0,0|1,0,3]=4 24 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,0,0,0,0,0|1,0,2]=3 25 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [0,0,0,0,0,0|2,0,2]=4 28 B7R0.2 CC(=O)CC(=C)CCl Amb25092223 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.2 CC(=O)CC(=N)CF Amb25087799 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [0,0,0,0,0,0|2,0,1]=3 34 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,0,0,0,0,0|3,0,1]=4 36 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [0,0,0,0,0,0|3,0,0]=3 37 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [0,0,0,0,0,0|2,0,2]=4 38 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [0,0,0,0,0,0|2,0,2]=4 39 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [0,0,0,0,0,0|3,0,1]=4 40 B7R0.2 CC(=O)CC(O)CO Amb25304727 [0,0,0,0,0,0|3,0,0]=3 41 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.2 CC(=O)CN(C)C=O Amb25134136 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [0,0,0,0,0,0|3,0,0]=3 44 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [0,0,0,0,0,0|2,0,2]=4 45 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [0,0,0,0,0,0|2,0,2]=4 47 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [0,0,0,0,0,0|2,0,2]=4 48 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [0,0,0,0,0,0|2,0,2]=4 49 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [0,0,0,0,0,0|3,0,1]=4 50 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [0,0,0,0,0,0|2,0,2]=4 51 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [0,0,0,0,0,0|3,0,1]=4 52 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.2 CC(=O)OC(Cl)CBr Amb25843189 [0,0,0,0,0,0|4,0,0]=4 54 B7R0.2 CC(=O)OC(Cl)CCl Amb22729073 [0,0,0,0,0,0|4,0,0]=4 55 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [0,0,0,0,0,0|2,0,2]=4 56 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [0,0,0,0,0,0|2,0,2]=4 58 B7R0.2 CC(C#C)NC(C)=O Amb24382534 [0,0,0,0,0,0|2,0,2]=4 59 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,0,0,0,0,0|1,0,1]=2 60 B7R0.2 CC(C#N)NC(=O)C Amb17399792 [0,0,0,0,0,0|3,0,1]=4 61 B7R0.2 CC(C#N)NC(N)=O Amb25290804 [0,0,0,0,0,0|3,0,1]=4 62 B7R0.2 CC(C#N)OC(=O)C Amb17593174 [0,0,0,0,0,0|3,0,1]=4 63 B7R0.2 CC(C#N)SC(N)=O Amb24746653 [0,0,0,0,0,0|3,0,1]=4 64 B7R0.2 CC(C)CC(Br)CC Amb24346666 [0,0,0,0,0,0|3,0,1]=4 65 B7R0.2 CC(C)CC(C)CBr Amb22641845 [0,0,0,0,0,0|3,0,1]=4 66 B7R0.2 CC(C)CC(C)CC Amb22228298 [0,0,0,0,0,0|2,0,1]=3 67 B7R0.2 CC(C)CC(C)CCl Amb25741744 [0,0,0,0,0,0|3,0,1]=4 68 B7R0.2 CC(C)CC(C)CO Amb22228341 [0,0,0,0,0,0|3,0,1]=4 69 B7R0.2 CC(C)CC(N)CC Amb18523780 [0,0,0,0,0,0|3,0,1]=4 70 B7R0.2 CC(C)C[C@@H](N)CC Amb24675860 [0,0,0,0,0,0|3,0,1]=4 71 B7R0.2 CC(C)C[C@@H](O)CC Amb25795362 [0,0,0,0,0,0|3,0,1]=4 72 B7R0.2 CC(C)N[C@@H](C)CC Amb24639587 [0,0,0,0,0,0|3,0,1]=4 73 B7R0.2 CC(C)SC(C)CC Amb24673493 [0,0,0,0,0,0|3,0,1]=4 74 B7R0.2 CC(C=C)OC(=O)Cl Amb24550333 [0,0,0,0,0,0|2,0,2]=4 75 B7R0.2 CC(C=O)NC(C)=O Amb18641830 [0,0,0,0,0,0|3,0,1]=4 76 B7R0.2 CC(C=O)OC(C)=O Amb18641863 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.2 CC(CB(Cl)Cl)CCl Amb24677659 [0,0,0,0,0,0|4,0,0]=4 78 B7R0.2 CC(CBr)=CC(=O)Cl Amb24519437 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [0,0,0,0,0,0|2,0,0]=2 80 B7R0.2 CC(CBr)CN(C)C Amb24726942 [0,0,0,0,0,0|4,0,0]=4 81 B7R0.2 CC(CBr)NC(C)=O Amb25223671 [0,0,0,0,0,0|3,0,0]=3 82 B7R0.2 CC(CBr)OC(N)=O Amb24368693 [0,0,0,0,0,0|3,0,0]=3 83 B7R0.2 CC(CC(=C)Br)C=O Amb24380828 [0,0,0,0,0,0|3,0,1]=4 84 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [0,0,0,0,0,0|1,0,2]=3 85 B7R0.2 CC(CC(C)=C)C=O Amb18641711 [0,0,0,0,0,0|3,0,1]=4 86 B7R0.2 CC(CC(C)=C)NN Amb25825816 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.2 CC(CC(C)=O)=CCl Amb25685302 [0,0,0,0,0,0|2,0,2]=4 88 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [0,0,0,0,0,0|2,0,1]=3 89 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [0,0,0,0,0,0|1,0,2]=3 90 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [0,0,0,0,0,0|2,0,1]=3 91 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [0,0,0,0,0,0|2,0,1]=3 92 B7R0.2 CC(CC(C)O)C#N Amb25361796 [0,0,0,0,0,0|2,0,2]=4 93 B7R0.2 CC(CC(C)O)OC Amb22757067 [0,0,0,0,0,0|2,0,1]=3 94 B7R0.2 CC(CC(Cl)Cl)CC Amb25725024 [0,0,0,0,0,0|2,0,1]=3 95 B7R0.2 CC(CC(F)F)CO Amb25738045 [0,0,0,0,0,0|3,0,1]=4 96 B7R0.2 CC(CC(F)F)NC Amb24476603 [0,0,0,0,0,0|3,0,1]=4 97 B7R0.2 CC(CC(N)=O)=CCl Amb25663357 [0,0,0,0,0,0|2,0,2]=4 98 B7R0.2 CC(CC(N)=O)CN Amb18641899 [0,0,0,0,0,0|2,0,0]=2 99 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [0,0,0,0,0,0|0,0,3]=3 100 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [0,0,0,0,0,0|1,0,2]=3 101 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,0,0,0,0,0|0,0,2]=2 102 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,0,0,0,0,0|1,0,1]=2 103 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,0,0,0,0,0|1,0,0]=1 104 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,0,0,0,0,0|2,0,0]=2 105 B7R0.2 CC(CC)=CC(N)=O Amb24640827 [0,0,0,0,0,0|1,0,2]=3 106 B7R0.2 CC(CC)CC(=N)N Amb10607625 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,0,0,0,0,0|1,0,0]=1 108 B7R0.2 CC(CC)OC(Cl)Cl Amb24483280 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.2 CC(CCl)C=C(Cl)Cl Amb25138772 [0,0,0,0,0,0|3,0,1]=4 110 B7R0.2 CC(CCl)C[NH+](C)C Amb22045172 [0,0,0,0,0,0|4,0,0]=4 111 B7R0.2 CC(CCl)N=C(C)Cl Amb24656115 [0,0,0,0,0,0|4,0,0]=4 112 B7R0.2 CC(CCl)NS(C)=O Amb24551851 [0,0,0,0,0,0|4,0,0]=4 113 B7R0.2 CC(CCl)OC(C)=O Amb24481416 [0,0,0,0,0,0|3,0,0]=3 114 B7R0.2 CC(CCl)OS(=O)Cl Amb25121727 [0,0,0,0,0,0|4,0,0]=4 115 B7R0.2 CC(CCl)\N=C(\C)/Cl Amb25189831 [0,0,0,0,0,0|4,0,0]=4 116 B7R0.2 CC(CF)NC(C)=O Amb25077726 [0,0,0,0,0,0|3,0,0]=3 117 B7R0.2 CC(CF)NC(N)=O Amb24354538 [0,0,0,0,0,0|3,0,0]=3 118 B7R0.2 CC(CN)CC(C)=O Amb18251072 [0,0,0,0,0,0|2,0,0]=2 119 B7R0.2 CC(CN)CC(C)O Amb19337142 [0,0,0,0,0,0|2,0,1]=3 120 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,0,0,0,0,0|1,0,0]=1 121 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,0,0,0,0,0|1,0,0]=1 122 B7R0.2 CC(CN)CP(O)=O Amb25757942 [0,0,0,0,0,0|2,0,0]=2 123 B7R0.2 CC(CN)NC(C)=O Amb18251073 [0,0,0,0,0,0|3,0,0]=3 124 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,0,0,0,0,0|3,0,0]=3 125 B7R0.2 CC(CN)NS(C)=O Amb25177123 [0,0,0,0,0,0|4,0,0]=4 126 B7R0.2 CC(CN)SC(C)=O Amb25255492 [0,0,0,0,0,0|3,0,0]=3 127 B7R0.2 CC(CN)SC(N)=N Amb24763725 [0,0,0,0,0,0|4,0,0]=4 128 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,0,0,0,0,0|1,0,2]=3 129 B7R0.2 CC(CO)CC(C)=O Amb24606485 [0,0,0,0,0,0|2,0,0]=2 130 B7R0.2 CC(CO)CC(N)=N Amb24579212 [0,0,0,0,0,0|3,0,0]=3 131 B7R0.2 CC(CO)CC(N)=O Amb24452895 [0,0,0,0,0,0|2,0,0]=2 132 B7R0.2 CC(CO)N=C(C)C Amb24699220 [0,0,0,0,0,0|4,0,0]=4 133 B7R0.2 CC(CO)NC(C)=S Amb24482996 [0,0,0,0,0,0|3,1,0]=4 134 B7R0.2 CC(CO)OC(C)=O Amb25144303 [0,0,0,0,0,0|3,0,0]=3 135 B7R0.2 CC(CO)OP(O)=O Amb24643413 [0,0,0,0,0,0|3,0,0]=3 136 B7R0.2 CC(CO)SC(N)=N Amb25119560 [0,0,0,0,0,0|4,0,0]=4 137 B7R0.2 CC(CO)\C=C(\C)/Br Amb25807120 [0,0,0,0,0,0|3,0,1]=4 138 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,0,0,0,0,0|1,0,2]=3 139 B7R0.2 CC(C[C@@H](C)N)OC Amb24690074 [0,0,0,0,0,0|3,0,1]=4 140 B7R0.2 CC(C[SiH](Cl)Cl)CCl Amb24440813 [0,0,0,0,0,0|3,1,0]=4 141 B7R0.2 CC(Cl)CC(O)CC Amb25053890 [0,0,0,0,0,0|3,0,1]=4 142 B7R0.2 CC(F)CC(O)CC Amb24675431 [0,0,0,0,0,0|3,0,1]=4 143 B7R0.2 CC(N)CC(C)CN Amb18641914 [0,0,0,0,0,0|3,0,1]=4 144 B7R0.2 CC(NC(=O)N)CC Amb1105272 [0,0,0,0,0,0|2,0,0]=2 145 B7R0.2 CC(NC)CC(=O)N Amb17231826 [0,0,0,0,0,0|2,0,0]=2 146 B7R0.2 CC(NC)CC(=S)N Amb17231886 [0,0,0,0,0,0|2,1,0]=3 147 B7R0.2 CC(O)CC(C)CO Amb25262806 [0,0,0,0,0,0|2,0,1]=3 148 B7R0.2 CC(O)CC(N)CI Amb25197705 [0,0,0,0,0,0|3,0,1]=4 149 B7R0.2 CC(O)CC(N)CO Amb25828018 [0,0,0,0,0,0|3,0,1]=4 150 B7R0.2 CC(O)CC(O)CCl Amb24663123 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,0,0,0,0,0|0,0,2]=2 152 B7R0.2 CCC(=O)CC(C)O Amb25113617 [0,0,0,0,0,0|2,0,2]=4 153 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,0,0,0,0,0|1,0,1]=2 154 B7R0.2 CCC(=O)C[C@H](C)O Amb25746635 [0,0,0,0,0,0|2,0,2]=4 155 B7R0.2 CCC(=O)C[N+]([O-])=O Amb21857551 [0,0,0,0,0,0|2,0,2]=4 156 B7R0.2 CCC(Br)C=C(Cl)Cl Amb25690742 [0,0,0,0,0,0|3,0,1]=4 157 B7R0.2 CCC(Br)CC(C)=C Amb24355903 [0,0,0,0,0,0|3,0,0]=3 158 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,0,0,0,0,0|1,0,0]=1 159 B7R0.2 CCC(C)C=C(Br)Br Amb24744207 [0,0,0,0,0,0|2,0,1]=3 160 B7R0.2 CCC(C)C=C(Cl)Cl Amb24559351 [0,0,0,0,0,0|2,0,1]=3 161 B7R0.2 CCC(C)CC(C)=C Amb22228340 [0,0,0,0,0,0|2,0,0]=2 162 B7R0.2 CCC(C)CC(C)Br Amb24757470 [0,0,0,0,0,0|2,0,1]=3 163 B7R0.2 CCC(C)CC(N)=N Amb19890168 [0,0,0,0,0,0|2,0,0]=2 164 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,0,0,0,0,0|1,0,0]=1 165 B7R0.2 CCC(C)CN(C)C Amb25851027 [0,0,0,0,0,0|3,0,0]=3 166 B7R0.2 CCC(C)C[N+]([O-])=O Amb25075983 [0,0,0,0,0,0|1,0,1]=2 167 B7R0.2 CCC(C)NC(C)=N Amb25081674 [0,0,0,0,0,0|3,0,0]=3 168 B7R0.2 CCC(C)NC(C)=S Amb24332642 [0,0,0,0,0,0|2,1,0]=3 169 B7R0.2 CCC(C)NC(N)=N Amb24531881 [0,0,0,0,0,0|3,0,0]=3 170 B7R0.2 CCC(C)NC(O)=S Amb25368326 [0,0,0,0,0,0|1,1,0]=2 171 B7R0.2 CCC(C)NC(S)=S Amb24382369 [0,0,0,0,0,0|1,2,0]=3 172 B7R0.2 CCC(C)NN(C)C Amb24739104 [0,0,0,0,0,0|4,0,0]=4 173 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,0,0,0,0,0|2,0,0]=2 174 B7R0.2 CCC(C)OC(N)=N Amb24563563 [0,0,0,0,0,0|3,0,0]=3 175 B7R0.2 CCC(C)O[N+]([O-])=O Amb25088971 [0,0,0,0,0,0|2,0,1]=3 176 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,0,0,0,0,0|2,0,0]=2 177 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,0,0,0,0,0|1,0,0]=1 178 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,0,0,0,0,0|1,0,0]=1 179 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,0,0,0,0,0|1,0,0]=1 180 B7R0.2 CCC(CC(N)C)C Amb10069423 [0,0,0,0,0,0|2,0,1]=3 181 B7R0.2 CCC(Cl)C=C(C)C Amb25295453 [0,0,0,0,0,0|3,0,1]=4 182 B7R0.2 CCC(Cl)C=C(Cl)Cl Amb24711397 [0,0,0,0,0,0|3,0,1]=4 183 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [0,0,0,0,0,0|2,0,0]=2 184 B7R0.2 CCC(Cl)CC(C)=C Amb24735482 [0,0,0,0,0,0|3,0,0]=3 185 B7R0.2 CCC(Cl)CC(Cl)Cl Amb25258037 [0,0,0,0,0,0|3,0,1]=4 186 B7R0.2 CCC(Cl)CN(C)C Amb25328843 [0,0,0,0,0,0|4,0,0]=4 187 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [0,0,0,0,0,0|3,0,0]=3 188 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,0,0,0,0,0|1,0,2]=3 189 B7R0.2 CCC(N)CC(C)=C Amb24367516 [0,0,0,0,0,0|3,0,0]=3 190 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,0,0,0,0,0|2,0,0]=2 191 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,0,0,0,0,0|2,0,0]=2 192 B7R0.2 CCC(N)CS(C)=O Amb24481377 [0,0,0,0,0,0|3,0,0]=3 193 B7R0.2 CCC(N)NC(C)=O Amb25062531 [0,0,0,0,0,0|3,0,0]=3 194 B7R0.2 CCC(N)NC(N)=N Amb25275524 [0,0,0,0,0,0|4,0,0]=4 195 B7R0.2 CCC(O)C=C(C)C Amb25340896 [0,0,0,0,0,0|3,0,1]=4 196 B7R0.2 CCC(O)CC(C)=C Amb24062975 [0,0,0,0,0,0|3,0,0]=3 197 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,0,0,0,0,0|2,0,0]=2 198 B7R0.2 CCC(O)CC(N)=O Amb24616660 [0,0,0,0,0,0|2,0,0]=2 199 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,0,0,0,0,0|1,0,0]=1 200 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [0,0,0,0,0,0|2,0,1]=3 201 B7R0.2 CCC(O)SC(C)=S Amb25332463 [0,0,0,0,0,0|3,1,0]=4 202 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,0,0,0,0,0|1,0,0]=1 203 B7R0.2 CCN(C)CC(=C)Br Amb25333139 [0,0,0,0,0,0|3,0,0]=3 204 B7R0.2 CCN(C)CC(C)Cl Amb25791823 [0,0,0,0,0,0|3,0,1]=4 205 B7R0.2 CCN(C)CC(N)N Amb24483053 [0,0,0,0,0,0|3,0,1]=4 206 B7R0.2 CCN(C)C[C@@H](C)N Amb25236654 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.2 CCN(C)C[C@H](C)N Amb25189934 [0,0,0,0,0,0|3,0,1]=4 208 B7R0.2 CCN(C)NC(C)=O Amb24675229 [0,0,0,0,0,0|3,0,0]=3 209 B7R0.2 CCN(CC(O)C)C Amb17334070 [0,0,0,0,0,0|2,0,1]=3 210 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,0,0,0,0,0|2,0,0]=2 211 B7R0.2 CCS(=O)CC(=C)Cl Amb25052718 [0,0,0,0,0,0|4,0,0]=4 212 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,0,0|2,0,0]=2 213 B7R0.2 CCS(=O)CC(C)O Amb25687853 [0,0,0,0,0,0|3,0,1]=4 214 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,0,0,0,0,0|1,0,0]=1 215 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,0,0,0,0,0|1,0,0]=1 216 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,0,0,0,0,0|1,0,0]=1 217 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [0,0,0,0,0,0|2,0,0]=2 218 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,0,0,0,0,0|1,0,0]=1 219 B7R0.2 CC[C@@H](N)CN(C)C Amb22587558 [0,0,0,0,0,0|4,0,0]=4 220 B7R0.2 CC[C@@H](O)C=C(C)C Amb24475081 [0,0,0,0,0,0|3,0,1]=4 221 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [0,0,0,0,0,0|3,0,0]=3 222 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,0,0,0,0,0|2,0,0]=2 223 B7R0.2 CC[C@@H](O)CN(C)C Amb24446828 [0,0,0,0,0,0|4,0,0]=4 224 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,0,0,0,0,0|1,0,0]=1 225 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,0,0,0,0,0|1,0,0]=1 226 B7R0.2 CC[C@H](C)CC(C)N Amb25062813 [0,0,0,0,0,0|2,0,1]=3 227 B7R0.2 CC[C@H](C)CC(N)=N Amb24409491 [0,0,0,0,0,0|2,0,0]=2 228 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [0,0,0,0,0,0|2,0,0]=2 229 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,0,0,0,0,0|1,0,0]=1 230 B7R0.2 CC[C@H](N)CN(C)C Amb22587381 [0,0,0,0,0,0|4,0,0]=4 231 B7R0.2 CC[C@H](N)CN(C)C Amb23385277 [0,0,0,0,0,0|4,0,0]=4 232 B7R0.2 CC[C@H](O)CN(C)C Amb25749217 [0,0,0,0,0,0|4,0,0]=4 233 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [0,0,0,0,0,0|2,0,1]=3 234 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,0,0,0,0,0|1,0,0]=1 235 B7R0.2 CC\C(\N)=C/C(N)=O Amb24624408 [0,0,0,0,0,0|2,0,2]=4 236 B7R0.2 CN(CC(N)=O)C#N Amb24457322 [0,0,0,0,0,0|3,0,1]=4 237 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [0,0,0,0,0,0|2,0,1]=3 238 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [0,0,0,0,0,0|2,0,1]=3 239 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,0,0,0,0,0|3,0,1]=4 240 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,0,0,0,0,0|2,0,0]=2 241 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,0,0,0,0,0|1,0,0]=1 242 B7R0.2 CNC(C)CN(C)C Amb18982416 [0,0,0,0,0,0|4,0,0]=4 243 B7R0.2 CNC(C)CS(C)=O Amb24410768 [0,0,0,0,0,0|3,0,0]=3 244 B7R0.2 CNC(C)C[N+]([O-])=O Amb25297025 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.2 CNC(CC(C)C)C Amb1119789 [0,0,0,0,0,0|3,0,1]=4 246 B7R0.2 CNN(C)CC(C)O Amb25681467 [0,0,0,0,0,0|3,0,1]=4 247 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,0,0,0,0,0|1,0,0]=1 248 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,0,0,0,0,0|1,0,0]=1 249 B7R0.2 CN\C(=C/C(=O)C)\C Amb15691784 [0,0,0,0,0,0|2,0,2]=4 250 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,0,0,0,0,0|2,0,1]=3 251 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.2 COC(C)CC(N)=S Amb25782261 [0,0,0,0,0,0|2,1,0]=3 253 B7R0.2 COC(C)CN(C)C Amb25686456 [0,0,0,0,0,0|4,0,0]=4 254 B7R0.2 COC(C)CS([O-])=O Amb25690482 [0,0,0,0,0,0|2,0,1]=3 255 B7R0.2 CON(C)CC(=C)Cl Amb24409735 [0,0,0,0,0,0|4,0,0]=4 256 B7R0.2 CON(C)CC(C)=C Amb25198060 [0,0,0,0,0,0|4,0,0]=4 257 B7R0.2 CON(C)CC(C)O Amb25285671 [0,0,0,0,0,0|3,0,1]=4 258 B7R0.2 CON(C)CC(N)=O Amb24447118 [0,0,0,0,0,0|3,0,0]=3 259 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,0,0,0,0,0|1,0,0]=1 260 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [0,0,0,0,0,0|3,0,0]=3 261 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,0,0,0,0,0|4,0,0]=4 262 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [0,0,0,0,0,0|4,0,0]=4 263 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [0,0,0,0,0,0|4,0,0]=4 264 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [0,0,0,0,0,0|4,0,0]=4 265 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,0,0,0,0,0|2,0,0]=2 266 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,0,0,0,0,0|1,0,0]=1 267 B7R0.2 C[C@@H](C#N)NC(C)=O Amb25142287 [0,0,0,0,0,0|3,0,1]=4 268 B7R0.2 C[C@@H](C=C)NC(C)=O Amb25084335 [0,0,0,0,0,0|2,0,2]=4 269 B7R0.2 C[C@@H](C=O)OC(C)=O Amb24724866 [0,0,0,0,0,0|3,0,1]=4 270 B7R0.2 C[C@@H](CC(=C)Br)C=O Amb25325003 [0,0,0,0,0,0|3,0,1]=4 271 B7R0.2 C[C@@H](CC(C)=C)C=O Amb24375353 [0,0,0,0,0,0|3,0,1]=4 272 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [0,0,0,0,0,0|1,0,2]=3 273 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [0,0,0,0,0,0|2,0,1]=3 274 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,0,0,0,0,0|2,0,0]=2 275 B7R0.2 C[C@@H](CCl)OC(C)=O Amb24419691 [0,0,0,0,0,0|3,0,0]=3 276 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [0,0,0,0,0,0|3,0,0]=3 277 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [0,0,0,0,0,0|2,0,0]=2 278 B7R0.2 C[C@@H](CO)N=C(C)C Amb25343868 [0,0,0,0,0,0|4,0,0]=4 279 B7R0.2 C[C@@H](CO)NC(N)=N Amb24724774 [0,0,0,0,0,0|4,0,0]=4 280 B7R0.2 C[C@@H](CO)NC(N)=O Amb25315937 [0,0,0,0,0,0|3,0,0]=3 281 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [0,0,0,0,0,0|3,0,0]=3 282 B7R0.2 C[C@@H](C[C@@H](C)Cl)OC Amb25690472 [0,0,0,0,0,0|3,0,1]=4 283 B7R0.2 C[C@@H](C[C@@H](C)O)NC Amb24505242 [0,0,0,0,0,0|2,0,1]=3 284 B7R0.2 C[C@@H](C[C@H](C)O)C=C Amb25763927 [0,0,0,0,0,0|1,0,3]=4 285 B7R0.2 C[C@@H](C[C@H](C)O)NC Amb25324434 [0,0,0,0,0,0|2,0,1]=3 286 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [0,0,0,0,0,0|2,0,1]=3 287 B7R0.2 C[C@H](C#N)NC(C)=O Amb24481316 [0,0,0,0,0,0|3,0,1]=4 288 B7R0.2 C[C@H](CBr)NC(C)=O Amb24690410 [0,0,0,0,0,0|3,0,0]=3 289 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,0,0,0,0,0|0,0,2]=2 290 B7R0.2 C[C@H](CO)C=C(C)C Amb25850751 [0,0,0,0,0,0|3,0,1]=4 291 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [0,0,0,0,0,0|3,0,0]=3 292 B7R0.2 C[C@H](CO)NC(C)=S Amb24746025 [0,0,0,0,0,0|3,1,0]=4 293 B7R0.2 C[C@H](CO)NC(N)=O Amb24682644 [0,0,0,0,0,0|3,0,0]=3 294 B7R0.2 C[C@H](CO)\C=C(\C)/Br Amb25682034 [0,0,0,0,0,0|3,0,1]=4 295 B7R0.2 C[C@H](C[C@H](C)Cl)OC Amb24634248 [0,0,0,0,0,0|3,0,1]=4 296 B7R0.2 C[C@H](C[C@H](C)O)C#N Amb25135337 [0,0,0,0,0,0|2,0,2]=4 297 B7R0.2 C[C@H](C[C@H](C)O)OC Amb24733201 [0,0,0,0,0,0|2,0,1]=3 298 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [0,0,0,0,0,0|2,0,1]=3 299 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [0,0,0,0,0,0|3,0,1]=4 300 B7R0.2 C[C@H](S)C[C@@H](O)CC Amb25237174 [0,0,0,0,0,0|2,1,1]=4 301 B7R0.2 C\C(=C/C(C)=O)\OC Amb24332557 [0,0,0,0,0,0|2,0,2]=4 302 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [0,0,0,0,0,0|1,0,3]=4 303 B7R0.2 C\C(=C\C(=C)O)\OC Amb24481460 [0,0,0,0,0,0|2,0,2]=4 304 B7R0.2 C\C(=C\C(O)=O)\C=C Amb18641686 [0,0,0,0,0,0|0,0,4]=4 305 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [0,0,0,0,0,0|1,0,3]=4 306 B7R0.2 C\C(=C\C)\NC(C)=O Amb24468210 [0,0,0,0,0,0|2,0,2]=4 307 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,0,0,0,0,0|1,0,2]=3 308 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [0,0,0,0,0,0|2,0,1]=3 309 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [0,0,0,0,0,0|2,0,1]=3 310 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [0,0,0,0,0,0|3,0,1]=4 311 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [0,0,0,0,0,0|1,0,2]=3 312 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,0,0,0,0,0|0,0,2]=2 313 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,0,0,0,0,0|2,0,1]=3 314 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,0,0,0,0,0|0,0,2]=2 315 B7R0.2 C\C(\CCl)=C\C(C)=O Amb25340485 [0,0,0,0,0,0|2,0,2]=4 316 B7R0.2 C\C(\CN)=C\C(C)=O Amb20621518 [0,0,0,0,0,0|2,0,2]=4 317 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,0,0,0,0,0|2,0,2]=4 318 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,0,0,0,0,0|1,0,2]=3 319 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,0,0,0,0,0|2,0,2]=4 320 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,0,0,0,0,0|1,0,2]=3 321 B7R0.2 C\[N+](\CC(N)=O)=N\[O-] Amb25131183 [0,0,0,0,0,0|4,0,0]=4 322 B7R0.2 ClCC(=O)CC(=O)Cl Amb17593874 [0,0,0,0,0,0|3,0,1]=4 323 B7R0.2 NC(=N)C[C@@H](O)CCl Amb24387966 [0,0,0,0,0,0|4,0,0]=4 324 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,0,0,0,0,0|3,0,0]=3 325 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [0,0,0,0,0,0|3,0,0]=3 326 B7R0.2 NC(CC(N)=O)C#N Amb24122907 [0,0,0,0,0,0|3,0,1]=4 327 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [0,0,0,0,0,0|3,0,1]=4 328 B7R0.2 NC(CF)CC(O)=O Amb24428065 [0,0,0,0,0,0|2,0,0]=2 329 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,0,0,0,0,0|2,0,2]=4 330 B7R0.2 NC(CO)CC(N)=O Amb24384089 [0,0,0,0,0,0|3,0,0]=3 331 B7R0.2 NC(CS)CC(O)=O Amb25090412 [0,0,0,0,0,0|2,0,0]=2 332 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,0,0,0,0,0|2,0,2]=4 333 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,0,0,0,0,0|2,0,2]=4 334 B7R0.2 NCC(F)CC(O)=O Amb24550169 [0,0,0,0,0,0|2,0,0]=2 335 B7R0.2 NCC(N)CC(O)=O Amb19515145 [0,0,0,0,0,0|2,0,0]=2 336 B7R0.2 NCC(N)CC(O)=O Amb21858324 [0,0,0,0,0,0|2,0,0]=2 337 B7R0.2 NCC(N)CC(O)=O Amb22751661 [0,0,0,0,0,0|2,0,0]=2 338 B7R0.2 NCC(O)CC(N)=O Amb18641952 [0,0,0,0,0,0|3,0,0]=3 339 B7R0.2 NCC(O)CP(=O)=O Amb24648320 [0,0,0,0,0,0|3,0,1]=4 340 B7R0.2 NCC(O)CP(O)=O Amb24714285 [0,0,0,0,0,0|3,0,0]=3 341 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [0,0,0,0,0,0|3,0,0]=3 342 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [0,0,0,0,0,0|2,0,0]=2 343 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [0,0,0,0,0,0|2,0,0]=2 344 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [0,0,0,0,0,0|2,0,0]=2 345 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [0,0,0,0,0,0|3,0,0]=3 346 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [0,0,0,0,0,0|2,0,0]=2 347 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [0,0,0,0,0,0|3,0,0]=3 348 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,0,0,0,0,0|2,0,2]=4 349 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,0,0,0,0,0|3,0,1]=4 350 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [0,0,0,0,0,0|3,0,1]=4 351 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [0,0,0,0,0,0|2,0,1]=3 352 B7R0.2 N[C@@H](CC([O-])=O)C=O Amb22800169 [0,0,0,0,0,0|2,0,2]=4 353 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [0,0,0,0,0,0|3,0,0]=3 354 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,0,0,0,0,0|2,0,1]=3 355 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [0,0,0,0,0,0|2,0,0]=2 356 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [0,0,0,0,0,0|3,0,0]=3 357 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,0,0,0,0,0|3,0,1]=4 358 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [0,0,0,0,0,0|3,0,0]=3 359 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [0,0,0,0,0,0|3,0,0]=3 360 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,0,0,0,0,0|2,0,1]=3 361 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,0,0,0,0,0|3,0,1]=4 362 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [0,0,0,0,0,0|2,0,0]=2 363 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [0,0,0,0,0,0|2,0,0]=2 364 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,0,0,0,0,0|2,0,1]=3 365 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [0,0,0,0,0,0|3,0,1]=4 366 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [0,0,0,0,0,0|4,0,0]=4 367 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,0,0,0,0,0|2,0,2]=4 368 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,0,0,0,0,0|2,0,2]=4 369 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [0,0,0,0,0,0|3,0,0]=3 370 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [0,0,0,0,0,0|2,0,0]=2 371 B7R0.2 OCC(O)CP(O)=O Amb25316128 [0,0,0,0,0,0|3,0,0]=3 372 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [0,0,0,0,0,0|2,0,0]=2 373 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [0,0,0,0,0,0|2,0,0]=2 374 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [0,0,0,0,0,0|2,0,0]=2 375 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [0,0,0,0,0,0|2,0,2]=4 376 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [0,0,0,0,0,0|2,0,1]=3 377 B7R0.2 [O-][N+](=O)CC(Cl)CCl Amb22347684 [0,0,0,0,0,0|3,0,1]=4 378 B6R0.1 C=CC(Cl)CC=O Amb24595013 [1,0,0,0,0,0|1,0,2]=4 379 B6R0.1 C=CCC(Br)CO Amb24399232 [1,0,0,0,0,0|3,0,0]=4 380 B6R0.1 C=CCC(Cl)CO Amb25807468 [1,0,0,0,0,0|3,0,0]=4 381 B6R0.1 C=CCC(N)CF Amb25183816 [1,0,0,0,0,0|3,0,0]=4 382 B6R0.1 C=CCC(N)CN Amb24479839 [1,0,0,0,0,0|3,0,0]=4 383 B6R0.1 C=CCC(N)CO Amb24745656 [1,0,0,0,0,0|3,0,0]=4 384 B6R0.1 C=CCC(O)CBr Amb24478446 [1,0,0,0,0,0|3,0,0]=4 385 B6R0.1 C=CCC(O)CF Amb25345890 [1,0,0,0,0,0|3,0,0]=4 386 B6R0.1 C=CCC(O)CI Amb25746456 [1,0,0,0,0,0|3,0,0]=4 387 B6R0.1 C=CCC(O)CN Amb22304831 [1,0,0,0,0,0|3,0,0]=4 388 B6R0.1 C=CC[C@@H](N)CO Amb24088744 [1,0,0,0,0,0|3,0,0]=4 389 B6R0.1 C=CC[C@@H](O)CCl Amb22736714 [1,0,0,0,0,0|3,0,0]=4 390 B6R0.1 C=CC[C@@H](O)CI Amb24419791 [1,0,0,0,0,0|3,0,0]=4 391 B6R0.1 C=CC[C@H](Br)CO Amb24479036 [1,0,0,0,0,0|3,0,0]=4 392 B6R0.1 C=CC[C@H](N)CO Amb24088875 [1,0,0,0,0,0|3,0,0]=4 393 B6R0.1 C=CC[C@H](N)CO Amb25732908 [1,0,0,0,0,0|3,0,0]=4 394 B6R0.1 C=CC[C@H](O)CCl Amb22736707 [1,0,0,0,0,0|3,0,0]=4 395 B6R0.1 CC#CC(C)CC Amb22229803 [1,0,0,0,0,0|1,0,2]=4 396 B6R0.1 CC(C#C)NC=O Amb25366975 [1,0,0,0,0,0|1,0,2]=4 397 B6R0.1 CC(C#N)NC=O Amb18120801 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.1 CC(CBr)CC#N Amb18126303 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.1 CC(CBr)CC=C Amb24740775 [1,0,0,0,0,0|2,0,0]=3 400 B6R0.1 CC(CBr)CC=O Amb18126382 [1,0,0,0,0,0|1,0,0]=2 401 B6R0.1 CC(CBr)NC=O Amb25363197 [1,0,0,0,0,0|2,0,0]=3 402 B6R0.1 CC(CC)NCC Amb19959917 [1,0,0,0,0,0|2,0,1]=4 403 B6R0.1 CC(CC)SCC Amb22230692 [1,0,0,0,0,0|2,0,1]=4 404 B6R0.1 CC(CC)\C=C\Cl Amb24334568 [1,0,0,0,0,0|1,0,1]=3 405 B6R0.1 CC(CC=C)C=C Amb25705690 [1,0,0,0,0,0|1,0,2]=4 406 B6R0.1 CC(CC=C)NN Amb25351147 [1,0,0,0,0,0|3,0,0]=4 407 B6R0.1 CC(CC=O)=C=C Amb24434894 [1,0,0,0,0,0|0,0,3]=4 408 B6R0.1 CC(CC=O)C#N Amb18638919 [1,0,0,0,0,0|1,0,1]=3 409 B6R0.1 CC(CC=O)C=C Amb18120863 [1,0,0,0,0,0|0,0,2]=3 410 B6R0.1 CC(CC=O)C=O Amb18121376 [1,0,0,0,0,0|1,0,1]=3 411 B6R0.1 CC(CCCl)CCl Amb24479659 [1,0,0,0,0,0|2,0,1]=4 412 B6R0.1 CC(CCI)CI Amb25777394 [1,0,0,0,0,0|2,0,1]=4 413 B6R0.1 CC(CCN)CN Amb21955767 [1,0,0,0,0,0|2,0,1]=4 414 B6R0.1 CC(CCO)C#C Amb25762142 [1,0,0,0,0,0|0,0,3]=4 415 B6R0.1 CC(CCO)C=C Amb22229374 [1,0,0,0,0,0|0,0,3]=4 416 B6R0.1 CC(CCO)C=C Amb22641463 [1,0,0,0,0,0|0,0,3]=4 417 B6R0.1 CC(CCl)CC#N Amb25735504 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.1 CC(CCl)CC=O Amb24332851 [1,0,0,0,0,0|1,0,0]=2 419 B6R0.1 CC(CCl)CCN Amb24436514 [1,0,0,0,0,0|2,0,1]=4 420 B6R0.1 CC(CCl)N=C=O Amb25314842 [1,0,0,0,0,0|2,0,1]=4 421 B6R0.1 CC(CCl)\C=C\Cl Amb24472920 [1,0,0,0,0,0|2,0,1]=4 422 B6R0.1 CC(CF)CC#N Amb24742643 [1,0,0,0,0,0|2,0,1]=4 423 B6R0.1 CC(CF)CCO Amb24332497 [1,0,0,0,0,0|1,0,1]=3 424 B6R0.1 CC(CN)CC=C Amb18121275 [1,0,0,0,0,0|2,0,0]=3 425 B6R0.1 CC(CN)CCBr Amb25353643 [1,0,0,0,0,0|2,0,1]=4 426 B6R0.1 CC(CN)CCCl Amb24599413 [1,0,0,0,0,0|2,0,1]=4 427 B6R0.1 CC(CN)CCF Amb24539384 [1,0,0,0,0,0|2,0,1]=4 428 B6R0.1 CC(CN)CNO Amb25235896 [1,0,0,0,0,0|2,0,0]=3 429 B6R0.1 CC(CNN)CN Amb24673236 [1,0,0,0,0,0|3,0,0]=4 430 B6R0.1 CC(CO)CC#C Amb24406137 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.1 CC(CO)CC#N Amb24691578 [1,0,0,0,0,0|2,0,1]=4 432 B6R0.1 CC(CO)CC=C Amb17593084 [1,0,0,0,0,0|2,0,0]=3 433 B6R0.1 CC(CO)CC=O Amb18639949 [1,0,0,0,0,0|1,0,0]=2 434 B6R0.1 CC(CO)CCCl Amb24568555 [1,0,0,0,0,0|2,0,1]=4 435 B6R0.1 CC(CO)CNC Amb17569890 [1,0,0,0,0,0|3,0,0]=4 436 B6R0.1 CC(CO)CON Amb25746199 [1,0,0,0,0,0|3,0,0]=4 437 B6R0.1 CC(CO)NC=O Amb25330301 [1,0,0,0,0,0|2,0,0]=3 438 B6R0.1 CC(CO)OC=O Amb25026452 [1,0,0,0,0,0|2,0,0]=3 439 B6R0.1 CC(CO)OCO Amb24332099 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.1 CC(CON)CN Amb24479834 [1,0,0,0,0,0|3,0,0]=4 441 B6R0.1 CC(OC)CC=O Amb17593089 [1,0,0,0,0,0|1,0,0]=2 442 B6R0.1 CC(OC)CCN Amb13952649 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.1 CC(SC)CCN Amb13952574 [1,0,0,0,0,0|2,0,1]=4 444 B6R0.1 CC(\C=C\O)C#C Amb25686428 [1,0,0,0,0,0|0,0,3]=4 445 B6R0.1 CC=C(C)CCO Amb22229371 [1,0,0,0,0,0|0,0,3]=4 446 B6R0.1 CC=CC(O)CC Amb22228839 [1,0,0,0,0,0|2,0,1]=4 447 B6R0.1 CC=NC(C)CO Amb24332341 [1,0,0,0,0,0|3,0,0]=4 448 B6R0.1 CC=N[C@@H](C)CO Amb24507477 [1,0,0,0,0,0|3,0,0]=4 449 B6R0.1 CCC(=C)CC=O Amb24445213 [1,0,0,0,0,0|0,0,2]=3 450 B6R0.1 CCC(=C)CCO Amb25261191 [1,0,0,0,0,0|0,0,3]=4 451 B6R0.1 CCC(=O)CC=O Amb24333311 [1,0,0,0,0,0|1,0,1]=3 452 B6R0.1 CCC(=O)NC=O Amb24480668 [1,0,0,0,0,0|2,0,1]=4 453 B6R0.1 CCC(=O)\C=C\O Amb25326651 [1,0,0,0,0,0|1,0,2]=4 454 B6R0.1 CCC(Br)CC=C Amb24528531 [1,0,0,0,0,0|2,0,0]=3 455 B6R0.1 CCC(Br)CCBr Amb23571816 [1,0,0,0,0,0|2,0,1]=4 456 B6R0.1 CCC(Br)COC Amb18182635 [1,0,0,0,0,0|3,0,0]=4 457 B6R0.1 CCC(C)=C=CCl Amb25186956 [1,0,0,0,0,0|1,0,2]=4 458 B6R0.1 CCC(C)C=NO Amb24443378 [1,0,0,0,0,0|1,0,1]=3 459 B6R0.1 CCC(C)CC#C Amb22229837 [1,0,0,0,0,0|1,0,1]=3 460 B6R0.1 CCC(C)CC#N Amb24117251 [1,0,0,0,0,0|1,0,1]=3 461 B6R0.1 CCC(C)CCBr Amb22641836 [1,0,0,0,0,0|1,0,1]=3 462 B6R0.1 CCC(C)CCC Amb22229359 [1,0,0,0,0,0|1,0,1]=3 463 B6R0.1 CCC(C)CCCl Amb24478904 [1,0,0,0,0,0|1,0,1]=3 464 B6R0.1 CCC(C)CCS Amb24657421 [1,0,0,0,0,0|0,1,1]=3 465 B6R0.1 CCC(C)CNC Amb19271598 [1,0,0,0,0,0|2,0,0]=3 466 B6R0.1 CCC(C)CON Amb25316087 [1,0,0,0,0,0|2,0,0]=3 467 B6R0.1 CCC(C)C[Mg]Br Amb22897327 [1,0,0,0,0,0|2,0,0]=3 468 B6R0.1 CCC(C)C[Zn]Br Amb22897702 [1,0,0,0,0,0|2,0,0]=3 469 B6R0.1 CCC(C)N=[N+]=[N-] Amb24575988 [1,0,0,0,0,0|3,0,0]=4 470 B6R0.1 CCC(C)NC#N Amb24332115 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.1 CCC(C)NC=S Amb24659847 [1,0,0,0,0,0|1,1,0]=3 472 B6R0.1 CCC(C)NOC Amb20668189 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.1 CCC(C)NOC Amb22059586 [1,0,0,0,0,0|3,0,0]=4 474 B6R0.1 CCC(C)OC=O Amb22734039 [1,0,0,0,0,0|1,0,0]=2 475 B6R0.1 CCC(C)OCCl Amb24706267 [1,0,0,0,0,0|2,0,1]=4 476 B6R0.1 CCC(C)SC=C Amb25745483 [1,0,0,0,0,0|2,0,0]=3 477 B6R0.1 CCC(C)SCCl Amb24560217 [1,0,0,0,0,0|2,0,1]=4 478 B6R0.1 CCC(Cl)=CC=O Amb25224351 [1,0,0,0,0,0|1,0,2]=4 479 B6R0.1 CCC(Cl)CC#C Amb24362836 [1,0,0,0,0,0|2,0,1]=4 480 B6R0.1 CCC(Cl)CCBr Amb25138737 [1,0,0,0,0,0|2,0,1]=4 481 B6R0.1 CCC(Cl)CCC Amb22229268 [1,0,0,0,0,0|2,0,1]=4 482 B6R0.1 CCC(Cl)COC Amb25341989 [1,0,0,0,0,0|3,0,0]=4 483 B6R0.1 CCC(F)CCC Amb24657166 [1,0,0,0,0,0|2,0,1]=4 484 B6R0.1 CCC(F)CCN Amb24524247 [1,0,0,0,0,0|2,0,1]=4 485 B6R0.1 CCC(F)CNN Amb25124283 [1,0,0,0,0,0|3,0,0]=4 486 B6R0.1 CCC(I)CCC Amb22733970 [1,0,0,0,0,0|2,0,1]=4 487 B6R0.1 CCC(I)CCO Amb24574041 [1,0,0,0,0,0|1,0,1]=3 488 B6R0.1 CCC(N)CC#C Amb18959775 [1,0,0,0,0,0|2,0,1]=4 489 B6R0.1 CCC(N)CC=C Amb18977592 [1,0,0,0,0,0|2,0,0]=3 490 B6R0.1 CCC(N)CC=C Amb22831631 [1,0,0,0,0,0|2,0,0]=3 491 B6R0.1 CCC(N)CCBr Amb25811771 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.1 CCC(N)CCO Amb18833133 [1,0,0,0,0,0|1,0,1]=3 493 B6R0.1 CCC(N)CCS Amb25129592 [1,0,0,0,0,0|1,1,1]=4 494 B6R0.1 CCC(N)CNC Amb18290359 [1,0,0,0,0,0|3,0,0]=4 495 B6R0.1 CCC(N)CON Amb25122953 [1,0,0,0,0,0|3,0,0]=4 496 B6R0.1 CCC(N)OC=C Amb24479833 [1,0,0,0,0,0|3,0,0]=4 497 B6R0.1 CCC(O)CC#C Amb17940344 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.1 CCC(O)CC=C Amb22734219 [1,0,0,0,0,0|2,0,0]=3 499 B6R0.1 CCC(O)CCBr Amb24373747 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.1 CCC(O)CCCl Amb24392780 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.1 CCC(O)CNC Amb18969632 [1,0,0,0,0,0|3,0,0]=4 502 B6R0.1 CCC(O)CON Amb25173821 [1,0,0,0,0,0|3,0,0]=4 503 B6R0.1 CCC(O)CSC Amb25708287 [1,0,0,0,0,0|3,0,0]=4 504 B6R0.1 CCC(O)\C=C\I Amb25258606 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.1 CCC(S)CCC Amb24507410 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.1 CCCC(C)CBr Amb18177792 [1,0,0,0,0,0|2,0,1]=4 507 B6R0.1 CCCC(C)CI Amb24531410 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.1 CCCC(C)CS Amb25851785 [1,0,0,0,0,0|2,0,1]=4 509 B6R0.1 CCCC(CC)N Amb13951437 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.1 CCC[C@@H](C)CO Amb22823174 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.1 CCC[C@H](C)CBr Amb24478868 [1,0,0,0,0,0|2,0,1]=4 512 B6R0.1 CCC[C@H](C)CI Amb24372792 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.1 CCN(C)CC#C Amb24479779 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.1 CCN(C)CCBr Amb18788424 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.1 CCN(C)CCF Amb25850115 [1,0,0,0,0,0|2,0,1]=4 516 B6R0.1 CCN(C)CCI Amb24397847 [1,0,0,0,0,0|2,0,1]=4 517 B6R0.1 CCN(N)CCO Amb24407231 [1,0,0,0,0,0|2,0,1]=4 518 B6R0.1 CCOC(C)CC Amb17939313 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.1 CC[C@@H](C)CCBr Amb25362204 [1,0,0,0,0,0|1,0,1]=3 520 B6R0.1 CC[C@@H](C)CCI Amb24531332 [1,0,0,0,0,0|1,0,1]=3 521 B6R0.1 CC[C@@H](C)CCN Amb25173553 [1,0,0,0,0,0|1,0,1]=3 522 B6R0.1 CC[C@@H](C)CCO Amb22800733 [1,0,0,0,0,0|0,0,1]=2 523 B6R0.1 CC[C@@H](C)N=C=O Amb24724238 [1,0,0,0,0,0|1,0,1]=3 524 B6R0.1 CC[C@@H](N)CC=C Amb22831805 [1,0,0,0,0,0|2,0,0]=3 525 B6R0.1 CC[C@@H](N)CCC Amb25841506 [1,0,0,0,0,0|2,0,1]=4 526 B6R0.1 CC[C@@H](N)CCO Amb24479845 [1,0,0,0,0,0|1,0,1]=3 527 B6R0.1 CC[C@@H](N)COC Amb22755736 [1,0,0,0,0,0|3,0,0]=4 528 B6R0.1 CC[C@@H](N)COC Amb24479069 [1,0,0,0,0,0|3,0,0]=4 529 B6R0.1 CC[C@@H](N)CSC Amb25303922 [1,0,0,0,0,0|3,0,0]=4 530 B6R0.1 CC[C@@H](O)CC#C Amb25173822 [1,0,0,0,0,0|2,0,1]=4 531 B6R0.1 CC[C@@H](O)CC=C Amb22898757 [1,0,0,0,0,0|2,0,0]=3 532 B6R0.1 CC[C@@H](O)CCBr Amb25689298 [1,0,0,0,0,0|2,0,1]=4 533 B6R0.1 CC[C@@H](O)CNC Amb25294683 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.1 CC[C@@H](O)CSC Amb25169420 [1,0,0,0,0,0|3,0,0]=4 535 B6R0.1 CC[C@H](C)CC=O Amb25805988 [1,0,0,0,0,0|0,0,0]=1 536 B6R0.1 CC[C@H](C)CCN Amb24640834 [1,0,0,0,0,0|1,0,1]=3 537 B6R0.1 CC[C@H](C)CCO Amb24333653 [1,0,0,0,0,0|0,0,1]=2 538 B6R0.1 CC[C@H](C)NC=O Amb25261503 [1,0,0,0,0,0|1,0,0]=2 539 B6R0.1 CC[C@H](C)OCCl Amb25141506 [1,0,0,0,0,0|2,0,1]=4 540 B6R0.1 CC[C@H](CC#N)N Amb17608228 [1,0,0,0,0,0|2,0,1]=4 541 B6R0.1 CC[C@H](N)CC#N Amb19884025 [1,0,0,0,0,0|2,0,1]=4 542 B6R0.1 CC[C@H](N)CCO Amb24738993 [1,0,0,0,0,0|1,0,1]=3 543 B6R0.1 CC[C@H](N)CNC Amb24386401 [1,0,0,0,0,0|3,0,0]=4 544 B6R0.1 CC[C@H](O)CC=C Amb25832194 [1,0,0,0,0,0|2,0,0]=3 545 B6R0.1 CC[C@H](O)CCC Amb25781736 [1,0,0,0,0,0|2,0,1]=4 546 B6R0.1 CC[C@H](O)CCN Amb25284469 [1,0,0,0,0,0|2,0,1]=4 547 B6R0.1 CC[C@H](O)CNN Amb25257062 [1,0,0,0,0,0|3,0,0]=4 548 B6R0.1 CC\C(\C)=C\CO Amb24623050 [1,0,0,0,0,0|0,0,3]=4 549 B6R0.1 CN(CCO)CO Amb24691618 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.1 CNC(C)CC#C Amb18959778 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.1 CNC(C)CC#N Amb18540665 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.1 CNC(C)CC=C Amb18292023 [1,0,0,0,0,0|2,0,0]=3 553 B6R0.1 CNC(C)CCBr Amb25076974 [1,0,0,0,0,0|2,0,1]=4 554 B6R0.1 CNC(C)CCCl Amb22492693 [1,0,0,0,0,0|2,0,1]=4 555 B6R0.1 CNC(C)CCN Amb20090507 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.1 CNC(C)CCS Amb24627618 [1,0,0,0,0,0|1,1,1]=4 557 B6R0.1 CNC(C)CNC Amb18993072 [1,0,0,0,0,0|3,0,0]=4 558 B6R0.1 CNC(C)CNN Amb18640278 [1,0,0,0,0,0|3,0,0]=4 559 B6R0.1 CNC(C)CSC Amb18300373 [1,0,0,0,0,0|3,0,0]=4 560 B6R0.1 CNC(C)NC=O Amb24479143 [1,0,0,0,0,0|2,0,0]=3 561 B6R0.1 CNCC(C)CN Amb18300042 [1,0,0,0,0,0|3,0,0]=4 562 B6R0.1 CNCC(C)CS Amb25853223 [1,0,0,0,0,0|3,0,0]=4 563 B6R0.1 CNCC(C)OC Amb19959922 [1,0,0,0,0,0|3,0,0]=4 564 B6R0.1 CNCC(C)SC Amb18299459 [1,0,0,0,0,0|3,0,0]=4 565 B6R0.1 CNC[C@H](C)CO Amb25663141 [1,0,0,0,0,0|3,0,0]=4 566 B6R0.1 CNN(C)CCO Amb25167370 [1,0,0,0,0,0|2,0,1]=4 567 B6R0.1 CN[C@H](C)CNC Amb25091130 [1,0,0,0,0,0|3,0,0]=4 568 B6R0.1 COC(=O)CC=O Amb18199826 [1,0,0,0,0,0|2,0,1]=4 569 B6R0.1 COC(C)=CC=O Amb25328678 [1,0,0,0,0,0|1,0,2]=4 570 B6R0.1 COC(C)CC#N Amb20622879 [1,0,0,0,0,0|2,0,1]=4 571 B6R0.1 COC(C)CCBr Amb22227890 [1,0,0,0,0,0|2,0,1]=4 572 B6R0.1 COC(C)CCCl Amb24359538 [1,0,0,0,0,0|2,0,1]=4 573 B6R0.1 COC(C)CCN Amb21961545 [1,0,0,0,0,0|2,0,1]=4 574 B6R0.1 COC(C)CON Amb18640476 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.1 COC(C)CSC Amb25043640 [1,0,0,0,0,0|3,0,0]=4 576 B6R0.1 COC(C)N=C=O Amb24593600 [1,0,0,0,0,0|2,0,1]=4 577 B6R0.1 COC(C)NC=O Amb24392931 [1,0,0,0,0,0|2,0,0]=3 578 B6R0.1 COCC(C)CBr Amb24332722 [1,0,0,0,0,0|3,0,0]=4 579 B6R0.1 COCC(C)CCl Amb24393321 [1,0,0,0,0,0|3,0,0]=4 580 B6R0.1 COCC(C)SC Amb24507664 [1,0,0,0,0,0|3,0,0]=4 581 B6R0.1 COCC(NC)C Amb10609106 [1,0,0,0,0,0|3,0,0]=4 582 B6R0.1 COC[C@@H](C)CO Amb22745568 [1,0,0,0,0,0|3,0,0]=4 583 B6R0.1 COC[C@H](C)CO Amb17872438 [1,0,0,0,0,0|3,0,0]=4 584 B6R0.1 CON(C)CC=C Amb24333772 [1,0,0,0,0,0|3,0,0]=4 585 B6R0.1 CO[C@H](C)CCBr Amb24470089 [1,0,0,0,0,0|2,0,1]=4 586 B6R0.1 CO\C(\C)=C/C=O Amb25326199 [1,0,0,0,0,0|1,0,2]=4 587 B6R0.1 CO\C(\C)=C\C=O Amb18121410 [1,0,0,0,0,0|1,0,2]=4 588 B6R0.1 CSC(C)CC=C Amb25662675 [1,0,0,0,0,0|2,0,0]=3 589 B6R0.1 CSC(C)CCBr Amb24693201 [1,0,0,0,0,0|2,0,1]=4 590 B6R0.1 CSC(C)CCCl Amb25169533 [1,0,0,0,0,0|2,0,1]=4 591 B6R0.1 CSCC(C)CN Amb18970333 [1,0,0,0,0,0|3,0,0]=4 592 B6R0.1 CSCC(C)CS Amb24350656 [1,0,0,0,0,0|3,0,0]=4 593 B6R0.1 CSCC(CC)N Amb17485955 [1,0,0,0,0,0|3,0,0]=4 594 B6R0.1 CS[C@H](C)CCO Amb24581736 [1,0,0,0,0,0|1,0,1]=3 595 B6R0.1 C[C@@H](CBr)CC=C Amb24739638 [1,0,0,0,0,0|2,0,0]=3 596 B6R0.1 C[C@@H](CBr)CCO Amb24478942 [1,0,0,0,0,0|1,0,1]=3 597 B6R0.1 C[C@@H](CC)NCC Amb24575627 [1,0,0,0,0,0|2,0,1]=4 598 B6R0.1 C[C@@H](CC=O)C=C Amb25746367 [1,0,0,0,0,0|0,0,2]=3 599 B6R0.1 C[C@@H](CCO)C=C Amb24334509 [1,0,0,0,0,0|0,0,3]=4 600 B6R0.1 C[C@@H](CCO)CO Amb19944691 [1,0,0,0,0,0|1,0,1]=3 601 B6R0.1 C[C@@H](CCl)CCO Amb24671318 [1,0,0,0,0,0|1,0,1]=3 602 B6R0.1 C[C@@H](CI)CC=C Amb25242572 [1,0,0,0,0,0|2,0,0]=3 603 B6R0.1 C[C@@H](CN)CC=C Amb25836360 [1,0,0,0,0,0|2,0,0]=3 604 B6R0.1 C[C@@H](CO)CC#C Amb25042877 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.1 C[C@@H](CO)CC=C Amb25167493 [1,0,0,0,0,0|2,0,0]=3 606 B6R0.1 C[C@@H](CO)CCN Amb22801706 [1,0,0,0,0,0|2,0,1]=4 607 B6R0.1 C[C@@H](CO)NC=O Amb25372235 [1,0,0,0,0,0|2,0,0]=3 608 B6R0.1 C[C@H](CBr)CC#N Amb24577421 [1,0,0,0,0,0|2,0,1]=4 609 B6R0.1 C[C@H](CBr)CCO Amb24740770 [1,0,0,0,0,0|1,0,1]=3 610 B6R0.1 C[C@H](CBr)N=C=O Amb24478553 [1,0,0,0,0,0|2,0,1]=4 611 B6R0.1 C[C@H](CCO)CO Amb22225176 [1,0,0,0,0,0|1,0,1]=3 612 B6R0.1 C[C@H](CO)CC#N Amb25662541 [1,0,0,0,0,0|2,0,1]=4 613 B6R0.1 C[C@H](CO)CC=C Amb25026058 [1,0,0,0,0,0|2,0,0]=3 614 B6R0.1 C[C@H](CO)CCCl Amb25848484 [1,0,0,0,0,0|2,0,1]=4 615 B6R0.1 C[C@H](CO)CCN Amb25663130 [1,0,0,0,0,0|2,0,1]=4 616 B6R0.1 C\C(\CBr)=C\C=O Amb18645750 [1,0,0,0,0,0|1,0,2]=4 617 B6R0.1 C\C(\CC)=C/C=C Amb24480536 [1,0,0,0,0,0|1,0,2]=4 618 B6R0.1 C\C(\CC)=C\C=O Amb18120877 [1,0,0,0,0,0|0,0,2]=3 619 B6R0.1 C\C(\CCl)=C\C=O Amb25326191 [1,0,0,0,0,0|1,0,2]=4 620 B6R0.1 C\C(\CO)=C/C=O Amb24417925 [1,0,0,0,0,0|1,0,2]=4 621 B6R0.1 C\C=C(/C)\CC=C Amb24479822 [1,0,0,0,0,0|1,0,2]=4 622 B6R0.1 C\C=C(/C)\CC=O Amb18120886 [1,0,0,0,0,0|0,0,2]=3 623 B6R0.1 C\C=C(/C)\CCO Amb24674649 [1,0,0,0,0,0|0,0,3]=4 624 B6R0.1 C\C=C(\C)/CC=C Amb24099383 [1,0,0,0,0,0|1,0,2]=4 625 B6R0.1 C\C=C\C(C)CC Amb22232014 [1,0,0,0,0,0|1,0,1]=3 626 B6R0.1 C\C=C\C(C)CN Amb24479862 [1,0,0,0,0,0|2,0,1]=4 627 B6R0.1 C\C=C\C(C)NC Amb18639480 [1,0,0,0,0,0|2,0,1]=4 628 B6R0.1 C\C=C\C(O)CC Amb22731799 [1,0,0,0,0,0|2,0,1]=4 629 B6R0.1 C\C=C\[C@H](C)CO Amb25381306 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.1 C\C=C\[C@H](Cl)CC Amb24634127 [1,0,0,0,0,0|2,0,1]=4 631 B6R0.1 ClCCN(CC)C Amb17334076 [1,0,0,0,0,0|2,0,1]=4 632 B6R0.1 NC(CS)CCO Amb25083064 [1,0,0,0,0,0|2,0,1]=4 633 B6R0.1 NCC(N)CCO Amb19514523 [1,0,0,0,0,0|2,0,1]=4 634 B6R0.1 NCC(O)CCO Amb22011571 [1,0,0,0,0,0|2,0,1]=4 635 B6R0.1 NCCC(CC)C Amb10607691 [1,0,0,0,0,0|1,0,1]=3 636 B6R0.1 NCCC(CO)C Amb17506270 [1,0,0,0,0,0|2,0,1]=4 637 B6R0.1 NC[C@@H](N)CCO Amb19514529 [1,0,0,0,0,0|2,0,1]=4 638 B6R0.1 NC[C@H](N)CCO Amb25115256 [1,0,0,0,0,0|2,0,1]=4 639 B6R0.1 N[C@H](CS)CCO Amb25691951 [1,0,0,0,0,0|2,0,1]=4 640 B6R0.1 O=CC(S)CC=O Amb25768520 [1,0,0,0,0,0|2,0,1]=4 641 B6R0.1 O=CCC(Br)CBr Amb24671080 [1,0,0,0,0,0|2,0,0]=3 642 B6R0.1 OCC(Cl)CCO Amb24441411 [1,0,0,0,0,0|2,0,1]=4 643 B6R0.1 OCC(O)CC=O Amb25243032 [1,0,0,0,0,0|2,0,0]=3 644 B6R0.1 OCC(O)CNO Amb25026456 [1,0,0,0,0,0|3,0,0]=4 645 B6R0.1 OCCC(CN)C Amb17506271 [1,0,0,0,0,0|1,0,1]=3 646 B6R0.1 OCCC(Cl)CCl Amb25147506 [1,0,0,0,0,0|2,0,1]=4 647 B6R0.1 OCCC(O)CCl Amb25361069 [1,0,0,0,0,0|2,0,1]=4 648 B6R0.1 OCCS(=O)CC Amb10669566 [1,0,0,0,0,0|2,0,1]=4 649 B6R0.1 OCC[C@H](CO)O Amb10071064 [1,0,0,0,0,0|2,0,1]=4 650 B6R0.1 OCC[C@H](O)CCl Amb25714009 [1,0,0,0,0,0|2,0,1]=4 651 B6R0.1 OC[C@H](Br)CCO Amb25697346 [1,0,0,0,0,0|2,0,1]=4 652 B6R0.1 OC[C@H](O)CC=O Amb24595645 [1,0,0,0,0,0|2,0,0]=3 653 B6R0.1 O[C@@H](CC=O)C=O Amb25169555 [1,0,0,0,0,0|2,0,1]=4 654 B6R0.1 O[C@@H](CCl)CC=O Amb25824190 [1,0,0,0,0,0|2,0,0]=3 655 B6R0.1 O[C@H](CC=O)C=O Amb25373324 [1,0,0,0,0,0|2,0,1]=4 656 B6R0.1 [C-]#[N+]CC(F)CC Amb25204383 [1,0,0,0,0,0|3,0,0]=4 657 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,0,0,0,0,0|1,0,2]=4 658 B6R0.2 CC(=C)CC(=O)C Amb17593075 [1,0,0,0,0,0|1,0,2]=4 659 B6R0.2 CC(=C)CN(C)C Amb25747292 [1,0,0,0,0,0|3,0,0]=4 660 B6R0.2 CC(=CC(=O)N)C Amb10561758 [1,0,0,0,0,0|1,0,2]=4 661 B6R0.2 CC(=CC(=O)O)C Amb1485519 [1,0,0,0,0,0|0,0,2]=3 662 B6R0.2 CC(=N)CC(N)=O Amb25259783 [1,0,0,0,0,0|2,0,1]=4 663 B6R0.2 CC(=O)C=S(C)C Amb25370005 [1,0,0,0,0,0|2,0,1]=4 664 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [1,0,0,0,0,0|2,0,1]=4 665 B6R0.2 CC(=O)CC(C)=N Amb22345922 [1,0,0,0,0,0|2,0,1]=4 666 B6R0.2 CC(=O)CC(C)=O Amb22727963 [1,0,0,0,0,0|2,0,1]=4 667 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,0,0,0,0,0|2,0,0]=3 668 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [1,0,0,0,0,0|2,0,0]=3 669 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [1,0,0,0,0,0|3,0,0]=4 670 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,0,0,0,0,0|3,0,0]=4 671 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,0,0,0,0,0|1,0,1]=3 672 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,0,0,0,0,0|1,1,1]=4 673 B6R0.2 CC(=O)CC(O)O Amb25273111 [1,0,0,0,0,0|3,0,0]=4 674 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [1,0,0,0,0,0|1,0,2]=4 675 B6R0.2 CC(=O)CS(C)=O Amb25025354 [1,0,0,0,0,0|3,0,0]=4 676 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [1,0,0,0,0,0|2,0,0]=3 677 B6R0.2 CC(=O)NN(C)C Amb25064806 [1,0,0,0,0,0|3,0,0]=4 678 B6R0.2 CC(=S)CC(N)=O Amb24479846 [1,0,0,0,0,0|2,0,1]=4 679 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [1,0,0,0,0,0|1,0,2]=4 680 B6R0.2 CC(Br)CC(C)=C Amb24365286 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.2 CC(Br)CC(C)O Amb25139315 [1,0,0,0,0,0|2,0,1]=4 682 B6R0.2 CC(Br)CC(N)=N Amb25700372 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.2 CC(Br)CC(N)=O Amb24635749 [1,0,0,0,0,0|2,0,0]=3 684 B6R0.2 CC(Br)OC(C)=O Amb19958925 [1,0,0,0,0,0|3,0,0]=4 685 B6R0.2 CC(C)=NC(N)=O Amb24682478 [1,0,0,0,0,0|2,0,1]=4 686 B6R0.2 CC(C)C=C(Br)Br Amb24736609 [1,0,0,0,0,0|2,0,1]=4 687 B6R0.2 CC(C)CC(=C)Br Amb22583739 [1,0,0,0,0,0|2,0,0]=3 688 B6R0.2 CC(C)CC(C)C Amb22045157 [1,0,0,0,0,0|2,0,1]=4 689 B6R0.2 CC(C)CC(C)I Amb25783778 [1,0,0,0,0,0|2,0,1]=4 690 B6R0.2 CC(C)CC(Cl)Br Amb24634052 [1,0,0,0,0,0|2,0,1]=4 691 B6R0.2 CC(C)CC(Cl)Cl Amb17689252 [1,0,0,0,0,0|2,0,1]=4 692 B6R0.2 CC(C)CC([O-])=O Amb22732147 [1,0,0,0,0,0|0,0,1]=2 693 B6R0.2 CC(C)CC([O-])=O Amb22732282 [1,0,0,0,0,0|0,0,1]=2 694 B6R0.2 CC(C)CC([O-])=O Amb22734041 [1,0,0,0,0,0|0,0,1]=2 695 B6R0.2 CC(C)CC([O-])=O Amb22734425 [1,0,0,0,0,0|0,0,1]=2 696 B6R0.2 CC(C)CN(C)N Amb25339332 [1,0,0,0,0,0|3,0,0]=4 697 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,0,0,0,0,0|2,0,0]=3 698 B6R0.2 CC(C)CS([O-])=O Amb19930010 [1,0,0,0,0,0|1,0,1]=3 699 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,0,0,0,0,0|0,0,0]=1 700 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [1,0,0,0,0,0|0,0,1]=2 701 B6R0.2 CC(C)C[Al](Cl)Cl Amb22353406 [1,0,0,0,0,0|3,0,0]=4 702 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [1,0,0,0,0,0|1,0,1]=3 703 B6R0.2 CC(C)C[SiH](Cl)Cl Amb25143964 [1,0,0,0,0,0|2,1,0]=4 704 B6R0.2 CC(C)NC(=O)F Amb24567697 [1,0,0,0,0,0|2,0,0]=3 705 B6R0.2 CC(C)NC(C)=C Amb25746179 [1,0,0,0,0,0|3,0,0]=4 706 B6R0.2 CC(C)NC(C)=N Amb25711699 [1,0,0,0,0,0|3,0,0]=4 707 B6R0.2 CC(C)NC(C)O Amb25662502 [1,0,0,0,0,0|2,0,1]=4 708 B6R0.2 CC(C)NC(N)=N Amb24271074 [1,0,0,0,0,0|3,0,0]=4 709 B6R0.2 CC(C)NC(S)=S Amb24761419 [1,0,0,0,0,0|1,2,0]=4 710 B6R0.2 CC(C)OC(=C)O Amb24086570 [1,0,0,0,0,0|2,0,0]=3 711 B6R0.2 CC(C)OC(C)=S Amb24697607 [1,0,0,0,0,0|2,1,0]=4 712 B6R0.2 CC(C)OC(N)=S Amb25732665 [1,0,0,0,0,0|2,1,0]=4 713 B6R0.2 CC(C)OC(S)=S Amb22274297 [1,0,0,0,0,0|1,2,0]=4 714 B6R0.2 CC(C)OC(S)=S Amb24465791 [1,0,0,0,0,0|1,2,0]=4 715 B6R0.2 CC(C)OC([S-])=S Amb19748282 [1,0,0,0,0,0|1,2,0]=4 716 B6R0.2 CC(C)OC([S-])=S Amb22729007 [1,0,0,0,0,0|1,2,0]=4 717 B6R0.2 CC(C)OP(C)=O Amb24592794 [1,0,0,0,0,0|3,0,0]=4 718 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,0,0,0,0,0|2,0,0]=3 719 B6R0.2 CC(C)SC(N)=N Amb22369433 [1,0,0,0,0,0|3,0,0]=4 720 B6R0.2 CC(C)SC(N)=O Amb24461669 [1,0,0,0,0,0|2,0,0]=3 721 B6R0.2 CC(CC(=C)C)O Amb17593083 [1,0,0,0,0,0|3,0,0]=4 722 B6R0.2 CC(CC(=N)N)C Amb10066934 [1,0,0,0,0,0|2,0,0]=3 723 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [1,0,0,0,0,0|2,0,0]=3 724 B6R0.2 CC(CC(=O)C)N Amb2583230 [1,0,0,0,0,0|2,0,0]=3 725 B6R0.2 CC(CC(=O)C)O Amb17593091 [1,0,0,0,0,0|2,0,0]=3 726 B6R0.2 CC(CC(Cl)C)O Amb17593253 [1,0,0,0,0,0|2,0,1]=4 727 B6R0.2 CC(CC(N)C)C Amb1121431 [1,0,0,0,0,0|2,0,1]=4 728 B6R0.2 CC(CC(O)C)O Amb10068523 [1,0,0,0,0,0|2,0,1]=4 729 B6R0.2 CC(CN(C)C)C Amb17231805 [1,0,0,0,0,0|3,0,0]=4 730 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [1,0,0,0,0,0|3,0,0]=4 731 B6R0.2 CC(Cl)CP(O)O Amb25061243 [1,0,0,0,0,0|2,0,1]=4 732 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [1,0,0,0,0,0|3,0,0]=4 733 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [1,0,0,0,0,0|3,0,0]=4 734 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [1,0,0,0,0,0|3,0,0]=4 735 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [1,0,0,0,0,0|3,0,0]=4 736 B6R0.2 CC(F)=CC(O)=O Amb24676595 [1,0,0,0,0,0|1,0,2]=4 737 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,0,0,0,0,0|1,0,0]=2 738 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [1,0,0,0,0,0|2,0,1]=4 739 B6R0.2 CC(I)=CC(O)=O Amb24668934 [1,0,0,0,0,0|1,0,2]=4 740 B6R0.2 CC(I)CC(C)O Amb25743469 [1,0,0,0,0,0|2,0,1]=4 741 B6R0.2 CC(I)CC(N)=O Amb25783800 [1,0,0,0,0,0|2,0,0]=3 742 B6R0.2 CC(N)=CC(O)=O Amb25856437 [1,0,0,0,0,0|1,0,2]=4 743 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [1,0,0,0,0,0|2,0,0]=3 744 B6R0.2 CC(N)CC(C)=C Amb25064223 [1,0,0,0,0,0|3,0,0]=4 745 B6R0.2 CC(N)CC(C)=O Amb22587050 [1,0,0,0,0,0|2,0,0]=3 746 B6R0.2 CC(N)CC(N)=N Amb25051498 [1,0,0,0,0,0|3,0,0]=4 747 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,0,0,0,0,0|2,0,0]=3 748 B6R0.2 CC(N)CC(N)=S Amb25198821 [1,0,0,0,0,0|2,1,0]=4 749 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,0,0,0,0,0|1,0,0]=2 750 B6R0.2 CC(NC(=O)N)C Amb1104587 [1,0,0,0,0,0|2,0,0]=3 751 B6R0.2 CC(NC(=S)N)C Amb1152626 [1,0,0,0,0,0|2,1,0]=4 752 B6R0.2 CC(O)CC(=C)Br Amb24618620 [1,0,0,0,0,0|3,0,0]=4 753 B6R0.2 CC(O)CC(C)N Amb18640217 [1,0,0,0,0,0|2,0,1]=4 754 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,0,0,0,0,0|2,1,0]=4 755 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,0,0,0,0,0|1,0,0]=2 756 B6R0.2 CC(O)CC(O)O Amb25716084 [1,0,0,0,0,0|1,0,2]=4 757 B6R0.2 CC(O)CC(S)=S Amb25215114 [1,0,0,0,0,0|1,2,0]=4 758 B6R0.2 CC(O)CP(O)=O Amb24406357 [1,0,0,0,0,0|2,0,0]=3 759 B6R0.2 CC(O)NC(N)=O Amb25811550 [1,0,0,0,0,0|3,0,0]=4 760 B6R0.2 CC(O)OC(N)=O Amb24669632 [1,0,0,0,0,0|3,0,0]=4 761 B6R0.2 CC(O)SC(C)=O Amb24544015 [1,0,0,0,0,0|3,0,0]=4 762 B6R0.2 CC(OC(=S)[S-])C Amb2371664 [1,0,0,0,0,0|1,2,0]=4 763 B6R0.2 CC(O[N+](=O)[O-])C Amb2447326 [1,0,0,0,0,0|2,0,1]=4 764 B6R0.2 CC(P)CC(C)O Amb25792365 [1,0,0,0,0,0|2,0,1]=4 765 B6R0.2 CC(S)CC(C)=O Amb24600676 [1,0,0,0,0,0|2,0,0]=3 766 B6R0.2 CC(S)CC(C)O Amb24122653 [1,0,0,0,0,0|2,0,1]=4 767 B6R0.2 CC(S)CC(N)=O Amb24479823 [1,0,0,0,0,0|2,0,0]=3 768 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,0,0,0,0,0|1,0,0]=2 769 B6R0.2 CC(SC(=N)N)C Amb1093763 [1,0,0,0,0,0|3,0,0]=4 770 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,0,0,0,0,0|2,0,0]=3 771 B6R0.2 CN(C)CB(O)O Amb25131560 [1,0,0,0,0,0|2,0,1]=4 772 B6R0.2 CN(C)CC(=C)Br Amb24699168 [1,0,0,0,0,0|3,0,0]=4 773 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,0,0,0,0,0|2,0,0]=3 774 B6R0.2 CN(C)CC(N)=S Amb19373088 [1,0,0,0,0,0|2,1,0]=4 775 B6R0.2 CN(C)CC(O)O Amb25226405 [1,0,0,0,0,0|1,0,2]=4 776 B6R0.2 CN(C)CC(O)S Amb24610156 [1,0,0,0,0,0|1,1,1]=4 777 B6R0.2 CN(C)CC([O-])=O Amb22002291 [1,0,0,0,0,0|1,0,1]=3 778 B6R0.2 CN(C)CS(O)=O Amb25376029 [1,0,0,0,0,0|2,0,0]=3 779 B6R0.2 CN(C)C[SiH](O)O Amb25811267 [1,0,0,0,0,0|1,1,1]=4 780 B6R0.2 CN(C)NC(N)=O Amb24325231 [1,0,0,0,0,0|3,0,0]=4 781 B6R0.2 CN(CC(=N)N)C Amb10610521 [1,0,0,0,0,0|3,0,0]=4 782 B6R0.2 CN(CC(=N)N)C Amb10610536 [1,0,0,0,0,0|3,0,0]=4 783 B6R0.2 CN(CC(=O)N)C Amb17231806 [1,0,0,0,0,0|2,0,0]=3 784 B6R0.2 CN(CC(=S)N)C Amb16232219 [1,0,0,0,0,0|2,1,0]=4 785 B6R0.2 CN(C[C@@H](O)C)C Amb10844893 [1,0,0,0,0,0|2,0,1]=4 786 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,0,0,0,0,0|2,0,0]=3 787 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,0,0,0,0,0|2,0,0]=3 788 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,0,0,0,0,0|2,0,0]=3 789 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,0,0,0,0,0|3,0,0]=4 790 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,0,0,0,0,0|2,0,0]=3 791 B6R0.2 CS(C)=CC(O)=O Amb25717234 [1,0,0,0,0,0|1,0,1]=3 792 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [1,0,0,0,0,0|1,0,1]=3 793 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,0,0,0,0,0|1,0,0]=2 794 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [1,0,0,0,0,0|2,0,0]=3 795 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [1,0,0,0,0,0|2,0,0]=3 796 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [1,0,0,0,0,0|3,0,0]=4 797 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [1,0,0,0,0,0|2,0,1]=4 798 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [1,0,0,0,0,0|2,0,0]=3 799 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [1,0,0,0,0,0|2,0,1]=4 800 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [1,0,0,0,0,0|2,0,1]=4 801 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [1,0,0,0,0,0|2,0,1]=4 802 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,0,0,0,0,0|1,0,0]=2 803 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,0,0,0,0,0|1,0,0]=2 804 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,0,0,0,0,0|1,0,0]=2 805 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [1,0,0,0,0,0|2,0,0]=3 806 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,0,0,0,0,0|1,0,0]=2 807 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,0,0,0,0,0|1,0,0]=2 808 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [1,0,0,0,0,0|2,0,0]=3 809 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [1,0,0,0,0,0|2,0,1]=4 810 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [1,0,0,0,0,0|2,0,1]=4 811 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,0,0,0,0,0|1,0,0]=2 812 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [1,0,0,0,0,0|2,0,1]=4 813 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,0,0,0,0,0|2,0,1]=4 814 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,0,0,0,0,0|1,0,0]=2 815 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,0,0,0,0,0|2,0,0]=3 816 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,0,0,0,0,0|1,0,0]=2 817 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [1,0,0,0,0,0|1,0,2]=4 818 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [1,0,0,0,0,0|1,0,2]=4 819 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [1,0,0,0,0,0|1,0,2]=4 820 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [1,0,0,0,0,0|1,0,2]=4 821 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,0,0,0,0,0|2,0,1]=4 822 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [1,0,0,0,0,0|3,0,0]=4 823 B6R0.2 NC(=O)CC(O)O Amb25810087 [1,0,0,0,0,0|3,0,0]=4 824 B6R0.2 NC(F)CC(O)=O Amb24479804 [1,0,0,0,0,0|2,0,0]=3 825 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [1,0,0,0,0,0|2,0,0]=3 826 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [1,0,0,0,0,0|2,0,0]=3 827 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [1,0,0,0,0,0|3,0,0]=4 828 B6R0.2 OB(CC(C)C)O Amb2447316 [1,0,0,0,0,0|1,0,1]=3 829 B6R0.2 OB(O)CC(O)=O Amb24053058 [1,0,0,0,0,0|3,0,0]=4 830 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,0,0,0,0,0|2,0,1]=4 831 B6R0.2 OC(=O)CC(F)Br Amb25336987 [1,0,0,0,0,0|2,0,0]=3 832 B6R0.2 OC(=O)CC(F)F Amb22001551 [1,0,0,0,0,0|2,0,0]=3 833 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,0,0,0,0,0|2,0,1]=4 834 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,0,0,0,0,0|2,0,1]=4 835 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,0,0,0,0,0|2,0,1]=4 836 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [1,0,0,0,0,0|3,0,0]=4 837 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,0,0,0,0,0|2,0,1]=4 838 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,0,0,0,0,0|2,0,1]=4 839 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,0,0,0,0,0|2,0,1]=4 840 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [1,0,0,0,0,0|1,0,1]=3 841 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,0,0,0,0,0|2,0,0]=3 842 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [1,0,0,0,0,0|2,0,1]=4 843 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [1,0,0,0,0,0|1,0,1]=3 844 B6R0.4 BC(=O)OCCCl Amb25199831 [1,0,0,0,0,0|3,0,0]=4 845 B6R0.4 C#CCCC(N)=O Amb18636026 [1,0,0,0,0,0|1,0,2]=4 846 B6R0.4 C#CCCC([O-])=O Amb22232009 [1,0,0,0,0,0|0,0,3]=4 847 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,0,0,0,0,0|3,0,0]=4 848 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,0,0,0,0,0|3,0,0]=4 849 B6R0.4 C=C(F)CCCO Amb25811029 [1,0,0,0,0,0|3,0,0]=4 850 B6R0.4 C=C(I)CCCN Amb24581029 [1,0,0,0,0,0|3,0,0]=4 851 B6R0.4 C=NCCC(O)=O Amb24480865 [1,0,0,0,0,0|1,0,1]=3 852 B6R0.4 CC#CCC(N)=O Amb24761404 [1,0,0,0,0,0|1,0,2]=4 853 B6R0.4 CC#CCC(O)=O Amb17939740 [1,0,0,0,0,0|0,0,2]=3 854 B6R0.4 CC(=C)CCCBr Amb22886717 [1,0,0,0,0,0|3,0,0]=4 855 B6R0.4 CC(=C)CCCCl Amb24089299 [1,0,0,0,0,0|3,0,0]=4 856 B6R0.4 CC(=C)CCCN Amb24761452 [1,0,0,0,0,0|3,0,0]=4 857 B6R0.4 CC(=C)CCCO Amb22886814 [1,0,0,0,0,0|3,0,0]=4 858 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|2,0,1]=4 859 B6R0.4 CC(=O)CCC=S Amb25662155 [1,0,0,0,0,0|2,0,1]=4 860 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|2,0,0]=3 861 B6R0.4 CC(=O)CCCI Amb25346994 [1,0,0,0,0,0|2,0,0]=3 862 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|2,0,0]=3 863 B6R0.4 CC(=O)CCON Amb25186994 [1,0,0,0,0,0|3,0,0]=4 864 B6R0.4 CC(=O)NCCF Amb25832238 [1,0,0,0,0,0|3,0,0]=4 865 B6R0.4 CC(=O)NCCI Amb25761166 [1,0,0,0,0,0|3,0,0]=4 866 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|3,0,0]=4 867 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|3,0,0]=4 868 B6R0.4 CC(=O)OCCF Amb25123333 [1,0,0,0,0,0|3,0,0]=4 869 B6R0.4 CC(=O)OCCI Amb17673987 [1,0,0,0,0,0|3,0,0]=4 870 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|3,0,0]=4 871 B6R0.4 CC(=O)OCCP Amb25810695 [1,0,0,0,0,0|3,0,0]=4 872 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|3,0,0]=4 873 B6R0.4 CC(=O)SCCCl Amb24746776 [1,0,0,0,0,0|3,0,0]=4 874 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|3,0,0]=4 875 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|3,0,0]=4 876 B6R0.4 CC(O)CCCCl Amb22270232 [1,0,0,0,0,0|2,0,1]=4 877 B6R0.4 CC(O)CCCF Amb24385806 [1,0,0,0,0,0|2,0,1]=4 878 B6R0.4 CC(O)CCCO Amb22227752 [1,0,0,0,0,0|2,0,1]=4 879 B6R0.4 CC(O)CCCS Amb25219256 [1,0,0,0,0,0|2,0,1]=4 880 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|0,0,3]=4 881 B6R0.4 CCC#CC(=O)Cl Amb25857496 [1,0,0,0,0,0|1,0,2]=4 882 B6R0.4 CCC#CC(N)=O Amb25255265 [1,0,0,0,0,0|1,0,2]=4 883 B6R0.4 CCC=CC(C)=O Amb22731698 [1,0,0,0,0,0|1,0,2]=4 884 B6R0.4 CCCC=C(F)F Amb10840483 [1,0,0,0,0,0|2,0,1]=4 885 B6R0.4 CCCCB(Cl)Cl Amb22230362 [1,0,0,0,0,0|3,0,0]=4 886 B6R0.4 CCCCB(O)O Amb2447142 [1,0,0,0,0,0|1,0,1]=3 887 B6R0.4 CCCCC(=C)Br Amb22583744 [1,0,0,0,0,0|2,0,0]=3 888 B6R0.4 CCCCC(=N)N Amb10066937 [1,0,0,0,0,0|2,0,0]=3 889 B6R0.4 CCCCC(=O)Br Amb22730323 [1,0,0,0,0,0|1,0,0]=2 890 B6R0.4 CCCCC(Br)Br Amb25784787 [1,0,0,0,0,0|2,0,1]=4 891 B6R0.4 CCCCC(C)Cl Amb22228753 [1,0,0,0,0,0|2,0,1]=4 892 B6R0.4 CCCCC(C)F Amb24350567 [1,0,0,0,0,0|2,0,1]=4 893 B6R0.4 CCCCC(C)I Amb17673919 [1,0,0,0,0,0|2,0,1]=4 894 B6R0.4 CCCCC(I)I Amb25186537 [1,0,0,0,0,0|2,0,1]=4 895 B6R0.4 CCCCC(N)O Amb24479887 [1,0,0,0,0,0|1,0,1]=3 896 B6R0.4 CCCCC(O)=S Amb24682342 [1,0,0,0,0,0|0,1,0]=2 897 B6R0.4 CCCCC(O)O Amb24687253 [1,0,0,0,0,0|0,0,2]=3 898 B6R0.4 CCCCC(O)S Amb24480485 [1,0,0,0,0,0|0,1,1]=3 899 B6R0.4 CCCCC([O-])=O Amb19879370 [1,0,0,0,0,0|0,0,1]=2 900 B6R0.4 CCCCC([O-])=O Amb22056343 [1,0,0,0,0,0|0,0,1]=2 901 B6R0.4 CCCCC([O-])=O Amb22729192 [1,0,0,0,0,0|0,0,1]=2 902 B6R0.4 CCCCC([O-])=O Amb22731639 [1,0,0,0,0,0|0,0,1]=2 903 B6R0.4 CCCCN(C)N Amb22730468 [1,0,0,0,0,0|3,0,0]=4 904 B6R0.4 CCCCP(Cl)Cl Amb25051489 [1,0,0,0,0,0|3,0,0]=4 905 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,0,0,0,0,0|2,0,0]=3 906 B6R0.4 CCCCS([O-])=O Amb19889352 [1,0,0,0,0,0|1,0,1]=3 907 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,0,0,0,0,0|0,0,0]=1 908 B6R0.4 CCCC[C@@H](C)Br Amb25146346 [1,0,0,0,0,0|2,0,1]=4 909 B6R0.4 CCCC[C@@H](C)I Amb25785621 [1,0,0,0,0,0|2,0,1]=4 910 B6R0.4 CCCC[C@@H](C)N Amb20242479 [1,0,0,0,0,0|2,0,1]=4 911 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,0,0,0,0,0|1,0,1]=3 912 B6R0.4 CCCC[C@H](C)Br Amb25374601 [1,0,0,0,0,0|2,0,1]=4 913 B6R0.4 CCCC[C@H](C)N Amb20242478 [1,0,0,0,0,0|2,0,1]=4 914 B6R0.4 CCCC[Sn](=O)S Amb22730994 [1,0,0,0,0,0|1,1,0]=3 915 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,0,0,0,0,0|1,0,0]=2 916 B6R0.4 CCCNC(=N)N Amb10844865 [1,0,0,0,0,0|3,0,0]=4 917 B6R0.4 CCCNC(=N)N Amb16206147 [1,0,0,0,0,0|3,0,0]=4 918 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,0]=3 919 B6R0.4 CCCNC(=O)N Amb1152241 [1,0,0,0,0,0|2,0,0]=3 920 B6R0.4 CCCNC(=S)N Amb1152085 [1,0,0,0,0,0|2,1,0]=4 921 B6R0.4 CCCNC(C)=S Amb25742111 [1,0,0,0,0,0|2,1,0]=4 922 B6R0.4 CCCNC(C)O Amb25821613 [1,0,0,0,0,0|2,0,1]=4 923 B6R0.4 CCCNC(N)=N Amb20667746 [1,0,0,0,0,0|3,0,0]=4 924 B6R0.4 CCCNC(O)=S Amb25302945 [1,0,0,0,0,0|1,1,0]=3 925 B6R0.4 CCCNS(C)=O Amb25024775 [1,0,0,0,0,0|3,0,0]=4 926 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [1,0,0,0,0,0|2,0,1]=4 927 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,0]=3 928 B6R0.4 CCCOC(N)=S Amb24382119 [1,0,0,0,0,0|2,1,0]=4 929 B6R0.4 CCCOC([S-])=S Amb22334111 [1,0,0,0,0,0|1,2,0]=4 930 B6R0.4 CCCOP(O)=O Amb25366595 [1,0,0,0,0,0|2,0,0]=3 931 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [1,0,0,0,0,0|2,0,1]=4 932 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|2,0,0]=3 933 B6R0.4 CCCSC(N)=N Amb20676008 [1,0,0,0,0,0|3,0,0]=4 934 B6R0.4 CCCSC(N)=N Amb23482968 [1,0,0,0,0,0|3,0,0]=4 935 B6R0.4 CCCSC(N)=S Amb24349580 [1,0,0,0,0,0|2,1,0]=4 936 B6R0.4 CCNCC(=C)Br Amb18969562 [1,0,0,0,0,0|3,0,0]=4 937 B6R0.4 CCNCC(=C)Cl Amb18289297 [1,0,0,0,0,0|3,0,0]=4 938 B6R0.4 CCNCC(=O)N Amb1128676 [1,0,0,0,0,0|2,0,0]=3 939 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|1,0,0]=2 940 B6R0.4 CCNCC(=S)N Amb17231834 [1,0,0,0,0,0|2,1,0]=4 941 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|2,0,0]=3 942 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|2,0,1]=4 943 B6R0.4 CCOCB(O)O Amb25356792 [1,0,0,0,0,0|2,0,1]=4 944 B6R0.4 CCOCC(=C)Br Amb24673237 [1,0,0,0,0,0|3,0,0]=4 945 B6R0.4 CCOCC(C)=C Amb25761593 [1,0,0,0,0,0|3,0,0]=4 946 B6R0.4 CCOCC(N)=N Amb19890012 [1,0,0,0,0,0|3,0,0]=4 947 B6R0.4 CCOC[C@H](C)O Amb25067464 [1,0,0,0,0,0|2,0,1]=4 948 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|3,0,0]=4 949 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,0]=2 950 B6R0.4 CCSCC(C)O Amb24458211 [1,0,0,0,0,0|2,0,1]=4 951 B6R0.4 CCSCC(N)=O Amb24420234 [1,0,0,0,0,0|2,0,0]=3 952 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,0,0,0,0,0|2,0,1]=4 953 B6R0.4 CCSNC(N)=O Amb24479375 [1,0,0,0,0,0|3,0,0]=4 954 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,0,0,0,0,0|0,0,2]=3 955 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 956 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,0,0,0,0,0|2,0,1]=4 957 B6R0.4 CN=CCC(C)=O Amb25261368 [1,0,0,0,0,0|2,0,1]=4 958 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|1,0,0]=2 959 B6R0.4 CNCCC(=S)N Amb17231833 [1,0,0,0,0,0|2,1,0]=4 960 B6R0.4 CNCCC(C)=C Amb18993045 [1,0,0,0,0,0|3,0,0]=4 961 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|2,0,0]=3 962 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,0]=3 963 B6R0.4 CNCCC(O)C Amb17569889 [1,0,0,0,0,0|2,0,1]=4 964 B6R0.4 CNCCS(C)=O Amb21984676 [1,0,0,0,0,0|3,0,0]=4 965 B6R0.4 CNNCC(N)=O Amb25773971 [1,0,0,0,0,0|3,0,0]=4 966 B6R0.4 CNNCC(O)=O Amb21929288 [1,0,0,0,0,0|2,0,0]=3 967 B6R0.4 CNOCC(O)=O Amb25104714 [1,0,0,0,0,0|2,0,0]=3 968 B6R0.4 COCCC(C)O Amb20621489 [1,0,0,0,0,0|2,0,1]=4 969 B6R0.4 COCCC(N)O Amb25727188 [1,0,0,0,0,0|2,0,1]=4 970 B6R0.4 COCCC(O)Br Amb20242943 [1,0,0,0,0,0|2,0,1]=4 971 B6R0.4 COCCN(=O)=O Amb24126452 [1,0,0,0,0,0|2,0,1]=4 972 B6R0.4 COCNC(C)=O Amb24659843 [1,0,0,0,0,0|3,0,0]=4 973 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 974 B6R0.4 CON=CC(O)=O Amb25292253 [1,0,0,0,0,0|2,0,1]=4 975 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,0,0,0,0,0|1,0,2]=4 976 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|2,0,1]=4 977 B6R0.4 CS(=O)CCCBr Amb24365916 [1,0,0,0,0,0|3,0,0]=4 978 B6R0.4 CS(=O)CCCN Amb18974527 [1,0,0,0,0,0|3,0,0]=4 979 B6R0.4 CSCCC(=S)N Amb17307559 [1,0,0,0,0,0|2,1,0]=4 980 B6R0.4 CSCCC(N)=N Amb19373501 [1,0,0,0,0,0|3,0,0]=4 981 B6R0.4 CSCCC(N)=N Amb19516878 [1,0,0,0,0,0|3,0,0]=4 982 B6R0.4 CSCCC(N)=O Amb24479809 [1,0,0,0,0,0|2,0,0]=3 983 B6R0.4 CSCCN(=O)=O Amb24179458 [1,0,0,0,0,0|2,0,1]=4 984 B6R0.4 CSCNC(C)=O Amb24561383 [1,0,0,0,0,0|3,0,0]=4 985 B6R0.4 CSCNC(N)=O Amb24612362 [1,0,0,0,0,0|3,0,0]=4 986 B6R0.4 CSCOC(C)=O Amb19884027 [1,0,0,0,0,0|3,0,0]=4 987 B6R0.4 CSSCC(N)=O Amb24480454 [1,0,0,0,0,0|3,0,0]=4 988 B6R0.4 CSSCC(O)=O Amb25378801 [1,0,0,0,0,0|2,0,0]=3 989 B6R0.4 CS\C=C\C(O)=O Amb18641964 [1,0,0,0,0,0|1,0,2]=4 990 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,0,0,0,0,0|2,0,1]=4 991 B6R0.4 C[C@@H](O)CCCN Amb24479875 [1,0,0,0,0,0|2,0,1]=4 992 B6R0.4 C[C@@H](O)CCCS Amb25794939 [1,0,0,0,0,0|2,0,1]=4 993 B6R0.4 C[C@H](O)CCCCl Amb22348392 [1,0,0,0,0,0|2,0,1]=4 994 B6R0.4 C[Si](=O)CCCN Amb22351702 [1,0,0,0,0,0|2,1,0]=4 995 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,0,0,0,0,0|1,0,2]=4 996 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,0,0,0,0,0|0,0,2]=3 997 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,0,0,0,0,0|1,0,2]=4 998 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,0,0,0,0,0|1,0,1]=3 999 B6R0.4 ClCCCC(=O)N Amb1138237 [1,0,0,0,0,0|2,0,0]=3 1000 B6R0.4 FCCCC(=O)O Amb17593104 [1,0,0,0,0,0|1,0,0]=2 1001 B6R0.4 N#CCCC(=O)C Amb17334046 [1,0,0,0,0,0|2,0,1]=4 1002 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,0,0,0,0,0|2,0,1]=4 1003 B6R0.4 N#CNCC(O)=O Amb25173813 [1,0,0,0,0,0|2,0,1]=4 1004 B6R0.4 N#CSCC(O)=O Amb24480976 [1,0,0,0,0,0|2,0,1]=4 1005 B6R0.4 N=CNCC(O)=O Amb24670244 [1,0,0,0,0,0|2,0,1]=4 1006 B6R0.4 NC(=O)CCCBr Amb25779163 [1,0,0,0,0,0|2,0,0]=3 1007 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,0]=3 1008 B6R0.4 NC(=O)CSCCl Amb25135617 [1,0,0,0,0,0|3,0,0]=4 1009 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|3,0,0]=4 1010 B6R0.4 NC(=O)OCCBr Amb25145573 [1,0,0,0,0,0|3,0,0]=4 1011 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|3,0,0]=4 1012 B6R0.4 NC(=S)CCCF Amb24667655 [1,0,0,0,0,0|2,1,0]=4 1013 B6R0.4 NCC#CC(O)=O Amb25703096 [1,0,0,0,0,0|1,0,2]=4 1014 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,0,0,0,0,0|2,0,0]=3 1015 B6R0.4 NCCCC(=O)N Amb2099583 [1,0,0,0,0,0|2,0,0]=3 1016 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|1,0,0]=2 1017 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,0,0,0,0,0|2,0,0]=3 1018 B6R0.4 NCCCC(N)=S Amb24479598 [1,0,0,0,0,0|2,1,0]=4 1019 B6R0.4 NCCCC(N)O Amb25063002 [1,0,0,0,0,0|2,0,1]=4 1020 B6R0.4 NCCCP(O)=O Amb22370049 [1,0,0,0,0,0|2,0,0]=3 1021 B6R0.4 NCCCS(=O)=O Amb24427014 [1,0,0,0,0,0|2,0,1]=4 1022 B6R0.4 NCCCS(O)=O Amb25185942 [1,0,0,0,0,0|2,0,0]=3 1023 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [1,0,0,0,0,0|2,0,1]=4 1024 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|3,0,0]=4 1025 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|3,0,0]=4 1026 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|3,0,0]=4 1027 B6R0.4 NCCOS(O)=O Amb25843211 [1,0,0,0,0,0|3,0,0]=4 1028 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,0,0,0,0,0|1,0,2]=4 1029 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,0,0,0,0,0|1,0,2]=4 1030 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,0,0,0,0,0|1,0,2]=4 1031 B6R0.4 NNCCC(N)=O Amb24406769 [1,0,0,0,0,0|3,0,0]=4 1032 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|2,0,0]=3 1033 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,0,0,0,0,0|2,0,0]=3 1034 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,0,0,0,0,0|2,0,0]=3 1035 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|3,0,0]=4 1036 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,0,0,0,0,0|3,0,0]=4 1037 B6R0.4 O=C(Cl)SCCCl Amb25272444 [1,0,0,0,0,0|3,0,0]=4 1038 B6R0.4 O=C(S)CCCCl Amb24683280 [1,0,0,0,0,0|1,1,0]=3 1039 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|2,0,1]=4 1040 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,0,0,0,0,0|3,0,0]=4 1041 B6R0.4 OB(O)CCCBr Amb24480413 [1,0,0,0,0,0|2,0,1]=4 1042 B6R0.4 OC(=O)CCC=O Amb17673897 [1,0,0,0,0,0|1,0,1]=3 1043 B6R0.4 OC(=O)CCCI Amb22295911 [1,0,0,0,0,0|1,0,0]=2 1044 B6R0.4 OC(=O)CCCP Amb24717184 [1,0,0,0,0,0|1,0,0]=2 1045 B6R0.4 OC(=O)CCNCl Amb24437846 [1,0,0,0,0,0|2,0,0]=3 1046 B6R0.4 OC(=O)CN=C=S Amb25024397 [1,0,0,0,0,0|2,0,1]=4 1047 B6R0.4 OC(=O)CSN=O Amb24368923 [1,0,0,0,0,0|3,0,0]=4 1048 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,0,0,0,0,0|1,0,2]=4 1049 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|1,0,2]=4 1050 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,0,0,0,0,0|1,0,2]=4 1051 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,0,0,0,0,0|1,0,2]=4 1052 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,0,0,0,0,0|1,0,2]=4 1053 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,0,0,0,0,0|1,0,2]=4 1054 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,0,0,0,0,0|1,0,2]=4 1055 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,0,0,0,0,0|1,0,2]=4 1056 B6R0.4 OCC#CC(O)=O Amb22002375 [1,0,0,0,0,0|1,0,2]=4 1057 B6R0.4 OCCCC(=O)O Amb17615189 [1,0,0,0,0,0|1,0,0]=2 1058 B6R0.4 OCCCC(O)=O Amb18640332 [1,0,0,0,0,0|1,0,0]=2 1059 B6R0.4 OCCCC(O)O Amb22802459 [1,0,0,0,0,0|1,0,2]=4 1060 B6R0.4 OCCNS(O)=O Amb25283153 [1,0,0,0,0,0|3,0,0]=4 1061 B6R0.4 OCCOC(=O)S Amb25106059 [1,0,0,0,0,0|2,1,0]=4 1062 B6R0.4 OCCOP(O)=O Amb25739645 [1,0,0,0,0,0|3,0,0]=4 1063 B6R0.4 OCCOS(O)=O Amb17942859 [1,0,0,0,0,0|3,0,0]=4 1064 B6R0.4 ON=NCC(O)=O Amb25204101 [1,0,0,0,0,0|3,0,0]=4 1065 B6R0.4 OP(=O)OCCCl Amb24479734 [1,0,0,0,0,0|3,0,0]=4 1066 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,0,0,0,0,0|1,0,0]=2 1067 B6R0.4 SCCCC(=O)O Amb16185429 [1,0,0,0,0,0|1,0,0]=2 1068 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [1,0,0,0,0,0|2,0,1]=4 1069 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,0,0,0,0,0|3,0,0]=4 1070 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [1,0,0,0,0,0|2,0,1]=4 1071 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [1,0,0,0,0,0|2,0,1]=4 1072 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [1,0,0,0,0,0|2,0,1]=4 1073 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [1,0,0,0,0,0|2,0,1]=4 1074 B8R0.2 C=C(C(O)CO)C(O)=O Amb18642874 [0,1,0,0,0,0|2,0,1]=4 1075 B8R0.2 C=CC(O)C(N)C(O)=O Amb18642830 [0,1,0,0,0,0|1,0,2]=4 1076 B8R0.2 C=C[C@@H](O)[C@H](N)C(O)=O Amb25111565 [0,1,0,0,0,0|1,0,2]=4 1077 B8R0.2 C=C[C@H](O)[C@H](N)C(O)=O Amb25328036 [0,1,0,0,0,0|1,0,2]=4 1078 B8R0.2 CC(=C)C(=O)C(C)CC Amb25709307 [0,1,0,0,0,0|2,0,1]=4 1079 B8R0.2 CC(=O)C(=C)C(C)CO Amb24588893 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.2 CC(=O)C(=C)[C@@H](C)CO Amb25064620 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.2 CC(=O)C(=O)C(C)OC Amb25730184 [0,1,0,0,0,0|2,0,1]=4 1082 B8R0.2 CC(=O)C(Cl)C(=O)CC Amb24373790 [0,1,0,0,0,0|2,0,1]=4 1083 B8R0.2 CC(=O)C(N)C(=O)CC Amb24744767 [0,1,0,0,0,0|2,0,1]=4 1084 B8R0.2 CC(=O)C(O)C(Cl)CC Amb24588006 [0,1,0,0,0,0|2,0,0]=3 1085 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,1,0,0,0,0|3,0,0]=4 1086 B8R0.2 CC(C#C)C(N)C(O)=O Amb25726710 [0,1,0,0,0,0|0,0,2]=3 1087 B8R0.2 CC(C#C)C(O)C(O)=O Amb24417906 [0,1,0,0,0,0|0,0,2]=3 1088 B8R0.2 CC(C#N)C(=O)C(O)=O Amb24680177 [0,1,0,0,0,0|1,0,2]=4 1089 B8R0.2 CC(C(C)C#C)C(N)=O Amb24683648 [0,1,0,0,0,0|1,0,2]=4 1090 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,1,0,0,0,0|0,0,2]=3 1091 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,1,0,0,0,0|1,0,1]=3 1092 B8R0.2 CC(C(C)C=C)C(C)=O Amb25732466 [0,1,0,0,0,0|1,0,2]=4 1093 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,1,0,0,0,0|0,0,2]=3 1094 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,1,0,0,0,0|1,0,1]=3 1095 B8R0.2 CC(C(C)CN)P(O)=O Amb24623943 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,1,0,0,0,0|2,0,0]=3 1097 B8R0.2 CC(C(C)O)N(C)CC Amb24386168 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,1,0,0,0,0|1,0,0]=2 1099 B8R0.2 CC(C(F)CN)P(O)=O Amb24524185 [0,1,0,0,0,0|3,0,0]=4 1100 B8R0.2 CC(C(N)=O)N(C)CO Amb24744516 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.2 CC(C(N)CC)C(C)O Amb24460640 [0,1,0,0,0,0|2,0,1]=4 1102 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,1,0,0,0,0|1,0,0]=2 1103 B8R0.2 CC(C(N)CC)S(C)=O Amb25299874 [0,1,0,0,0,0|3,0,0]=4 1104 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.2 CC(C(O)=O)=C(Cl)CC Amb24719968 [0,1,0,0,0,0|1,0,2]=4 1106 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,1,0,0,0,0|2,0,1]=4 1107 B8R0.2 CC(C(O)=O)N(C)N=O Amb25041960 [0,1,0,0,0,0|3,0,0]=4 1108 B8R0.2 CC(C(O)C#C)C(O)=O Amb25123215 [0,1,0,0,0,0|1,0,2]=4 1109 B8R0.2 CC(C(O)C=C)C(O)=O Amb18642774 [0,1,0,0,0,0|1,0,2]=4 1110 B8R0.2 CC(C)C(C)C(C)CC Amb22733173 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.2 CC(C)C(N)C(C)CC Amb18203208 [0,1,0,0,0,0|2,0,1]=4 1112 B8R0.2 CC(C)[C@@H](O)[C@H](C)CC Amb25098715 [0,1,0,0,0,0|2,0,1]=4 1113 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,1,0,0,0,0|0,0,2]=3 1114 B8R0.2 CC(C=C)C(F)C(C)=O Amb25839816 [0,1,0,0,0,0|1,0,2]=4 1115 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,1,0,0,0,0|0,0,2]=3 1116 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,1,0,0,0,0|0,0,2]=3 1117 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,1,0,0,0,0|0,0,2]=3 1118 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,1,0,0,0,0|1,0,1]=3 1119 B8R0.2 CC(CBr)N(C)C(C)=O Amb25303453 [0,1,0,0,0,0|3,0,0]=4 1120 B8R0.2 CC(CC)=C(F)C(O)=O Amb25305731 [0,1,0,0,0,0|0,0,2]=3 1121 B8R0.2 CC(CC)C(=C)C(C)O Amb25092048 [0,1,0,0,0,0|1,0,2]=4 1122 B8R0.2 CC(CC)C(Cl)C(=O)Cl Amb24635851 [0,1,0,0,0,0|1,0,0]=2 1123 B8R0.2 CC(CC)C(N)C(=O)S Amb24753871 [0,1,0,0,0,0|0,1,0]=2 1124 B8R0.2 CC(CC)C(N)C(N)=S Amb19374909 [0,1,0,0,0,0|1,1,0]=3 1125 B8R0.2 CC(CC)C(N)P(O)=O Amb24480138 [0,1,0,0,0,0|1,0,0]=2 1126 B8R0.2 CC(CC)C(N)P(O)O Amb24739487 [0,1,0,0,0,0|1,0,1]=3 1127 B8R0.2 CC(CC)C(O)C(C)=C Amb24478684 [0,1,0,0,0,0|2,0,0]=3 1128 B8R0.2 CC(CC)C(O)C(Cl)Cl Amb25765418 [0,1,0,0,0,0|2,0,1]=4 1129 B8R0.2 CC(CC)C(O)C(N)=O Amb24112761 [0,1,0,0,0,0|1,0,0]=2 1130 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,1,0,0,0,0|0,0,0]=1 1131 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,1,0,0,0,0|0,0,0]=1 1132 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,1,0,0,0,0|0,0,0]=1 1133 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,1,0,0,0,0|0,0,0]=1 1134 B8R0.2 CC(CC)[C@@H](N)C(N)=O Amb18538475 [0,1,0,0,0,0|1,0,0]=2 1135 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,1,0,0,0,0|0,0,0]=1 1136 B8R0.2 CC(CC)[C@@H]([NH3+])C(N)=S Amb23437729 [0,1,0,0,0,0|1,1,0]=3 1137 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,1,0,0,0,0|0,0,0]=1 1138 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,1,0,0,0,0|0,0,0]=1 1139 B8R0.2 CC(CCl)N(C)C(C)=O Amb25329970 [0,1,0,0,0,0|3,0,0]=4 1140 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,1,0,0,0,0|1,0,0]=2 1141 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,1,0,0,0,0|1,0,0]=2 1142 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,1,0,0,0,0|1,0,0]=2 1143 B8R0.2 CC(CN)C(O)C(C)=C Amb25102667 [0,1,0,0,0,0|3,0,0]=4 1144 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,1,0,0,0,0|1,0,0]=2 1145 B8R0.2 CC(CN)N(C)C(C)=O Amb18251128 [0,1,0,0,0,0|3,0,0]=4 1146 B8R0.2 CC(CN)N(C)C(N)=O Amb18251133 [0,1,0,0,0,0|3,0,0]=4 1147 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,1,0,0,0,0|1,0,2]=4 1148 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,1,0,0,0,0|1,0,2]=4 1149 B8R0.2 CC(CO)N(C)C(N)=O Amb24481821 [0,1,0,0,0,0|3,0,0]=4 1150 B8R0.2 CC(CO)[C@@H](O)C(C)=C Amb25284368 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,1,0,0,0,0|1,0,0]=2 1152 B8R0.2 CC(NC)C(O)C(C)=C Amb25311078 [0,1,0,0,0,0|3,0,0]=4 1153 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,1,0,0,0,0|1,0,0]=2 1154 B8R0.2 CC(O)C(Br)C(C)CO Amb25799666 [0,1,0,0,0,0|2,0,1]=4 1155 B8R0.2 CC(O)C(O)C(C)CC Amb25818364 [0,1,0,0,0,0|1,0,1]=3 1156 B8R0.2 CC(O)C(O)C(N)CC Amb24480357 [0,1,0,0,0,0|2,0,1]=4 1157 B8R0.2 CC(OC)C(Cl)C(C)=O Amb24480084 [0,1,0,0,0,0|2,0,0]=3 1158 B8R0.2 CC(OC)C(O)C(C)=C Amb24690397 [0,1,0,0,0,0|3,0,0]=4 1159 B8R0.2 CC(OC)C(O)C(N)=O Amb25706543 [0,1,0,0,0,0|2,0,0]=3 1160 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,1,0,0,0,0|1,0,0]=2 1161 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,1,0,0,0,0|1,0,0]=2 1162 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,1,0,0,0,0|0,0,2]=3 1163 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,1,0,0,0,0|0,0,2]=3 1164 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,1,0,0,0,0|0,0,2]=3 1165 B8R0.2 CCC(=O)C(C)C(=O)Cl Amb24340219 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.2 CCC(=O)C(C)C(N)=O Amb24524504 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,1,0,0,0,0|1,0,1]=3 1169 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,1,0,0,0,0|1,0,0]=2 1170 B8R0.2 CCC(C(C(=O)N)N)C Amb1105283 [0,1,0,0,0,0|1,0,0]=2 1171 B8R0.2 CCC(C(C(=O)N)N)C Amb1152621 [0,1,0,0,0,0|1,0,0]=2 1172 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,1,0,0,0,0|1,0,0]=2 1173 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,1,0,0,0,0|0,0,0]=1 1174 B8R0.2 CCC(C([N+](=O)[O-])C)O Amb17618435 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.2 CCC(C)=C(C)C(C)=O Amb24721878 [0,1,0,0,0,0|1,0,2]=4 1176 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,1,0,0,0,0|0,0,1]=2 1177 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,1,0,0,0,0|0,0,1]=2 1178 B8R0.2 CCC(C)C(=O)C([O-])=O Amb22055837 [0,1,0,0,0,0|0,0,2]=3 1179 B8R0.2 CCC(C)C(C)C(C)N Amb24697401 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.2 CCC(C)C(C)C(N)=O Amb24746800 [0,1,0,0,0,0|1,0,0]=2 1181 B8R0.2 CCC(C)C(C)C(N)=S Amb24504575 [0,1,0,0,0,0|1,1,0]=3 1182 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,1,0,0,0,0|0,0,0]=1 1183 B8R0.2 CCC(C)C(C)N(C)C Amb25044950 [0,1,0,0,0,0|3,0,0]=4 1184 B8R0.2 CCC(C)N(C)C(=O)Cl Amb25680235 [0,1,0,0,0,0|2,0,0]=3 1185 B8R0.2 CCC(C)[C@H](C)[C@H](C)O Amb24748768 [0,1,0,0,0,0|1,0,1]=3 1186 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,1,0,0,0,0|1,0,0]=2 1187 B8R0.2 CCC(F)C(N)C(O)O Amb25204781 [0,1,0,0,0,0|1,0,2]=4 1188 B8R0.2 CCC(N)C(=C)C(O)=O Amb24558624 [0,1,0,0,0,0|1,0,1]=3 1189 B8R0.2 CCC(O)C(=C)C(N)=O Amb25265250 [0,1,0,0,0,0|2,0,1]=4 1190 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,1,0,0,0,0|1,0,0]=2 1191 B8R0.2 CCC(O)C(O)C(C)=O Amb24736298 [0,1,0,0,0,0|2,0,0]=3 1192 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,1,0,0,0,0|1,0,0]=2 1193 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,1,0,0,0,0|1,0,0]=2 1194 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,1,0,0,0,0|1,0,0]=2 1195 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,1,0,0,0,0|1,0,0]=2 1196 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,1,0,0,0,0|1,0,0]=2 1197 B8R0.2 CCC([13CH3])[13C](=O)[13C]([O-])=O Amb22055838 [0,1,0,0,0,0|0,0,2]=3 1198 B8R0.2 CCC([C@@H](C(=O)N)N)C Amb17231868 [0,1,0,0,0,0|1,0,0]=2 1199 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,1,0,0,0,0|0,0,0]=1 1200 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,1,0,0,0,0|0,0,0]=1 1201 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,1,0,0,0,0|0,0,0]=1 1202 B8R0.2 CCN(C)C(C)C(N)=O Amb24467965 [0,1,0,0,0,0|2,0,0]=3 1203 B8R0.2 CCN(C)C(C)C(N)=S Amb24655486 [0,1,0,0,0,0|2,1,0]=4 1204 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,1,0,0,0,0|1,0,0]=2 1205 B8R0.2 CCS(=O)C(C)C(C)=O Amb25772477 [0,1,0,0,0,0|3,0,0]=4 1206 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,1,0,0,0,0|2,0,0]=3 1207 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,1,0,0,0,0|0,0,1]=2 1208 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,1,0,0,0,0|1,0,0]=2 1209 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,1,0,0,0,0|1,0,0]=2 1210 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,1,0,0,0,0|1,0,0]=2 1211 B8R0.2 CC[C@@H](O)[C@H](N)C(N)=O Amb24670277 [0,1,0,0,0,0|2,0,0]=3 1212 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,1,0,0,0,0|1,0,0]=2 1213 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,1,0,0,0,0|1,0,0]=2 1214 B8R0.2 CC[C@@H]([C@@H](C(=O)N)N)C Amb10878815 [0,1,0,0,0,0|1,0,0]=2 1215 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,1,0,0,0,0|1,0,0]=2 1216 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,1,0,0,0,0|0,0,0]=1 1217 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,1,0,0,0,0|0,0,0]=1 1218 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,1,0,0,0,0|0,0,1]=2 1219 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,1,0,0,0,0|0,0,0]=1 1220 B8R0.2 CC[C@H](C)[C@H](C)C(N)=O Amb25076764 [0,1,0,0,0,0|1,0,0]=2 1221 B8R0.2 CC[C@H](N)C(=C)C(O)=O Amb24468573 [0,1,0,0,0,0|1,0,1]=3 1222 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,1,0,0,0,0|1,0,0]=2 1223 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,1,0,0,0,0|1,0,0]=2 1224 B8R0.2 CC[C@H](O)[C@H](N)C(N)=O Amb25113391 [0,1,0,0,0,0|2,0,0]=3 1225 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,1,0,0,0,0|0,0,0]=1 1226 B8R0.2 CC\C(\C)=C(\C)/C(C)=O Amb25767749 [0,1,0,0,0,0|1,0,2]=4 1227 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,1,0,0,0,0|2,0,1]=4 1228 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,1,0,0,0,0|1,0,0]=2 1229 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,1,0,0,0,0|1,0,0]=2 1230 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,1,0,0,0,0|2,0,1]=4 1231 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,1,0,0,0,0|2,0,1]=4 1234 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,1,0,0,0,0|1,0,0]=2 1235 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,1,0,0,0,0|1,0,0]=2 1236 B8R0.2 COC(C)C(=C)C(O)=O Amb25706403 [0,1,0,0,0,0|1,0,1]=3 1237 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,1,0,0,0,0|1,0,0]=2 1238 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,1,0,0,0,0|1,0,0]=2 1239 B8R0.2 CO[C@@H](C)C(=O)C(O)=O Amb24597638 [0,1,0,0,0,0|1,0,1]=3 1240 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,1,0,0,0,0|1,0,0]=2 1241 B8R0.2 CO[C@@H](Cl)[C@H](Cl)C(C)=O Amb25162294 [0,1,0,0,0,0|3,0,0]=4 1242 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,1,0,0,0,0|1,0,0]=2 1243 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,1,0,0,0,0|1,0,0]=2 1244 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,1,0,0,0,0|1,0,0]=2 1245 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,1,0,0,0,0|1,0,0]=2 1246 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,1,0,0,0,0|1,0,0]=2 1247 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,1,0,0,0,0|1,0,0]=2 1248 B8R0.2 C[C@@H](C#C)[C@H](N)C(O)=O Amb25783160 [0,1,0,0,0,0|0,0,2]=3 1249 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,1,0,0,0,0|2,0,1]=4 1250 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,1,0,0,0,0|0,0,2]=3 1251 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,1,0,0,0,0|1,0,1]=3 1252 B8R0.2 C[C@@H](CC)C(=O)C([O-])=O Amb22757032 [0,1,0,0,0,0|0,0,2]=3 1253 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,1,0,0,0,0|0,0,0]=1 1254 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,1,0,0,0,0|0,0,0]=1 1255 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,1,0,0,0,0|0,0,0]=1 1256 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,1,0,0,0,0|0,0,0]=1 1257 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,1,0,0,0,0|0,0,0]=1 1258 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,1,0,0,0,0|0,0,0]=1 1259 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,1,0,0,0,0|0,0,0]=1 1260 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,1,0,0,0,0|0,0,0]=1 1261 B8R0.2 C[C@@H](CN)N(C)C(C)=O Amb25172190 [0,1,0,0,0,0|3,0,0]=4 1262 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,1,0,0,0,0|1,0,0]=2 1263 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,1,0,0,0,0|1,0,0]=2 1264 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,1,0,0,0,0|1,0,0]=2 1265 B8R0.2 C[C@@H](NC)[C@H](O)C(C)=C Amb25849330 [0,1,0,0,0,0|3,0,0]=4 1266 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,1,0,0,0,0|1,0,0]=2 1267 B8R0.2 C[C@@H](O)[C@@H](Br)[C@H](C)CO Amb24480008 [0,1,0,0,0,0|2,0,1]=4 1268 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](C)CC Amb24389196 [0,1,0,0,0,0|1,0,1]=3 1269 B8R0.2 C[C@@H](O)[C@H](C)[C@@H](O)CC Amb25369460 [0,1,0,0,0,0|2,0,1]=4 1270 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,1,0,0,0,0|1,0,0]=2 1271 B8R0.2 C[C@@H](OC)[C@H](Br)C(=O)Cl Amb25325034 [0,1,0,0,0,0|2,0,0]=3 1272 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,1,0,0,0,0|1,0,0]=2 1273 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,1,0,0,0,0|1,0,0]=2 1274 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,1,0,0,0,0|1,0,0]=2 1275 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,1,0,0,0,0|1,0,0]=2 1276 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,1,0,0,0,0|0,0,2]=3 1277 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,1,0,0,0,0|1,0,1]=3 1278 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,1,0,0,0,0|1,0,0]=2 1279 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,1,0,0,0,0|1,0,0]=2 1280 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,1,0,0,0,0|1,0,0]=2 1281 B8R0.2 C[C@@H]([C@H](O)C=C)C(O)=O Amb24622455 [0,1,0,0,0,0|1,0,2]=4 1282 B8R0.2 C[C@@H]([C@H](O)CC)C(C)=C Amb24672493 [0,1,0,0,0,0|3,0,0]=4 1283 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,1,0,0,0,0|1,0,0]=2 1284 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,1,0,0,0,0|0,0,2]=3 1285 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,1,0,0,0,0|0,0,2]=3 1286 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,1,0,0,0,0|0,0,2]=3 1287 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,1,0,0,0,0|0,0,2]=3 1288 B8R0.2 C[C@H](C=O)[C@@H](O)C(C)=O Amb25768475 [0,1,0,0,0,0|2,0,1]=4 1289 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,1,0,0,0,0|0,0,0]=1 1290 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,1,0,0,0,0|0,0,0]=1 1291 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,1,0,0,0,0|0,0,0]=1 1292 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,1,0,0,0,0|0,0,0]=1 1293 B8R0.2 C[C@H](CO)N(C)C(C)=O Amb24553314 [0,1,0,0,0,0|3,0,0]=4 1294 B8R0.2 C[C@H](CO)[C@@H](O)C(C)=C Amb24387757 [0,1,0,0,0,0|3,0,0]=4 1295 B8R0.2 C[C@H](NC)[C@@H](O)C(N)=O Amb25095009 [0,1,0,0,0,0|2,0,0]=3 1296 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,1,0,0,0,0|1,0,0]=2 1297 B8R0.2 C[C@H](O)[C@@H](C)[C@@H](O)CC Amb25206574 [0,1,0,0,0,0|2,0,1]=4 1298 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](C)CC Amb25741416 [0,1,0,0,0,0|1,0,1]=3 1299 B8R0.2 C[C@H](O)[C@@H](O)[C@H](C)CC Amb25145311 [0,1,0,0,0,0|1,0,1]=3 1300 B8R0.2 C[C@H](O)[C@H](C)[C@@H](O)CC Amb25369459 [0,1,0,0,0,0|2,0,1]=4 1301 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CC Amb24735014 [0,1,0,0,0,0|1,0,1]=3 1302 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CO Amb24697820 [0,1,0,0,0,0|2,0,1]=4 1303 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,1,0,0,0,0|1,0,0]=2 1304 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,1,0,0,0,0|1,0,0]=2 1305 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,1,0,0,0,0|2,0,0]=3 1306 B8R0.2 C[C@H]([C@H](C)C=C)C(C)=O Amb25266896 [0,1,0,0,0,0|1,0,2]=4 1307 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,1,0,0,0,0|0,0,2]=3 1308 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,1,0,0,0,0|1,0,0]=2 1309 B8R0.2 C\C(=C/C)\C(C)C(C)=O Amb24689489 [0,1,0,0,0,0|1,0,2]=4 1310 B8R0.2 C\C(=C/C)\C(C)C(N)=O Amb24477780 [0,1,0,0,0,0|1,0,2]=4 1311 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,1,0,0,0,0|0,0,2]=3 1312 B8R0.2 C\C(=C/C)\C(O)C(C)=O Amb25708298 [0,1,0,0,0,0|1,0,2]=4 1313 B8R0.2 C\C(=C/C)\C(O)C(N)=O Amb25082841 [0,1,0,0,0,0|1,0,2]=4 1314 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,1,0,0,0,0|0,0,2]=3 1315 B8R0.2 C\C(=C\C)\C(O)C(C)=O Amb24561282 [0,1,0,0,0,0|1,0,2]=4 1316 B8R0.2 C\C(=C\C)\C(O)C(N)=O Amb25243454 [0,1,0,0,0,0|1,0,2]=4 1317 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,1,0,0,0,0|0,0,2]=3 1318 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,1,0,0,0,0|2,0,0]=3 1319 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,1,0,0,0,0|2,0,0]=3 1320 B8R0.2 NC(=O)[C@@H](O)[C@@H](O)CO Amb24533413 [0,1,0,0,0,0|3,0,0]=4 1321 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO Amb25146059 [0,1,0,0,0,0|3,0,0]=4 1322 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,1,0,0,0,0|2,0,0]=3 1323 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,1,0,0,0,0|2,0,0]=3 1324 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,1,0,0,0,0|2,0,0]=3 1325 B8R0.2 NCC(O)C(F)P(O)=O Amb25725015 [0,1,0,0,0,0|3,0,0]=4 1326 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,1,0,0,0,0|2,0,0]=3 1327 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,1,0,0,0,0|2,0,0]=3 1328 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,1,0,0,0,0|2,0,0]=3 1329 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,1,0,0,0,0|2,0,0]=3 1330 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,1,0,0,0,0|2,0,0]=3 1331 B8R0.2 N[C@@H](C(O)CCl)C(N)=O Amb24543859 [0,1,0,0,0,0|3,0,0]=4 1332 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,1,0,0,0,0|2,0,0]=3 1333 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,1,0,0,0,0|2,0,0]=3 1334 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,1,0,0,0,0|2,0,0]=3 1335 B8R0.2 N[C@@H]([C@@H](O)CO)C(N)=O Amb24717733 [0,1,0,0,0,0|3,0,0]=4 1336 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,1,0,0,0,0|2,0,0]=3 1337 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,1,0,0,0,0|2,0,0]=3 1338 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,1,0,0,0,0|2,0,0]=3 1339 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,1,0,0,0,0|2,0,0]=3 1340 B8R0.2 N[C@H](CO)[C@H](O)C(N)=O Amb24677605 [0,1,0,0,0,0|3,0,0]=4 1341 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,1,0,0,0,0|2,0,0]=3 1342 B8R0.2 N[C@H]([C@@H](O)CO)C(=O)Cl Amb25707913 [0,1,0,0,0,0|3,0,0]=4 1343 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,1,0,0,0,0|2,0,0]=3 1344 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,1,0,0,0,0|2,0,0]=3 1345 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,0|2,0,0]=3 1346 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,1,0,0,0,0|2,0,1]=4 1347 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,1,0,0,0,0|2,0,0]=3 1348 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,1,0,0,0,0|2,0,0]=3 1349 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,1,0,0,0,0|2,0,0]=3 1350 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,1,0,0,0,0|2,0,0]=3 1351 B8R0.2 OC[C@H](O)[C@@H](O)C([O-])=O Amb17943095 [0,1,0,0,0,0|2,0,1]=4 1352 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,1,0,0,0,0|2,0,0]=3 1353 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,1,0,0,0,0|2,0,0]=3 1354 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,1,0,0,0,0|2,0,0]=3 1355 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,1,0,0,0,0|1,0,0]=2 1356 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,1,0,0,0,0|0,0,0]=1 1357 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22552521 [0,1,0,0,0,0|2,0,1]=4 1358 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22733096 [0,1,0,0,0,0|2,0,1]=4 1359 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22734344 [0,1,0,0,0,0|2,0,1]=4 1360 B8R0.2 [O-]C(=O)[C@@H](O)[C@H](O)CO Amb22744783 [0,1,0,0,0,0|2,0,1]=4 1361 B8R0.5 C#CCS(=O)CC(O)=O Amb24417332 [0,1,0,0,0,0|2,0,1]=4 1362 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,1,0,0,0,0|1,0,1]=3 1363 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,1,0,0,0,0|1,0,1]=3 1364 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,1,0,0,0,0|1,0,1]=3 1365 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,1,0,0,0,0|1,0,1]=3 1366 B8R0.5 C=C(Br)CC(O)CCO Amb25343863 [0,1,0,0,0,0|3,0,0]=4 1367 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [0,1,0,0,0,0|0,0,3]=4 1368 B8R0.5 C=C=CC(N)CC(O)=O Amb24476615 [0,1,0,0,0,0|1,0,2]=4 1369 B8R0.5 C=CCC(CC(=O)C)C Amb17593320 [0,1,0,0,0,0|1,0,1]=3 1370 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,1,0,0,0,0|1,0,1]=3 1371 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,1,0,0,0,0|1,0,1]=3 1372 B8R0.5 C=CCS(=O)CC(=O)O Amb10608086 [0,1,0,0,0,0|2,0,1]=4 1373 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,1,0,0,0,0|0,0,1]=2 1374 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,1,0,0,0,0|1,0,1]=3 1375 B8R0.5 C=CC[C@@H](O)CC(N)=O Amb24680790 [0,1,0,0,0,0|2,0,1]=4 1376 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,1,0,0,0,0|0,0,1]=2 1377 B8R0.5 CC#CC(O)CC(C)=O Amb24736733 [0,1,0,0,0,0|2,0,1]=4 1378 B8R0.5 CC(=C)CN(C)CCI Amb25740918 [0,1,0,0,0,0|3,0,0]=4 1379 B8R0.5 CC(=C)CN(C)CCN Amb19028420 [0,1,0,0,0,0|3,0,0]=4 1380 B8R0.5 CC(=C)C[C@@H](O)CCO Amb24412924 [0,1,0,0,0,0|3,0,0]=4 1381 B8R0.5 CC(=C)C[C@H](O)CCO Amb24414030 [0,1,0,0,0,0|3,0,0]=4 1382 B8R0.5 CC(=CC(N)=O)OCC Amb25773866 [0,1,0,0,0,0|1,0,2]=4 1383 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [0,1,0,0,0,0|0,0,2]=3 1384 B8R0.5 CC(=CC(O)=O)SCC Amb25229812 [0,1,0,0,0,0|0,0,2]=3 1385 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [0,1,0,0,0,0|2,0,1]=4 1386 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [0,1,0,0,0,0|2,0,1]=4 1387 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,1,0,0,0,0|2,0,1]=4 1388 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,1,0,0,0,0|2,0,1]=4 1389 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [0,1,0,0,0,0|2,0,1]=4 1390 B8R0.5 CC(=O)CN(C)CC=C Amb24752867 [0,1,0,0,0,0|2,0,1]=4 1391 B8R0.5 CC(=O)C[C@H](O)CCBr Amb24634001 [0,1,0,0,0,0|2,0,0]=3 1392 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,1,0,0,0,0|2,0,0]=3 1393 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,1,0,0,0,0|2,0,1]=4 1394 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,1,0,0,0,0|2,0,1]=4 1395 B8R0.5 CC(=O)OC(Br)CCCl Amb25771672 [0,1,0,0,0,0|3,0,0]=4 1396 B8R0.5 CC(=O)OC(Cl)CCCl Amb25109244 [0,1,0,0,0,0|3,0,0]=4 1397 B8R0.5 CC(=O)\C=C(\C)/CCN Amb20621191 [0,1,0,0,0,0|1,0,2]=4 1398 B8R0.5 CC(C)CC(C)CCC Amb22228271 [0,1,0,0,0,0|2,0,1]=4 1399 B8R0.5 CC(C)CC(C)CCN Amb25848784 [0,1,0,0,0,0|2,0,1]=4 1400 B8R0.5 CC(C)CC(C)CNC Amb19023731 [0,1,0,0,0,0|2,0,1]=4 1401 B8R0.5 CC(C)C[C@H](C)CCBr Amb24479945 [0,1,0,0,0,0|2,0,1]=4 1402 B8R0.5 CC(C)C[C@H](C)CCO Amb24456802 [0,1,0,0,0,0|2,0,1]=4 1403 B8R0.5 CC(CC#C)CC(C)=O Amb24707587 [0,1,0,0,0,0|1,0,1]=3 1404 B8R0.5 CC(CC#C)NC(C)=O Amb24373503 [0,1,0,0,0,0|2,0,1]=4 1405 B8R0.5 CC(CC#C)OC(C)=O Amb25091916 [0,1,0,0,0,0|2,0,1]=4 1406 B8R0.5 CC(CC#C)OC(N)=O Amb24446613 [0,1,0,0,0,0|2,0,1]=4 1407 B8R0.5 CC(CC#N)CC(C)=O Amb24339577 [0,1,0,0,0,0|1,0,1]=3 1408 B8R0.5 CC(CC#N)CC(C)O Amb25052229 [0,1,0,0,0,0|1,0,2]=4 1409 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,1,0,0,0,0|0,0,1]=2 1410 B8R0.5 CC(CC#N)NC(C)=O Amb25061726 [0,1,0,0,0,0|2,0,1]=4 1411 B8R0.5 CC(CC(C)=O)=CCCl Amb24581453 [0,1,0,0,0,0|1,0,2]=4 1412 B8R0.5 CC(CC(C)=O)=NOC Amb25179533 [0,1,0,0,0,0|2,0,1]=4 1413 B8R0.5 CC(CC(C)=O)N=[N+]=[N-] Amb24447192 [0,1,0,0,0,0|3,0,0]=4 1414 B8R0.5 CC(CC(C)=O)NC=O Amb24477804 [0,1,0,0,0,0|2,0,1]=4 1415 B8R0.5 CC(CC(F)F)NCC Amb24721139 [0,1,0,0,0,0|2,0,1]=4 1416 B8R0.5 CC(CC(N)=O)N=C=S Amb24590729 [0,1,0,0,0,0|2,0,1]=4 1417 B8R0.5 CC(CC(N)=O)NC#N Amb25115328 [0,1,0,0,0,0|2,0,1]=4 1418 B8R0.5 CC(CC(O)=O)NC=O Amb18967805 [0,1,0,0,0,0|1,0,1]=3 1419 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,1,0,0,0,0|0,0,1]=2 1420 B8R0.5 CC(CC=C)NC(N)=O Amb24412410 [0,1,0,0,0,0|2,0,1]=4 1421 B8R0.5 CC(CC=O)CC(C)=C Amb18642471 [0,1,0,0,0,0|2,0,1]=4 1422 B8R0.5 CC(CC=O)CC(C)O Amb25858195 [0,1,0,0,0,0|1,0,2]=4 1423 B8R0.5 CC(CC=O)NC(C)=O Amb25705280 [0,1,0,0,0,0|2,0,1]=4 1424 B8R0.5 CC(CC=O)OC(C)=O Amb18642743 [0,1,0,0,0,0|2,0,1]=4 1425 B8R0.5 CC(CCBr)CC(C)=O Amb24740003 [0,1,0,0,0,0|1,0,0]=2 1426 B8R0.5 CC(CCBr)NC(C)=O Amb25213338 [0,1,0,0,0,0|2,0,0]=3 1427 B8R0.5 CC(CCBr)OC(C)=O Amb25111237 [0,1,0,0,0,0|2,0,0]=3 1428 B8R0.5 CC(CCCl)CC(C)=O Amb25231057 [0,1,0,0,0,0|1,0,0]=2 1429 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,1,0,0,0,0|0,0,0]=1 1430 B8R0.5 CC(CCN)CB(O)O Amb25337156 [0,1,0,0,0,0|1,0,1]=3 1431 B8R0.5 CC(CCN)CC(C)O Amb25064091 [0,1,0,0,0,0|1,0,1]=3 1432 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,1,0,0,0,0|0,0,0]=1 1433 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,1,0,0,0,0|0,0,0]=1 1434 B8R0.5 CC(CCN)NC(C)=O Amb18986174 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.5 CC(CCN)NC(N)=O Amb18985721 [0,1,0,0,0,0|2,0,0]=3 1436 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,1,0,0,0,0|0,0,2]=3 1437 B8R0.5 CC(CCO)C=C(C)C Amb24581739 [0,1,0,0,0,0|2,0,1]=4 1438 B8R0.5 CC(CCO)CC(C)=C Amb24525539 [0,1,0,0,0,0|2,0,0]=3 1439 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,1,0,0,0,0|1,0,0]=2 1440 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,1,0,0,0,0|0,0,0]=1 1441 B8R0.5 CC(CCO)NC(N)=O Amb25043087 [0,1,0,0,0,0|2,0,0]=3 1442 B8R0.5 CC(CCO)NS(C)=O Amb24736064 [0,1,0,0,0,0|3,0,0]=4 1443 B8R0.5 CC(CCO)OC(N)=O Amb25090414 [0,1,0,0,0,0|2,0,0]=3 1444 B8R0.5 CC(CCS)=CC(O)=O Amb25328912 [0,1,0,0,0,0|0,0,2]=3 1445 B8R0.5 CC(CNC)=CC(O)=O Amb25126794 [0,1,0,0,0,0|0,0,2]=3 1446 B8R0.5 CC(CNO)=CC(O)=O Amb25702672 [0,1,0,0,0,0|1,0,2]=4 1447 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,1,0,0,0,0|0,0,2]=3 1448 B8R0.5 CC(CSC)=CC(O)=O Amb25364860 [0,1,0,0,0,0|0,0,2]=3 1449 B8R0.5 CC(Cl)CC(C)CCCl Amb25790039 [0,1,0,0,0,0|2,0,1]=4 1450 B8R0.5 CC(NC(=O)C)CON Amb17138376 [0,1,0,0,0,0|3,0,0]=4 1451 B8R0.5 CC(NCC)CC(=O)N Amb17231866 [0,1,0,0,0,0|1,0,0]=2 1452 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,1,0,0,0,0|0,0,0]=1 1453 B8R0.5 CC(O)CC(N)CCC Amb24477692 [0,1,0,0,0,0|2,0,1]=4 1454 B8R0.5 CC(O)CC(O)CCO Amb24733599 [0,1,0,0,0,0|2,0,1]=4 1455 B8R0.5 CC(O)CC(O)COC Amb24543387 [0,1,0,0,0,0|2,0,1]=4 1456 B8R0.5 CC(O)CC(O)OCC Amb25734373 [0,1,0,0,0,0|2,0,1]=4 1457 B8R0.5 CC(O)CC(S)CCC Amb24379900 [0,1,0,0,0,0|2,0,1]=4 1458 B8R0.5 CC(O)CN(C)CCBr Amb18324959 [0,1,0,0,0,0|2,0,1]=4 1459 B8R0.5 CC(O)CN(C)CCCl Amb18180172 [0,1,0,0,0,0|2,0,1]=4 1460 B8R0.5 CC(O)CN(C)CCF Amb24333707 [0,1,0,0,0,0|2,0,1]=4 1461 B8R0.5 CC(O)CN(C)CCN Amb19020546 [0,1,0,0,0,0|2,0,1]=4 1462 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,1,0,0,0,0|0,0,2]=3 1463 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,1,0,0,0,0|1,0,0]=2 1464 B8R0.5 CCCC(C)CC(C)=C Amb22730409 [0,1,0,0,0,0|2,0,0]=3 1465 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,1,0,0,0,0|1,0,0]=2 1466 B8R0.5 CCCC(C)CC(C)Cl Amb25823700 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.5 CCCC(C)CC(C)N Amb19026129 [0,1,0,0,0,0|2,0,1]=4 1468 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,1,0,0,0,0|1,0,1]=3 1469 B8R0.5 CCCC(C)CC(N)=N Amb25771598 [0,1,0,0,0,0|2,0,0]=3 1470 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,1,0,0,0,0|1,0,0]=2 1471 B8R0.5 CCCC(C)NC(C)=N Amb25289823 [0,1,0,0,0,0|3,0,0]=4 1472 B8R0.5 CCCC(C)NC(N)=N Amb25189065 [0,1,0,0,0,0|3,0,0]=4 1473 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,1,0,0,0,0|2,0,0]=3 1474 B8R0.5 CCCC(C)SC(N)=N Amb25750723 [0,1,0,0,0,0|3,0,0]=4 1475 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,1,0,0,0,0|2,0,0]=3 1476 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,1,0,0,0,0|1,0,0]=2 1477 B8R0.5 CCCC(CN(C)C)C Amb10560435 [0,1,0,0,0,0|3,0,0]=4 1478 B8R0.5 CCCC(Cl)OC(=O)Cl Amb24480168 [0,1,0,0,0,0|3,0,0]=4 1479 B8R0.5 CCCC(N)CC(C)=C Amb25145992 [0,1,0,0,0,0|3,0,0]=4 1480 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,1,0,0,0,0|2,0,0]=3 1481 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,1,0,0,0,0|1,0,0]=2 1482 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [0,1,0,0,0,0|3,0,0]=4 1483 B8R0.5 CCCC(O)CC(N)=O Amb25072270 [0,1,0,0,0,0|2,0,0]=3 1484 B8R0.5 CCCC(O)C[N+]([O-])=O Amb25265997 [0,1,0,0,0,0|2,0,1]=4 1485 B8R0.5 CCCC(O)OC(C)=O Amb25245948 [0,1,0,0,0,0|3,0,0]=4 1486 B8R0.5 CCCC(O)OC(N)=O Amb24476660 [0,1,0,0,0,0|3,0,0]=4 1487 B8R0.5 CCCN(C)CC(=C)Cl Amb24763817 [0,1,0,0,0,0|3,0,0]=4 1488 B8R0.5 CCCN(C)CC(N)=O Amb24700757 [0,1,0,0,0,0|2,0,0]=3 1489 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,1,0,0,0,0|1,0,0]=2 1490 B8R0.5 CCCN(C)C[C@@H](C)O Amb24394137 [0,1,0,0,0,0|2,0,1]=4 1491 B8R0.5 CCCN(C)C[C@H](C)O Amb24502341 [0,1,0,0,0,0|2,0,1]=4 1492 B8R0.5 CCCN(CC(O)C)C Amb17334132 [0,1,0,0,0,0|2,0,1]=4 1493 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,1,0,0,0,0|2,0,0]=3 1494 B8R0.5 CCC[C@@H](C)CC(N)=O Amb24761385 [0,1,0,0,0,0|1,0,0]=2 1495 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,1,0,0,0,0|0,0,0]=1 1496 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [0,1,0,0,0,0|2,0,0]=3 1497 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,1,0,0,0,0|0,0,0]=1 1498 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,1,0,0,0,0|1,0,0]=2 1499 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,1,0,0,0,0|1,0,0]=2 1500 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,1,0,0,0,0|2,0,0]=3 1501 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,1,0,0,0,0|1,0,0]=2 1502 B8R0.5 CCC[C@H](C)CC(N)=O Amb25340178 [0,1,0,0,0,0|1,0,0]=2 1503 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,1,0,0,0,0|1,0,0]=2 1504 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,1,0,0,0,0|1,0,0]=2 1505 B8R0.5 CCC\C(\C)=C/C(C)=O Amb24676836 [0,1,0,0,0,0|1,0,2]=4 1506 B8R0.5 CCC\C(\C)=C\C(C)=O Amb25735089 [0,1,0,0,0,0|1,0,2]=4 1507 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,1,0,0,0,0|1,0,2]=4 1508 B8R0.5 CCNC(=N)CC(N)=O Amb25769007 [0,1,0,0,0,0|2,0,1]=4 1509 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,1,0,0,0,0|1,0,1]=3 1510 B8R0.5 CCNC(=S)CC([O-])=O Amb25771930 [0,1,0,0,0,0|1,0,2]=4 1511 B8R0.5 CCNC(C)CC(C)=O Amb25131542 [0,1,0,0,0,0|1,0,0]=2 1512 B8R0.5 CCNC(C)CC(C)Br Amb24589023 [0,1,0,0,0,0|2,0,1]=4 1513 B8R0.5 CCNC(C)CC(C)Cl Amb24481697 [0,1,0,0,0,0|2,0,1]=4 1514 B8R0.5 CCNC(C)CC(C)O Amb25836121 [0,1,0,0,0,0|1,0,1]=3 1515 B8R0.5 CCN\C(=C\C(=O)C)\C Amb10602727 [0,1,0,0,0,0|1,0,2]=4 1516 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,1,0,0,0,0|1,0,1]=3 1517 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,1,0,0,0,0|2,0,1]=4 1518 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,1,0,0,0,0|2,0,1]=4 1519 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,1,0,0,0,0|2,0,1]=4 1520 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,1,0,0,0,0|2,0,1]=4 1521 B8R0.5 CCOC(Br)OC(C)=O Amb24425527 [0,1,0,0,0,0|3,0,0]=4 1522 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,1,0,0,0,0|1,0,0]=2 1523 B8R0.5 CCOC(C)CN(C)C Amb24620141 [0,1,0,0,0,0|3,0,0]=4 1524 B8R0.5 CCOC(C)NC(N)=O Amb24655701 [0,1,0,0,0,0|2,0,0]=3 1525 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,1,0,0,0,0|2,0,0]=3 1526 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,1,0,0,0,0|2,0,1]=4 1527 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,1,0,0,0,0|1,0,1]=3 1528 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,1,0,0,0,0|2,0,1]=4 1529 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [0,1,0,0,0,0|2,0,0]=3 1530 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,1,0,0,0,0|0,0,0]=1 1531 B8R0.5 CCO[C@H](C)C[C@@H](C)O Amb24466310 [0,1,0,0,0,0|1,0,1]=3 1532 B8R0.5 CCSC(C)CC(N)=N Amb24333275 [0,1,0,0,0,0|2,0,0]=3 1533 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,1,0,0,0,0|1,0,1]=3 1534 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,1,0,0,0,0|1,0,1]=3 1535 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,1,0,0,0,0|1,0,1]=3 1536 B8R0.5 CN(CCCl)CC(N)=O Amb24626078 [0,1,0,0,0,0|2,0,0]=3 1537 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,1,0,0,0,0|1,0,0]=2 1538 B8R0.5 CN(CCF)CC(N)=S Amb24392584 [0,1,0,0,0,0|2,1,0]=4 1539 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,1,0,0,0,0|1,0,0]=2 1540 B8R0.5 CN(CCI)CC(N)=O Amb25042038 [0,1,0,0,0,0|2,0,0]=3 1541 B8R0.5 CN(CCN)CC(=C)Br Amb19028446 [0,1,0,0,0,0|3,0,0]=4 1542 B8R0.5 CN(CCN)CC(=C)Cl Amb18313574 [0,1,0,0,0,0|3,0,0]=4 1543 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,1,0,0,0,0|1,0,0]=2 1544 B8R0.5 CN(CCO)CC(=C)Br Amb19079908 [0,1,0,0,0,0|3,0,0]=4 1545 B8R0.5 CN(CCO)CC(=C)Cl Amb25229314 [0,1,0,0,0,0|3,0,0]=4 1546 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,1,0,0,0,0|0,0,0]=1 1547 B8R0.5 CNCC(C)CN(C)C Amb19021215 [0,1,0,0,0,0|3,0,0]=4 1548 B8R0.5 CNCC(C)NC(C)=O Amb25834936 [0,1,0,0,0,0|2,0,0]=3 1549 B8R0.5 CNNC(=N)CC(O)=O Amb25226519 [0,1,0,0,0,0|2,0,1]=4 1550 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,1,0,0,0,0|1,0,1]=3 1552 B8R0.5 COCC(C)C=C(Br)Br Amb24481959 [0,1,0,0,0,0|2,0,1]=4 1553 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,1,0,0,0,0|0,0,0]=1 1554 B8R0.5 COCC(C)CN(C)N Amb24495578 [0,1,0,0,0,0|3,0,0]=4 1555 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,1,0,0,0,0|2,0,0]=3 1556 B8R0.5 COCC(C)SC(N)=N Amb25853833 [0,1,0,0,0,0|3,0,0]=4 1557 B8R0.5 COCC(Cl)CC(=O)Cl Amb25059197 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,1,0,0,0,0|1,0,0]=2 1559 B8R0.5 COCC(O)CC(C)=C Amb25716730 [0,1,0,0,0,0|3,0,0]=4 1560 B8R0.5 COCC(O)CC(N)=N Amb24665644 [0,1,0,0,0,0|3,0,0]=4 1561 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,1,0,0,0,0|1,0,0]=2 1562 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,1,0,0,0,0|0,0,0]=1 1563 B8R0.5 COC[C@@H](C)NC(C)=O Amb24477698 [0,1,0,0,0,0|2,0,0]=3 1564 B8R0.5 COC[C@@H](C)NC(N)=O Amb24718117 [0,1,0,0,0,0|2,0,0]=3 1565 B8R0.5 COC[C@H](C)N=C(N)N Amb24552323 [0,1,0,0,0,0|3,0,0]=4 1566 B8R0.5 COC[C@H](C)NC(C)=O Amb24477723 [0,1,0,0,0,0|2,0,0]=3 1567 B8R0.5 CS(=O)CC(N)CCO Amb25711601 [0,1,0,0,0,0|3,0,0]=4 1568 B8R0.5 CS(=O)CC(O)CCN Amb25272158 [0,1,0,0,0,0|3,0,0]=4 1569 B8R0.5 CSCC(C)NC(C)=N Amb25032327 [0,1,0,0,0,0|3,0,0]=4 1570 B8R0.5 CSCC(C)NC(C)=O Amb24481592 [0,1,0,0,0,0|2,0,0]=3 1571 B8R0.5 CSCC(C)NC(N)=S Amb25032326 [0,1,0,0,0,0|2,1,0]=4 1572 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,1,0,0,0,0|2,0,0]=3 1573 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,1,0,0,0,0|1,0,0]=2 1574 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [0,1,0,0,0,0|2,0,0]=3 1575 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,1,0,0,0,0|1,0,0]=2 1576 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,1,0,0,0,0|1,0,0]=2 1577 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,1,0,0,0,0|2,0,1]=4 1578 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,1,0,0,0,0|0,0,0]=1 1579 B8R0.5 C[C@@H](CCO)CC(C)=C Amb25187356 [0,1,0,0,0,0|2,0,0]=3 1580 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,1,0,0,0,0|0,0,0]=1 1581 B8R0.5 C[C@@H](CCO)NC(C)=O Amb25140356 [0,1,0,0,0,0|2,0,0]=3 1582 B8R0.5 C[C@@H](CCO)NC(N)=O Amb24676501 [0,1,0,0,0,0|2,0,0]=3 1583 B8R0.5 C[C@@H](O)C[C@@H](O)CCBr Amb24692601 [0,1,0,0,0,0|2,0,1]=4 1584 B8R0.5 C[C@@H](O)C[C@@H](S)CCC Amb25107605 [0,1,0,0,0,0|2,0,1]=4 1585 B8R0.5 C[C@H](CC#N)NC(C)=O Amb24381940 [0,1,0,0,0,0|2,0,1]=4 1586 B8R0.5 C[C@H](CC=O)CC(C)=C Amb25680323 [0,1,0,0,0,0|2,0,1]=4 1587 B8R0.5 C[C@H](CCO)CC(C)=C Amb24362138 [0,1,0,0,0,0|2,0,0]=3 1588 B8R0.5 C[C@H](CCO)NC(N)=O Amb24690086 [0,1,0,0,0,0|2,0,0]=3 1589 B8R0.5 C[C@H](O)C[C@H](O)CCC Amb25272245 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.5 C[C@H](O)C[C@H](O)COC Amb25688669 [0,1,0,0,0,0|2,0,1]=4 1591 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,1,0,0,0,0|0,0,2]=3 1592 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [0,1,0,0,0,0|1,0,2]=4 1593 B8R0.5 C\C(=C/C(C)=O)\SCC Amb25031784 [0,1,0,0,0,0|1,0,2]=4 1594 B8R0.5 C\C(=C/C(O)=O)\C#CC Amb24644658 [0,1,0,0,0,0|0,0,3]=4 1595 B8R0.5 C\C(=C/CC)\NC(N)=O Amb24657227 [0,1,0,0,0,0|2,0,1]=4 1596 B8R0.5 C\C(=C\C(C)=O)\NCC Amb20241597 [0,1,0,0,0,0|1,0,2]=4 1597 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [0,1,0,0,0,0|1,0,2]=4 1598 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [0,1,0,0,0,0|0,0,2]=3 1599 B8R0.5 C\C(=C\CC)\NC(N)=O Amb24680900 [0,1,0,0,0,0|2,0,1]=4 1600 B8R0.5 C\C(\CC(C)=O)=C/OC Amb24334053 [0,1,0,0,0,0|1,0,2]=4 1601 B8R0.5 C\C(\CC(C)=O)=C\OC Amb24580390 [0,1,0,0,0,0|1,0,2]=4 1602 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,1,0,0,0,0|0,0,1]=2 1603 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,1,0,0,0,0|0,0,1]=2 1604 B8R0.5 C\C(\CC(O)=O)=C\CS Amb18124785 [0,1,0,0,0,0|0,0,2]=3 1605 B8R0.5 C\C(\CC=C)=C\C(O)=O Amb25810544 [0,1,0,0,0,0|0,0,3]=4 1606 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,1,0,0,0,0|0,0,2]=3 1607 B8R0.5 C\C(\CNC)=C/C(O)=O Amb24384927 [0,1,0,0,0,0|0,0,2]=3 1608 B8R0.5 C\C=C\C(C)CC(C)=O Amb25211017 [0,1,0,0,0,0|1,0,1]=3 1609 B8R0.5 C\C=C\C(C)CC(C)O Amb25136258 [0,1,0,0,0,0|1,0,2]=4 1610 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,1,0,0,0,0|0,0,1]=2 1611 B8R0.5 C\C=C\C(C)OC(C)=O Amb24678106 [0,1,0,0,0,0|2,0,1]=4 1612 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,1,0,0,0,0|2,0,1]=4 1613 B8R0.5 C\C=C\C(O)CC(C)=O Amb24676886 [0,1,0,0,0,0|2,0,1]=4 1614 B8R0.5 C\C=C\C(O)CC(N)=O Amb24567413 [0,1,0,0,0,0|2,0,1]=4 1615 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,1,0,0,0,0|0,0,1]=2 1616 B8R0.5 C\C=C\[C@@H](O)CC(C)=O Amb25143519 [0,1,0,0,0,0|2,0,1]=4 1617 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,1,0,0,0,0|1,0,1]=3 1618 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,1,0,0,0,0|1,0,1]=3 1619 B8R0.5 N#CCS(=O)CC(O)=O Amb18984975 [0,1,0,0,0,0|2,0,1]=4 1620 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,1,0,0,0,0|1,0,1]=3 1621 B8R0.5 NC(=O)CS(=O)CCCl Amb24751567 [0,1,0,0,0,0|3,0,0]=4 1622 B8R0.5 NC(=O)CS(=O)CCO Amb24502237 [0,1,0,0,0,0|3,0,0]=4 1623 B8R0.5 NC(=O)C[C@@H](O)CC#N Amb22226710 [0,1,0,0,0,0|2,0,1]=4 1624 B8R0.5 NC(=O)C[C@H](O)CC#N Amb22225367 [0,1,0,0,0,0|2,0,1]=4 1625 B8R0.5 NCCC(CN(C)C)C Amb17334120 [0,1,0,0,0,0|3,0,0]=4 1626 B8R0.5 NCCC(O)CP(O)=O Amb25708296 [0,1,0,0,0,0|2,0,0]=3 1627 B8R0.5 NCCS(=O)CC(O)=O Amb25124054 [0,1,0,0,0,0|2,0,0]=3 1628 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,1,0,0,0,0|1,0,0]=2 1629 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,1,0,0,0,0|1,0,0]=2 1630 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,1,0,0,0,0|1,0,0]=2 1631 B8R0.5 OC(=O)CS(=O)CCF Amb25094766 [0,1,0,0,0,0|2,0,0]=3 1632 B8R0.5 OCCN(CC(=O)C)C Amb10608107 [0,1,0,0,0,0|2,0,0]=3 1633 B8R0.5 OCCN(CC(=O)Cl)C Amb17142874 [0,1,0,0,0,0|2,0,0]=3 1634 B8R0.5 OCCN(CC(=O)N)C Amb17142858 [0,1,0,0,0,0|2,0,0]=3 1635 B8R0.5 OCCN(CC(=S)N)C Amb17120471 [0,1,0,0,0,0|2,1,0]=4 1636 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [0,1,0,0,0,0|1,0,2]=4 1637 B8R0.16 C=CC(CC(O)=O)C=C Amb18642422 [0,1,0,0,0,0|0,0,3]=4 1638 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,1,0,0,0,0|0,0,2]=3 1639 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,1,0,0,0,0|0,0,2]=3 1640 B8R0.16 CC(=C)CC(CO)CO Amb24464721 [0,1,0,0,0,0|3,0,0]=4 1641 B8R0.16 CC(=C)CN(CC)CC Amb25341066 [0,1,0,0,0,0|3,0,0]=4 1642 B8R0.16 CC(=O)C=C(CC)CC Amb24551516 [0,1,0,0,0,0|1,0,2]=4 1643 B8R0.16 CC(=O)C=C(CC)OC Amb24529216 [0,1,0,0,0,0|1,0,2]=4 1644 B8R0.16 CC(=O)CC(CC)=CC Amb24551554 [0,1,0,0,0,0|1,0,1]=3 1645 B8R0.16 CC(=O)CC(CC)CC Amb25791160 [0,1,0,0,0,0|1,0,0]=2 1646 B8R0.16 CC(=O)CC(SC)SC Amb24689832 [0,1,0,0,0,0|2,0,0]=3 1647 B8R0.16 CC(=O)NC(CO)CO Amb25127062 [0,1,0,0,0,0|3,0,0]=4 1648 B8R0.16 CC(=O)NC(CO)CS Amb25685905 [0,1,0,0,0,0|3,0,0]=4 1649 B8R0.16 CC(=O)N\C(\CC)=C\C Amb24559223 [0,1,0,0,0,0|2,0,1]=4 1650 B8R0.16 CC(=O)OB(CC)CC Amb24606030 [0,1,0,0,0,0|3,0,0]=4 1651 B8R0.16 CC(=O)OC(CC)CC Amb24617396 [0,1,0,0,0,0|2,0,0]=3 1652 B8R0.16 CC(=O)OC(CN)CO Amb25663259 [0,1,0,0,0,0|3,0,0]=4 1653 B8R0.16 CC(=O)OC(CO)CO Amb24479923 [0,1,0,0,0,0|3,0,0]=4 1654 B8R0.16 CC(=O)OC(CS)CBr Amb24446024 [0,1,0,0,0,0|3,0,0]=4 1655 B8R0.16 CC(=O)OC(CS)CCl Amb24584930 [0,1,0,0,0,0|3,0,0]=4 1656 B8R0.16 CC(=O)OC(OC)OC Amb25229616 [0,1,0,0,0,0|3,0,0]=4 1657 B8R0.16 CC(=O)O[C@@H](CCl)CBr Amb25053056 [0,1,0,0,0,0|3,0,0]=4 1658 B8R0.16 CC(=O)SC(CCl)CCl Amb24479930 [0,1,0,0,0,0|3,0,0]=4 1659 B8R0.16 CC(=O)SC(CN)CN Amb24117511 [0,1,0,0,0,0|3,0,0]=4 1660 B8R0.16 CC(=O)\C=C(/CC)\OC Amb24580486 [0,1,0,0,0,0|1,0,2]=4 1661 B8R0.16 CC(C)CC(CBr)CC Amb25740694 [0,1,0,0,0,0|2,0,1]=4 1662 B8R0.16 CC(C)CC(CN)CC Amb19026794 [0,1,0,0,0,0|2,0,1]=4 1663 B8R0.16 CC(C)CC(CO)CC Amb22641858 [0,1,0,0,0,0|2,0,1]=4 1664 B8R0.16 CC(C)C[C@@H](CN)CC Amb24476608 [0,1,0,0,0,0|2,0,1]=4 1665 B8R0.16 CC(C)C[C@H](CO)CC Amb24657452 [0,1,0,0,0,0|2,0,1]=4 1666 B8R0.16 CC(N)CC(CC)CC Amb24559666 [0,1,0,0,0,0|2,0,1]=4 1667 B8R0.16 CC(O)CC(CC)C#N Amb18642540 [0,1,0,0,0,0|1,0,2]=4 1668 B8R0.16 CC(O)CC(CC)C=O Amb24669026 [0,1,0,0,0,0|1,0,2]=4 1669 B8R0.16 CC(O)CC(CO)OC Amb25306517 [0,1,0,0,0,0|2,0,1]=4 1670 B8R0.16 CC(O)CC(OC)OC Amb22728270 [0,1,0,0,0,0|2,0,1]=4 1671 B8R0.16 CCC(C#C)NC(C)=O Amb25102560 [0,1,0,0,0,0|2,0,1]=4 1672 B8R0.16 CCC(C#N)NC(N)=O Amb25337865 [0,1,0,0,0,0|2,0,1]=4 1673 B8R0.16 CCC(C#N)OC(C)=O Amb24593580 [0,1,0,0,0,0|2,0,1]=4 1674 B8R0.16 CCC(C=C(C)C)NC Amb24532848 [0,1,0,0,0,0|2,0,1]=4 1675 B8R0.16 CCC(C=C)OC(C)=O Amb24325174 [0,1,0,0,0,0|2,0,1]=4 1676 B8R0.16 CCC(C=O)OC(C)=O Amb18642754 [0,1,0,0,0,0|2,0,1]=4 1677 B8R0.16 CCC(CB(O)O)CC Amb24360547 [0,1,0,0,0,0|1,0,1]=3 1678 B8R0.16 CCC(CBr)NC(C)=O Amb25725356 [0,1,0,0,0,0|2,0,0]=3 1679 B8R0.16 CCC(CC(=C)Cl)C=O Amb25689367 [0,1,0,0,0,0|2,0,1]=4 1680 B8R0.16 CCC(CC(=O)Cl)CCl Amb25189070 [0,1,0,0,0,0|1,0,0]=2 1681 B8R0.16 CCC(CC(C)=C)C=O Amb24636947 [0,1,0,0,0,0|2,0,1]=4 1682 B8R0.16 CCC(CC(C)=O)C#N Amb18642298 [0,1,0,0,0,0|1,0,1]=3 1683 B8R0.16 CCC(CC(C)=O)C=O Amb18642641 [0,1,0,0,0,0|1,0,1]=3 1684 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,1,0,0,0,0|1,0,0]=2 1685 B8R0.16 CCC(CC(C)=O)SC Amb24467065 [0,1,0,0,0,0|1,0,0]=2 1686 B8R0.16 CCC(CC(N)=N)CC Amb25213951 [0,1,0,0,0,0|2,0,0]=3 1687 B8R0.16 CCC(CC(N)=O)=CC Amb24610057 [0,1,0,0,0,0|1,0,1]=3 1688 B8R0.16 CCC(CC(N)=O)C#N Amb25366882 [0,1,0,0,0,0|1,0,1]=3 1689 B8R0.16 CCC(CC(N)=O)C=C Amb25691393 [0,1,0,0,0,0|1,0,1]=3 1690 B8R0.16 CCC(CC(N)=S)CC Amb24642789 [0,1,0,0,0,0|1,1,0]=3 1691 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,1,0,0,0,0|0,0,1]=2 1692 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,1,0,0,0,0|0,0,1]=2 1693 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,1,0,0,0,0|0,0,0]=1 1694 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,1,0,0,0,0|0,0,0]=1 1695 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,1,0,0,0,0|0,0,0]=1 1696 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,1,0,0,0,0|0,0,0]=1 1697 B8R0.16 CCC(CC)C=C(Br)Br Amb24514976 [0,1,0,0,0,0|2,0,1]=4 1698 B8R0.16 CCC(CC)NC(N)=N Amb25770424 [0,1,0,0,0,0|3,0,0]=4 1699 B8R0.16 CCC(CC)OC(N)=O Amb24614586 [0,1,0,0,0,0|2,0,0]=3 1700 B8R0.16 CCC(CC)O[N+]([O-])=O Amb25705269 [0,1,0,0,0,0|2,0,1]=4 1701 B8R0.16 CCC(CCl)C=C(Cl)Cl Amb25241865 [0,1,0,0,0,0|2,0,1]=4 1702 B8R0.16 CCC(CCl)N=C(C)Cl Amb24562848 [0,1,0,0,0,0|3,0,0]=4 1703 B8R0.16 CCC(CCl)N=C(Cl)Cl Amb24479978 [0,1,0,0,0,0|3,0,0]=4 1704 B8R0.16 CCC(CN(C)C)NC Amb24458830 [0,1,0,0,0,0|3,0,0]=4 1705 B8R0.16 CCC(CN(C)C)OC Amb24584936 [0,1,0,0,0,0|3,0,0]=4 1706 B8R0.16 CCC(CN)CC(C)=C Amb24359882 [0,1,0,0,0,0|2,0,0]=3 1707 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,1,0,0,0,0|0,0,0]=1 1708 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,1,0,0,0,0|0,0,0]=1 1709 B8R0.16 CCC(CN)CN(C)C Amb25146879 [0,1,0,0,0,0|3,0,0]=4 1710 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,1,0,0,0,0|2,0,0]=3 1711 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,1,0,0,0,0|2,0,0]=3 1712 B8R0.16 CCC(CO)CC(C)=C Amb25219191 [0,1,0,0,0,0|2,0,0]=3 1713 B8R0.16 CCC(CO)CN(C)C Amb25716404 [0,1,0,0,0,0|3,0,0]=4 1714 B8R0.16 CCC(CO)NC(C)=S Amb25258075 [0,1,0,0,0,0|2,1,0]=4 1715 B8R0.16 CCC(CS)NC(N)=N Amb25786050 [0,1,0,0,0,0|3,0,0]=4 1716 B8R0.16 CCC(C[N+]([O-])=O)CC Amb25174023 [0,1,0,0,0,0|1,0,1]=3 1717 B8R0.16 CCC(NC(=O)N)CC Amb1138537 [0,1,0,0,0,0|2,0,0]=3 1718 B8R0.16 CCN(CC(=C)Br)OC Amb24476750 [0,1,0,0,0,0|3,0,0]=4 1719 B8R0.16 CCN(CC(O)=O)C=O Amb18972736 [0,1,0,0,0,0|1,0,1]=3 1720 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [0,1,0,0,0,0|1,0,0]=2 1721 B8R0.16 CCN(CC([O-])=O)CC Amb22732183 [0,1,0,0,0,0|1,0,1]=3 1722 B8R0.16 CCN(CC)OC(N)=O Amb24359821 [0,1,0,0,0,0|3,0,0]=4 1723 B8R0.16 CCP(CC(N)=O)CC Amb24383719 [0,1,0,0,0,0|2,0,0]=3 1724 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [0,1,0,0,0,0|1,0,0]=2 1725 B8R0.16 CC[C@@H](C=O)NC(C)=O Amb25064294 [0,1,0,0,0,0|2,0,1]=4 1726 B8R0.16 CC[C@@H](CC(N)=O)C=C Amb24476683 [0,1,0,0,0,0|1,0,1]=3 1727 B8R0.16 CC[C@@H](CN)CC(C)=C Amb24393061 [0,1,0,0,0,0|2,0,0]=3 1728 B8R0.16 CC[C@@H](CO)NC(N)=N Amb25169417 [0,1,0,0,0,0|3,0,0]=4 1729 B8R0.16 CC[C@@H](CO)\C=C(\C)/Br Amb24352998 [0,1,0,0,0,0|2,0,1]=4 1730 B8R0.16 CC[C@@H](CS)NC(N)=N Amb25145973 [0,1,0,0,0,0|3,0,0]=4 1731 B8R0.16 CC[C@H](C#N)NC(C)=O Amb24476725 [0,1,0,0,0,0|2,0,1]=4 1732 B8R0.16 CC[C@H](C=O)NC(C)=O Amb24476942 [0,1,0,0,0,0|2,0,1]=4 1733 B8R0.16 CC[C@H](CC(C)=C)C=O Amb25833659 [0,1,0,0,0,0|2,0,1]=4 1734 B8R0.16 CC[C@H](CC(C)=O)C=O Amb25687293 [0,1,0,0,0,0|1,0,1]=3 1735 B8R0.16 CC[C@H](CO)NC(C)=O Amb24444629 [0,1,0,0,0,0|2,0,0]=3 1736 B8R0.16 CC[C@H](CO)NC(C)=S Amb24477766 [0,1,0,0,0,0|2,1,0]=4 1737 B8R0.16 CC[C@H](CO)NC(N)=N Amb24672152 [0,1,0,0,0,0|3,0,0]=4 1738 B8R0.16 CC[C@H](CO)NS(C)=O Amb24570649 [0,1,0,0,0,0|3,0,0]=4 1739 B8R0.16 CC[C@H](CS)NC(N)=N Amb24599971 [0,1,0,0,0,0|3,0,0]=4 1740 B8R0.16 CC\C(\C=C)=C/C(O)=O Amb25368328 [0,1,0,0,0,0|0,0,3]=4 1741 B8R0.16 CC\C(\C=O)=C/C(O)=O Amb18642578 [0,1,0,0,0,0|0,0,3]=4 1742 B8R0.16 CC\C(\C=O)=C\C(O)=O Amb25770561 [0,1,0,0,0,0|0,0,3]=4 1743 B8R0.16 CC\C(\CC(O)=O)=C/C Amb18642626 [0,1,0,0,0,0|0,0,1]=2 1744 B8R0.16 CC\[N+](\CC(O)=O)=N\[O-] Amb25365958 [0,1,0,0,0,0|2,0,0]=3 1745 B8R0.16 CNC(CN(=O)=O)SC Amb20621640 [0,1,0,0,0,0|2,0,1]=4 1746 B8R0.16 COC(CBr)OC(C)=O Amb25797965 [0,1,0,0,0,0|3,0,0]=4 1747 B8R0.16 COC(CC(=O)N)OC Amb2417314 [0,1,0,0,0,0|2,0,0]=3 1748 B8R0.16 COC(CC(C)=O)C=O Amb25798334 [0,1,0,0,0,0|2,0,1]=4 1749 B8R0.16 COC(CC(O)=O)C=C Amb18642791 [0,1,0,0,0,0|0,0,2]=3 1750 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,1,0,0,0,0|1,0,0]=2 1751 B8R0.16 COC(CC(O)=O)OC Amb22231899 [0,1,0,0,0,0|1,0,0]=2 1752 B8R0.16 COC(CC)OC(N)=O Amb25055387 [0,1,0,0,0,0|2,0,0]=3 1753 B8R0.16 COC(CCl)=CC(O)=O Amb25690575 [0,1,0,0,0,0|1,0,2]=4 1754 B8R0.16 COC(CO)CC(C)=C Amb25680510 [0,1,0,0,0,0|3,0,0]=4 1755 B8R0.16 COC(C[N+]([O-])=O)OC Amb22168374 [0,1,0,0,0,0|2,0,1]=4 1756 B8R0.16 CO[C@H](CC(O)=O)C#C Amb25773997 [0,1,0,0,0,0|0,0,2]=3 1757 B8R0.16 CO[C@H](CO)CC(C)=C Amb24592175 [0,1,0,0,0,0|3,0,0]=4 1758 B8R0.16 CSC(CC(=O)Cl)CCl Amb25321994 [0,1,0,0,0,0|2,0,0]=3 1759 B8R0.16 CSC(C[N+]([O-])=O)SC Amb24559304 [0,1,0,0,0,0|2,0,1]=4 1760 B8R0.16 C[C@H](O)CC(OC)OC Amb24404610 [0,1,0,0,0,0|2,0,1]=4 1761 B8R0.16 C[C@H](O)CN(CC)CC Amb25836101 [0,1,0,0,0,0|2,0,1]=4 1762 B8R0.16 ClCC(OC(=O)Cl)CCl Amb13952835 [0,1,0,0,0,0|3,0,0]=4 1763 B8R0.16 N#CC(CC(O)=O)C#N Amb25228388 [0,1,0,0,0,0|1,0,2]=4 1764 B8R0.16 NC(=O)OC(CCl)CCl Amb24367089 [0,1,0,0,0,0|3,0,0]=4 1765 B8R0.16 NC(=O)OC(CO)CO Amb25789555 [0,1,0,0,0,0|3,0,0]=4 1766 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [0,1,0,0,0,0|1,0,0]=2 1767 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [0,1,0,0,0,0|1,0,0]=2 1768 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [0,1,0,0,0,0|1,0,0]=2 1769 B8R0.16 OC(=O)C=C(CBr)CBr Amb24481720 [0,1,0,0,0,0|1,0,2]=4 1770 B8R0.16 OC(=O)C=C(CO)CO Amb25112732 [0,1,0,0,0,0|1,0,2]=4 1771 B8R0.16 OC(=O)CC(C=O)C=O Amb24577569 [0,1,0,0,0,0|1,0,2]=4 1772 B8R0.16 OCC(CCl)OP(O)=O Amb24480240 [0,1,0,0,0,0|3,0,0]=4 1773 B8R0.19 CC(=CC(=O)OC)NC Amb24401759 [0,1,0,0,0,0|1,0,2]=4 1774 B8R0.19 CC(=CC(=O)OC)OC Amb24534136 [0,1,0,0,0,0|1,0,2]=4 1775 B8R0.19 CC(C#N)CC(=O)NC Amb17334086 [0,1,0,0,0,0|2,0,1]=4 1776 B8R0.19 CC(C#N)CC(=O)OC Amb17334095 [0,1,0,0,0,0|1,0,1]=3 1777 B8R0.19 CC(CBr)OC(=O)CF Amb25697149 [0,1,0,0,0,0|3,0,0]=4 1778 B8R0.19 CC(CC(=C)C=O)C=O Amb24334526 [0,1,0,0,0,0|2,0,1]=4 1779 B8R0.19 CC(CC(=C)CC)CC Amb24478628 [0,1,0,0,0,0|2,0,0]=3 1780 B8R0.19 CC(CC(=O)C=C)C=C Amb25730035 [0,1,0,0,0,0|1,0,2]=4 1781 B8R0.19 CC(CC(=O)NC)NC Amb22587223 [0,1,0,0,0,0|2,0,0]=3 1782 B8R0.19 CC(CC(=O)NN)CN Amb25676980 [0,1,0,0,0,0|2,0,0]=3 1783 B8R0.19 CC(CC(=O)OC)=CBr Amb24635219 [0,1,0,0,0,0|1,0,2]=4 1784 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [0,1,0,0,0,0|0,0,2]=3 1785 B8R0.19 CC(CC(=O)OC)=CCl Amb24511859 [0,1,0,0,0,0|1,0,2]=4 1786 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [0,1,0,0,0,0|1,0,1]=3 1787 B8R0.19 CC(CC(Br)C=O)CC Amb25249112 [0,1,0,0,0,0|1,0,1]=3 1788 B8R0.19 CC(CC(C)CC)CC Amb22229085 [0,1,0,0,0,0|2,0,1]=4 1789 B8R0.19 CC(CC(Cl)C#N)CC Amb24602618 [0,1,0,0,0,0|2,0,1]=4 1790 B8R0.19 CC(CC(F)CN)CC Amb24617364 [0,1,0,0,0,0|2,0,1]=4 1791 B8R0.19 CC(CC(N)C#N)CC Amb24552597 [0,1,0,0,0,0|2,0,1]=4 1792 B8R0.19 CC(CC(N)CO)CC Amb24721873 [0,1,0,0,0,0|1,0,1]=3 1793 B8R0.19 CC(CC(O)CBr)CC Amb24480278 [0,1,0,0,0,0|1,0,1]=3 1794 B8R0.19 CC(CC(O)CC)CO Amb25706078 [0,1,0,0,0,0|2,0,1]=4 1795 B8R0.19 CC(CC(O)CC)OC Amb25314649 [0,1,0,0,0,0|2,0,1]=4 1796 B8R0.19 CC(CC(O)CCl)CC Amb24540064 [0,1,0,0,0,0|1,0,1]=3 1797 B8R0.19 CC(CC(O)CN)CC Amb25044040 [0,1,0,0,0,0|1,0,1]=3 1798 B8R0.19 CC(CC(O)CO)CC Amb24456930 [0,1,0,0,0,0|0,0,2]=3 1799 B8R0.19 CC(CC(O)CO)CO Amb25285571 [0,1,0,0,0,0|1,0,2]=4 1800 B8R0.19 CC(CC(O)OC)CC Amb25788091 [0,1,0,0,0,0|0,0,2]=3 1801 B8R0.19 CC(CC)=CC(=O)CC Amb25683797 [0,1,0,0,0,0|1,0,2]=4 1802 B8R0.19 CC(CC)=CC(=O)NC Amb25314412 [0,1,0,0,0,0|1,0,2]=4 1803 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,1,0,0,0,0|0,0,2]=3 1804 B8R0.19 CC(CC)C=C(C)CC Amb24061667 [0,1,0,0,0,0|2,0,1]=4 1805 B8R0.19 CC(CC)NS(=O)CC Amb25177264 [0,1,0,0,0,0|3,0,0]=4 1806 B8R0.19 CC(CC)\C=C(/C)\C=O Amb18642478 [0,1,0,0,0,0|1,0,1]=3 1807 B8R0.19 CC(CC)\C=C(\C)/CC Amb24640745 [0,1,0,0,0,0|2,0,1]=4 1808 B8R0.19 CC(CCl)OC(=O)CS Amb24551053 [0,1,0,0,0,0|2,1,0]=4 1809 B8R0.19 CC(CF)NC(=O)CO Amb24481944 [0,1,0,0,0,0|2,0,0]=3 1810 B8R0.19 CC(CN)CC(=O)C=C Amb24698166 [0,1,0,0,0,0|2,0,0]=3 1811 B8R0.19 CC(CN)NC(=O)C#C Amb18251099 [0,1,0,0,0,0|3,0,0]=4 1812 B8R0.19 CC(CN)NC(=O)C=C Amb18908294 [0,1,0,0,0,0|3,0,0]=4 1813 B8R0.19 CC(CO)CC(=O)NN Amb25692312 [0,1,0,0,0,0|2,0,0]=3 1814 B8R0.19 CC(CO)CC(C)C=O Amb24340208 [0,1,0,0,0,0|2,0,1]=4 1815 B8R0.19 CC(CO)CC(N)CC Amb19149274 [0,1,0,0,0,0|2,0,1]=4 1816 B8R0.19 CC(CO)NC(=O)CBr Amb25765598 [0,1,0,0,0,0|3,0,0]=4 1817 B8R0.19 CC(CO)NC(=O)CCl Amb18791488 [0,1,0,0,0,0|3,0,0]=4 1818 B8R0.19 CC(CO)\C=C(/C)\C=O Amb25758939 [0,1,0,0,0,0|2,0,1]=4 1819 B8R0.19 CC(CO)\C=C(\C)/CO Amb24719589 [0,1,0,0,0,0|2,0,1]=4 1820 B8R0.19 CC(CS(=O)CC)CC Amb24333813 [0,1,0,0,0,0|2,0,0]=3 1821 B8R0.19 CCC(=C)CC(=O)C#N Amb24690781 [0,1,0,0,0,0|1,0,2]=4 1822 B8R0.19 CCC(=C)CC(=O)C=C Amb24638472 [0,1,0,0,0,0|1,0,2]=4 1823 B8R0.19 CCC(=C)CC(=O)CN Amb25329097 [0,1,0,0,0,0|1,0,2]=4 1824 B8R0.19 CCC(=C)CC(Cl)CC Amb25725705 [0,1,0,0,0,0|3,0,0]=4 1825 B8R0.19 CCC(=C)CC(N)CC Amb24392905 [0,1,0,0,0,0|3,0,0]=4 1826 B8R0.19 CCC(=C)CC(O)CC Amb24478745 [0,1,0,0,0,0|3,0,0]=4 1827 B8R0.19 CCC(=C)C[C@H](C)CO Amb25239868 [0,1,0,0,0,0|3,0,0]=4 1828 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [0,1,0,0,0,0|2,0,1]=4 1829 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,1,0,0,0,0|1,0,1]=3 1830 B8R0.19 CCC(=O)CC(C)C#N Amb18642307 [0,1,0,0,0,0|2,0,1]=4 1831 B8R0.19 CCC(=O)CC(C)C=O Amb18642639 [0,1,0,0,0,0|2,0,1]=4 1832 B8R0.19 CCC(=O)CC(C)CN Amb24690163 [0,1,0,0,0,0|2,0,0]=3 1833 B8R0.19 CCC(=O)CC(C)CO Amb25050722 [0,1,0,0,0,0|2,0,0]=3 1834 B8R0.19 CCC(=O)CC(Cl)CBr Amb25062486 [0,1,0,0,0,0|3,0,0]=4 1835 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [0,1,0,0,0,0|2,0,0]=3 1836 B8R0.19 CCC(=O)CC(O)OC Amb25065360 [0,1,0,0,0,0|3,0,0]=4 1837 B8R0.19 CCC(=O)C[C@@H](O)CCl Amb24340137 [0,1,0,0,0,0|3,0,0]=4 1838 B8R0.19 CCC(=O)C[C@H](C)C#C Amb24725316 [0,1,0,0,0,0|1,0,2]=4 1839 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [0,1,0,0,0,0|2,0,0]=3 1840 B8R0.19 CCC(=O)C[C@H](O)CCl Amb25359848 [0,1,0,0,0,0|3,0,0]=4 1841 B8R0.19 CCC(=O)NC(C)CCl Amb24699423 [0,1,0,0,0,0|3,0,0]=4 1842 B8R0.19 CCC(=O)NC(C)CN Amb18251126 [0,1,0,0,0,0|3,0,0]=4 1843 B8R0.19 CCC(=O)OC(C)CCl Amb25292214 [0,1,0,0,0,0|3,0,0]=4 1844 B8R0.19 CCC(=O)OC(C)CO Amb25077934 [0,1,0,0,0,0|3,0,0]=4 1845 B8R0.19 CCC(Br)OC(=O)C=C Amb24480104 [0,1,0,0,0,0|3,0,0]=4 1846 B8R0.19 CCC(C)CC(=C)C=O Amb25131177 [0,1,0,0,0,0|1,0,0]=2 1847 B8R0.19 CCC(C)CC(=O)C#C Amb25356354 [0,1,0,0,0,0|1,0,0]=2 1848 B8R0.19 CCC(C)CC(=O)C=C Amb25134056 [0,1,0,0,0,0|1,0,0]=2 1849 B8R0.19 CCC(C)CC(=O)CBr Amb25251707 [0,1,0,0,0,0|1,0,0]=2 1850 B8R0.19 CCC(C)CC(=O)CCl Amb22395327 [0,1,0,0,0,0|1,0,0]=2 1851 B8R0.19 CCC(C)CC(=O)NN Amb24758303 [0,1,0,0,0,0|1,0,0]=2 1852 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,1,0,0,0,0|0,0,0]=1 1853 B8R0.19 CCC(C)CC(C)C=O Amb18642673 [0,1,0,0,0,0|1,0,1]=3 1854 B8R0.19 CCC(C)CC(C)CBr Amb24630146 [0,1,0,0,0,0|2,0,1]=4 1855 B8R0.19 CCC(C)CC(C)CCl Amb24644668 [0,1,0,0,0,0|2,0,1]=4 1856 B8R0.19 CCC(C)CC(C)CN Amb18312039 [0,1,0,0,0,0|2,0,1]=4 1857 B8R0.19 CCC(C)CC(C)CO Amb24574609 [0,1,0,0,0,0|1,0,1]=3 1858 B8R0.19 CCC(C)CC(C)NC Amb19026148 [0,1,0,0,0,0|2,0,1]=4 1859 B8R0.19 CCC(C)CC(C)NN Amb24683801 [0,1,0,0,0,0|2,0,1]=4 1860 B8R0.19 CCC(C)CC(Cl)=NO Amb25310366 [0,1,0,0,0,0|1,0,0]=2 1861 B8R0.19 CCC(C)CC(N)=NO Amb24415677 [0,1,0,0,0,0|1,0,0]=2 1862 B8R0.19 CCC(C)CN(C)C=O Amb24438589 [0,1,0,0,0,0|2,0,0]=3 1863 B8R0.19 CCC(C)CN(C)OC Amb25852714 [0,1,0,0,0,0|2,0,0]=3 1864 B8R0.19 CCC(C)NC(=O)CN Amb21958749 [0,1,0,0,0,0|2,0,0]=3 1865 B8R0.19 CCC(C)NC(=O)CS Amb25052738 [0,1,0,0,0,0|1,1,0]=3 1866 B8R0.19 CCC(C)NC(=O)SC Amb25145616 [0,1,0,0,0,0|1,1,0]=3 1867 B8R0.19 CCC(C)N[C@H](C)CO Amb25353052 [0,1,0,0,0,0|2,0,1]=4 1868 B8R0.19 CCC(C)OC(=O)C=C Amb22733882 [0,1,0,0,0,0|2,0,0]=3 1869 B8R0.19 CCC(C)OC(=O)C=O Amb25311231 [0,1,0,0,0,0|1,0,1]=3 1870 B8R0.19 CCC(C)OC(=O)CN Amb18307959 [0,1,0,0,0,0|2,0,0]=3 1871 B8R0.19 CCC(C)OC(=S)NN Amb24501375 [0,1,0,0,0,0|2,1,0]=4 1872 B8R0.19 CCC(C)SC(C)CO Amb24481650 [0,1,0,0,0,0|2,0,1]=4 1873 B8R0.19 CCC(C)\C=C(\C)/CN Amb25838075 [0,1,0,0,0,0|2,0,1]=4 1874 B8R0.19 CCC(Cl)OC(=O)CCl Amb25772642 [0,1,0,0,0,0|3,0,0]=4 1875 B8R0.19 CCC(N)CC(=O)C#C Amb24388579 [0,1,0,0,0,0|2,0,0]=3 1876 B8R0.19 CCC(N)CC(=O)C=C Amb25108966 [0,1,0,0,0,0|2,0,0]=3 1877 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,1,0,0,0,0|1,0,0]=2 1878 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,1,0,0,0,0|1,0,0]=2 1879 B8R0.19 CCC(N)CC(N)=NO Amb24379538 [0,1,0,0,0,0|2,0,0]=3 1880 B8R0.19 CCC(N)CC(O)CC Amb25858181 [0,1,0,0,0,0|2,0,1]=4 1881 B8R0.19 CCC(N)C\C(\C)=C\C Amb25198785 [0,1,0,0,0,0|3,0,0]=4 1882 B8R0.19 CCC(NC(=O)CBr)C Amb17331628 [0,1,0,0,0,0|2,0,0]=3 1883 B8R0.19 CCC(NC(=O)CCl)C Amb1149867 [0,1,0,0,0,0|2,0,0]=3 1884 B8R0.19 CCC(NC(=O)OC)C Amb10568221 [0,1,0,0,0,0|1,0,0]=2 1885 B8R0.19 CCC(O)CC(=C)C#C Amb24576559 [0,1,0,0,0,0|3,0,0]=4 1886 B8R0.19 CCC(O)CC(=C)C=C Amb24687988 [0,1,0,0,0,0|3,0,0]=4 1887 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,1,0,0,0,0|1,0,0]=2 1888 B8R0.19 CCC(O)CC(=S)SC Amb24688018 [0,1,0,0,0,0|1,2,0]=4 1889 B8R0.19 CCC(O)CC(C)=CC Amb24062972 [0,1,0,0,0,0|3,0,0]=4 1890 B8R0.19 CCC(O)CC(O)C=O Amb25770125 [0,1,0,0,0,0|1,0,1]=3 1891 B8R0.19 CCC(O)CC(O)CC Amb25702353 [0,1,0,0,0,0|2,0,1]=4 1892 B8R0.19 CCC(O)CN(C)OC Amb24672344 [0,1,0,0,0,0|3,0,0]=4 1893 B8R0.19 CCC(O)NC(=O)C=C Amb24477763 [0,1,0,0,0,0|3,0,0]=4 1894 B8R0.19 CCC(O)OC(=O)C=C Amb24734213 [0,1,0,0,0,0|3,0,0]=4 1895 B8R0.19 CCC(O)\C=C(\C)/CO Amb25713264 [0,1,0,0,0,0|2,0,1]=4 1896 B8R0.19 CCC(OC(=S)NC)C Amb15691687 [0,1,0,0,0,0|2,1,0]=4 1897 B8R0.19 CCN(C)CC(=C)CBr Amb25097533 [0,1,0,0,0,0|3,0,0]=4 1898 B8R0.19 CCN(C)CC(=C)CS Amb24746211 [0,1,0,0,0,0|2,1,0]=4 1899 B8R0.19 CCN(C)CC(=O)CN Amb25364572 [0,1,0,0,0,0|2,0,0]=3 1900 B8R0.19 CCN(C)CC(=O)NC Amb25304735 [0,1,0,0,0,0|2,0,0]=3 1901 B8R0.19 CCN(C)CC(=O)NN Amb19890161 [0,1,0,0,0,0|2,0,0]=3 1902 B8R0.19 CCN(C)CC(=O)NN Amb21959605 [0,1,0,0,0,0|2,0,0]=3 1903 B8R0.19 CCN(C)CC(C)=CCl Amb24480139 [0,1,0,0,0,0|3,0,0]=4 1904 B8R0.19 CCN(C)CC(O)CCl Amb24481726 [0,1,0,0,0,0|2,0,1]=4 1905 B8R0.19 CCN(O)CC(=O)OC Amb25259900 [0,1,0,0,0,0|2,0,0]=3 1906 B8R0.19 CCS(=O)CC(=O)CC Amb25361921 [0,1,0,0,0,0|3,0,0]=4 1907 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [0,1,0,0,0,0|2,0,0]=3 1908 B8R0.19 CC[C@@H](C)CC(C)C=O Amb24378509 [0,1,0,0,0,0|1,0,1]=3 1909 B8R0.19 CC[C@@H](C)C[C@H](C)C=O Amb24558292 [0,1,0,0,0,0|1,0,1]=3 1910 B8R0.19 CC[C@@H](C)NC(=O)OC Amb25368349 [0,1,0,0,0,0|1,0,0]=2 1911 B8R0.19 CC[C@@H](C)\C=C(/C)\CCl Amb24532835 [0,1,0,0,0,0|2,0,1]=4 1912 B8R0.19 CC[C@@H](C)\C=C(\C)/CO Amb25185199 [0,1,0,0,0,0|1,0,1]=3 1913 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,1,0,0,0,0|1,0,0]=2 1914 B8R0.19 CC[C@@H](N)CN(C)OC Amb25334124 [0,1,0,0,0,0|3,0,0]=4 1915 B8R0.19 CC[C@@H](N)C[C@H](O)CC Amb19929572 [0,1,0,0,0,0|2,0,1]=4 1916 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,1,0,0,0,0|1,0,0]=2 1917 B8R0.19 CC[C@@H](O)C[C@H](O)CC Amb22388488 [0,1,0,0,0,0|2,0,1]=4 1918 B8R0.19 CC[C@H](C)CC(=C)C=O Amb25309429 [0,1,0,0,0,0|1,0,0]=2 1919 B8R0.19 CC[C@H](C)CC(C)CBr Amb24552942 [0,1,0,0,0,0|2,0,1]=4 1920 B8R0.19 CC[C@H](C)C[C@@H](C)C=O Amb25195051 [0,1,0,0,0,0|1,0,1]=3 1921 B8R0.19 CC[C@H](C)C[C@@H](C)CO Amb24593564 [0,1,0,0,0,0|1,0,1]=3 1922 B8R0.19 CC[C@H](C)C[C@H](C)CO Amb24726094 [0,1,0,0,0,0|1,0,1]=3 1923 B8R0.19 CC[C@H](C)NC(=O)C=C Amb24398563 [0,1,0,0,0,0|2,0,0]=3 1924 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [0,1,0,0,0,0|1,0,0]=2 1925 B8R0.19 CC[C@H](N)C[C@H](O)CC Amb19929573 [0,1,0,0,0,0|2,0,1]=4 1926 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,1,0,0,0,0|1,0,0]=2 1927 B8R0.19 CC[C@H](O)C[C@@H](O)CC Amb24467480 [0,1,0,0,0,0|2,0,1]=4 1928 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,1,0,0,0,0|1,0,2]=4 1929 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [0,1,0,0,0,0|2,0,0]=3 1930 B8R0.19 CN(CC)CC(=O)NN Amb10608256 [0,1,0,0,0,0|2,0,0]=3 1931 B8R0.19 CN(CC)NC(=O)CC Amb24621982 [0,1,0,0,0,0|3,0,0]=4 1932 B8R0.19 CN(C[C@@H](O)CC)CC Amb24638558 [0,1,0,0,0,0|2,0,1]=4 1933 B8R0.19 CN(N=O)CC(=O)OC Amb17618624 [0,1,0,0,0,0|3,0,0]=4 1934 B8R0.19 CNC(=N)CC(C)OC Amb24452935 [0,1,0,0,0,0|3,0,0]=4 1935 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,1,0,0,0,0|2,0,1]=4 1936 B8R0.19 CNC(=O)CC(C)OC Amb24673256 [0,1,0,0,0,0|2,0,0]=3 1937 B8R0.19 CNC(=O)CC(C)SC Amb24642838 [0,1,0,0,0,0|2,0,0]=3 1938 B8R0.19 CNC(=O)CC(O)CN Amb24442697 [0,1,0,0,0,0|3,0,0]=4 1939 B8R0.19 CNC(=O)CN(C)OC Amb24619120 [0,1,0,0,0,0|3,0,0]=4 1940 B8R0.19 CNC(=O)NC(C)CF Amb24476735 [0,1,0,0,0,0|3,0,0]=4 1941 B8R0.19 CNC(=O)NC(C)CN Amb18251132 [0,1,0,0,0,0|3,0,0]=4 1942 B8R0.19 CNC(=O)NC(C)CO Amb24423704 [0,1,0,0,0,0|3,0,0]=4 1943 B8R0.19 CNC(=O)N[C@@H](C)CF Amb25829867 [0,1,0,0,0,0|3,0,0]=4 1944 B8R0.19 CNC(=O)N[C@@H](C)CO Amb24523142 [0,1,0,0,0,0|3,0,0]=4 1945 B8R0.19 CNC(=O)OC(C)CBr Amb25304309 [0,1,0,0,0,0|3,0,0]=4 1946 B8R0.19 CNC(=O)OC(C)CCl Amb24675681 [0,1,0,0,0,0|3,0,0]=4 1947 B8R0.19 CNC(=O)OC(C)CO Amb24477700 [0,1,0,0,0,0|3,0,0]=4 1948 B8R0.19 CNC(C)CC(N)=NO Amb25147148 [0,1,0,0,0,0|2,0,0]=3 1949 B8R0.19 CNC(CC(=O)NC)C Amb10608347 [0,1,0,0,0,0|2,0,0]=3 1950 B8R0.19 CN\C(=C/C(=O)OC)\C Amb2386651 [0,1,0,0,0,0|1,0,2]=4 1951 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,1,0,0,0,0|2,0,1]=4 1952 B8R0.19 COC(=O)CC(=C)CCl Amb24053257 [0,1,0,0,0,0|1,0,2]=4 1953 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [0,1,0,0,0,0|2,0,1]=4 1954 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [0,1,0,0,0,0|2,0,1]=4 1955 B8R0.19 COC(=O)CC(Br)C=O Amb18647814 [0,1,0,0,0,0|2,0,1]=4 1956 B8R0.19 COC(=O)CC(Br)CF Amb24627105 [0,1,0,0,0,0|2,0,0]=3 1957 B8R0.19 COC(=O)CC(C)C=C Amb24712566 [0,1,0,0,0,0|0,0,2]=3 1958 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,1,0,0,0,0|1,0,1]=3 1959 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,1,0,0,0,0|1,0,0]=2 1960 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,1,0,0,0,0|1,0,0]=2 1961 B8R0.19 COC(=O)CC(C)CO Amb24729571 [0,1,0,0,0,0|1,0,0]=2 1962 B8R0.19 COC(=O)CC(C)NO Amb25032324 [0,1,0,0,0,0|2,0,0]=3 1963 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,1,0,0,0,0|1,0,0]=2 1964 B8R0.19 COC(=O)CC(Cl)SCl Amb24710162 [0,1,0,0,0,0|3,0,0]=4 1965 B8R0.19 COC(=O)CC(N)C=C Amb25380673 [0,1,0,0,0,0|1,0,2]=4 1966 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,1,0,0,0,0|2,0,0]=3 1967 B8R0.19 COC(=O)CC(N)CN Amb25766036 [0,1,0,0,0,0|2,0,0]=3 1968 B8R0.19 COC(=O)CC(N)CO Amb24366077 [0,1,0,0,0,0|2,0,0]=3 1969 B8R0.19 COC(=O)CC(O)C=C Amb25746682 [0,1,0,0,0,0|1,0,2]=4 1970 B8R0.19 COC(=O)CC(O)CBr Amb25201054 [0,1,0,0,0,0|2,0,0]=3 1971 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,1,0,0,0,0|2,0,0]=3 1972 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,1,0,0,0,0|2,0,0]=3 1973 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,1,0,0,0,0|2,0,0]=3 1974 B8R0.19 COC(=O)CN(C)C#N Amb24481702 [0,1,0,0,0,0|2,0,1]=4 1975 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [0,1,0,0,0,0|2,0,1]=4 1976 B8R0.19 COC(=O)CN(C)C=O Amb22349764 [0,1,0,0,0,0|2,0,1]=4 1977 B8R0.19 COC(=O)CS(=O)CCl Amb24582180 [0,1,0,0,0,0|3,0,0]=4 1978 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,1,0,0,0,0|1,0,0]=2 1979 B8R0.19 COC(=O)C[C@@H](CO)O Amb13883661 [0,1,0,0,0,0|2,0,0]=3 1980 B8R0.19 COC(=O)C[C@@H](N)C=C Amb25704281 [0,1,0,0,0,0|1,0,2]=4 1981 B8R0.19 COC(=O)C[C@@H](O)C=C Amb24705874 [0,1,0,0,0,0|1,0,2]=4 1982 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,1,0,0,0,0|2,0,0]=3 1983 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,1,0,0,0,0|2,0,0]=3 1984 B8R0.19 COC(=O)C[C@H](C)CBr Amb25249104 [0,1,0,0,0,0|1,0,0]=2 1985 B8R0.19 COC(=O)C[C@H](N)CN Amb24360537 [0,1,0,0,0,0|2,0,0]=3 1986 B8R0.19 COC(=O)C[C@H](N)CO Amb24561636 [0,1,0,0,0,0|2,0,0]=3 1987 B8R0.19 COC(=O)C[C@H](O)C#C Amb24748370 [0,1,0,0,0,0|1,0,2]=4 1988 B8R0.19 COC(=O)C[C@H](O)C=C Amb25788939 [0,1,0,0,0,0|1,0,2]=4 1989 B8R0.19 COC(=O)NC(C)C#N Amb24604926 [0,1,0,0,0,0|2,0,1]=4 1990 B8R0.19 COC(=O)NC(C)C=C Amb25294663 [0,1,0,0,0,0|1,0,2]=4 1991 B8R0.19 COC(=O)NC(C)C=O Amb24359055 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,1,0,0,0,0|2,0,0]=3 1993 B8R0.19 COC(=O)NC(N)OC Amb24562342 [0,1,0,0,0,0|3,0,0]=4 1994 B8R0.19 COC(=O)NC(N)SC Amb24340152 [0,1,0,0,0,0|3,0,0]=4 1995 B8R0.19 COC(=O)N[C@@H](C)C#N Amb25688761 [0,1,0,0,0,0|2,0,1]=4 1996 B8R0.19 COC(=O)N[C@@H](C)CN Amb22747138 [0,1,0,0,0,0|2,0,0]=3 1997 B8R0.19 COC(=O)N[C@H](C)C#N Amb24476727 [0,1,0,0,0,0|2,0,1]=4 1998 B8R0.19 COC(=O)N[C@H](C)CO Amb24478791 [0,1,0,0,0,0|2,0,0]=3 1999 B8R0.19 COC(C)CC(=O)C#C Amb25188993 [0,1,0,0,0,0|2,0,0]=3 2000 B8R0.19 COC(C)CC(=O)C=C Amb25836096 [0,1,0,0,0,0|2,0,0]=3 2001 B8R0.19 COC(C)CC(=O)NO Amb24476739 [0,1,0,0,0,0|1,0,0]=2 2002 B8R0.19 COC(C)CC(C)CO Amb25215348 [0,1,0,0,0,0|2,0,1]=4 2003 B8R0.19 COC(C)CC(N)=NO Amb25116224 [0,1,0,0,0,0|2,0,0]=3 2004 B8R0.19 CON(C)CC(N)=NO Amb25295782 [0,1,0,0,0,0|3,0,0]=4 2005 B8R0.19 COS(=O)OC(C)CCl Amb24339412 [0,1,0,0,0,0|3,0,0]=4 2006 B8R0.19 C[C@@H](CC(=O)C=C)C=C Amb24378496 [0,1,0,0,0,0|1,0,2]=4 2007 B8R0.19 C[C@@H](CC(=O)CC)CC Amb24448957 [0,1,0,0,0,0|1,0,0]=2 2008 B8R0.19 C[C@@H](CC)NC(=S)NN Amb24574044 [0,1,0,0,0,0|2,1,0]=4 2009 B8R0.19 C[C@@H](CN)NC(=O)CN Amb25144196 [0,1,0,0,0,0|3,0,0]=4 2010 B8R0.19 C[C@@H](CO)NC(=O)CBr Amb25794836 [0,1,0,0,0,0|3,0,0]=4 2011 B8R0.19 C[C@@H](CO)NC(=O)CCl Amb22831873 [0,1,0,0,0,0|3,0,0]=4 2012 B8R0.19 C[C@@H](CO)NC(=O)CN Amb25071829 [0,1,0,0,0,0|3,0,0]=4 2013 B8R0.19 C[C@@H](CO)\C=C(\C)/CO Amb24644328 [0,1,0,0,0,0|2,0,1]=4 2014 B8R0.19 C[C@@H](C[C@@H](O)CO)CO Amb24618764 [0,1,0,0,0,0|1,0,2]=4 2015 B8R0.19 C[C@@H](C[C@H](N)CO)CC Amb25231217 [0,1,0,0,0,0|1,0,1]=3 2016 B8R0.19 C[C@H](CC(=O)CC)CC Amb24689490 [0,1,0,0,0,0|1,0,0]=2 2017 B8R0.19 C[C@H](CC(Br)C=C)CC Amb24588082 [0,1,0,0,0,0|2,0,1]=4 2018 B8R0.19 C[C@H](CC(O)C#N)CO Amb24431105 [0,1,0,0,0,0|2,0,1]=4 2019 B8R0.19 C[C@H](CC(O)C=C)CC Amb25296223 [0,1,0,0,0,0|1,0,1]=3 2020 B8R0.19 C[C@H](CN)NC(=O)C#C Amb24446307 [0,1,0,0,0,0|3,0,0]=4 2021 B8R0.19 C[C@H](CO)NC(=O)C=C Amb24478792 [0,1,0,0,0,0|3,0,0]=4 2022 B8R0.19 C[C@H](CO)NC(=O)CCl Amb25823305 [0,1,0,0,0,0|3,0,0]=4 2023 B8R0.19 C[C@H](CO)\C=C(\C)/CO Amb24645855 [0,1,0,0,0,0|2,0,1]=4 2024 B8R0.19 C[C@H](C[C@H](C)CO)CO Amb25266477 [0,1,0,0,0,0|2,0,1]=4 2025 B8R0.19 C\C(=C/C(=O)OC)\OC Amb21927982 [0,1,0,0,0,0|1,0,2]=4 2026 B8R0.19 C\C(\C=O)=C\C(O)CC Amb25205229 [0,1,0,0,0,0|2,0,1]=4 2027 B8R0.19 C\C(\CC(=O)C=C)=C\C Amb25093521 [0,1,0,0,0,0|1,0,2]=4 2028 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [0,1,0,0,0,0|1,0,2]=4 2029 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [0,1,0,0,0,0|0,0,2]=3 2030 B8R0.19 C\C(\CC(=O)OC)=C\Cl Amb25210836 [0,1,0,0,0,0|1,0,2]=4 2031 B8R0.19 C\C(\CCl)=C\C(=O)OC Amb25230685 [0,1,0,0,0,0|1,0,2]=4 2032 B8R0.19 C\C=C(\C)/CC(C)CO Amb25842247 [0,1,0,0,0,0|3,0,0]=4 2033 B8R0.19 C\C=C(\C)/C[C@H](C)CO Amb25722949 [0,1,0,0,0,0|3,0,0]=4 2034 B8R0.19 NCC(O)CC(=O)NO Amb25203640 [0,1,0,0,0,0|2,0,0]=3 2035 B8R0.19 NNC(=O)CC(O)CCl Amb19942496 [0,1,0,0,0,0|3,0,0]=4 2036 B8R0.19 NNC(=O)C[C@@H](O)CCl Amb24476045 [0,1,0,0,0,0|3,0,0]=4 2037 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,1,0,0,0,0|2,0,1]=4 2038 B8R0.19 OCC(O)CC(O)C=O Amb22731319 [0,1,0,0,0,0|2,0,1]=4 2039 B8R0.19 OC[C@@H](O)CC(=O)C=O Amb24468249 [0,1,0,0,0,0|2,0,1]=4 2040 B8R0.19 OC[C@@H](O)C[C@@H](O)C=O Amb25340462 [0,1,0,0,0,0|2,0,1]=4 2041 B8R0.19 OC[C@H](O)C[C@@H](O)C=O Amb24441617 [0,1,0,0,0,0|2,0,1]=4 2042 B8R0.19 O[C@@H](CC(=O)CO)CO Amb24387900 [0,1,0,0,0,0|2,0,0]=3 2043 B8R0.23 C=C(Br)C(O)CC(O)=O Amb24648348 [0,1,0,0,0,0|1,0,2]=4 2044 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,1,0,0,0,0|3,0,0]=4 2045 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,1,0,0,0,0|0,0,1]=2 2046 B8R0.23 CC(=C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,0|2,0,1]=4 2047 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,1,0,0,0,0|1,0,1]=3 2048 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,1,0,0,0,0|1,0,1]=3 2049 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,1,0,0,0,0|0,0,2]=3 2050 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,1,0,0,0,0|0,0,2]=3 2051 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,1,0,0,0,0|0,0,1]=2 2052 B8R0.23 CC(=O)C(C)OC(=O)Cl Amb24721759 [0,1,0,0,0,0|2,0,1]=4 2053 B8R0.23 CC(=O)C(C)SC(C)=O Amb25833387 [0,1,0,0,0,0|2,0,1]=4 2054 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,1,0,0,0,0|1,0,1]=3 2055 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|2,0,1]=4 2056 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,1,0,0,0,0|1,0,1]=3 2057 B8R0.23 CC(=O)CC(=S)C(C)C Amb24632255 [0,1,0,0,0,0|2,0,1]=4 2058 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,1,0,0,0,0|2,0,1]=4 2059 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,1,0,0,0,0|1,0,1]=3 2060 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,1,0,0,0,0|2,0,1]=4 2061 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,1,0,0,0,0|0,0,1]=2 2062 B8R0.23 CC(=O)[C@@H](C)OC(C)=O Amb25205804 [0,1,0,0,0,0|2,0,1]=4 2063 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,0|1,0,1]=3 2064 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,1,0,0,0,0|0,0,1]=2 2065 B8R0.23 CC(=O)[C@H](C)NC(C)=O Amb24072918 [0,1,0,0,0,0|2,0,1]=4 2066 B8R0.23 CC(=O)\C(\C)=C\C(O)=O Amb22359749 [0,1,0,0,0,0|0,0,3]=4 2067 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,0|0,0,0]=1 2068 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,1,0,0,0,0|0,0,2]=3 2069 B8R0.23 CC(C)C(/C)=C/C(C)=O Amb17778974 [0,1,0,0,0,0|1,0,2]=4 2070 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,1,0,0,0,0|0,0,2]=3 2071 B8R0.23 CC(C)C(=O)CC(C)=O Amb17778966 [0,1,0,0,0,0|2,0,1]=4 2072 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [0,1,0,0,0,0|2,0,0]=3 2073 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [0,1,0,0,0,0|1,0,0]=2 2074 B8R0.23 CC(C)C(C)CC(C)C Amb22729265 [0,1,0,0,0,0|2,0,1]=4 2075 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,0|1,0,0]=2 2076 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [0,1,0,0,0,0|2,0,0]=3 2077 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [0,1,0,0,0,0|2,0,0]=3 2078 B8R0.23 CC(C)C(C)O[N+]([O-])=O Amb25032143 [0,1,0,0,0,0|2,0,1]=4 2079 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,1,0,0,0,0|1,0,2]=4 2080 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [0,1,0,0,0,0|2,0,0]=3 2081 B8R0.23 CC(C)C(Cl)SC(C)=O Amb24479957 [0,1,0,0,0,0|3,0,0]=4 2082 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,1,0,0,0,0|1,0,0]=2 2083 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,1,0,0,0,0|1,0,2]=4 2084 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,1,0,0,0,0|2,0,0]=3 2085 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,1,0,0,0,0|1,1,0]=3 2086 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,0|2,0,0]=3 2087 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [0,1,0,0,0,0|3,0,0]=4 2088 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,1,0,0,0,0|1,0,2]=4 2089 B8R0.23 CC(C)C(O)CC(C)=C Amb22228361 [0,1,0,0,0,0|3,0,0]=4 2090 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [0,1,0,0,0,0|2,0,0]=3 2091 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [0,1,0,0,0,0|2,0,0]=3 2092 B8R0.23 CC(C)C(O)C[N+]([O-])=O Amb25176366 [0,1,0,0,0,0|2,0,1]=4 2093 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [0,1,0,0,0,0|2,0,0]=3 2094 B8R0.23 CC(C)CC(C)C(C)Br Amb18330279 [0,1,0,0,0,0|2,0,1]=4 2095 B8R0.23 CC(C)CC(C)C(C)Cl Amb24524147 [0,1,0,0,0,0|2,0,1]=4 2096 B8R0.23 CC(C)CC(C)C(C)N Amb18289569 [0,1,0,0,0,0|2,0,1]=4 2097 B8R0.23 CC(C)N(C)CC(C)=O Amb22587141 [0,1,0,0,0,0|2,0,0]=3 2098 B8R0.23 CC(C)N(C)CC(N)=O Amb24384718 [0,1,0,0,0,0|2,0,0]=3 2099 B8R0.23 CC(C)N(C)C[C@@H](C)O Amb24502340 [0,1,0,0,0,0|2,0,1]=4 2100 B8R0.23 CC(C)N(C)C[C@H](C)O Amb24616788 [0,1,0,0,0,0|2,0,1]=4 2101 B8R0.23 CC(C)N(O)CC(N)=O Amb24481943 [0,1,0,0,0,0|3,0,0]=4 2102 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [0,1,0,0,0,0|3,0,0]=4 2103 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,1,0,0,0,0|1,0,0]=2 2104 B8R0.23 CC(C)[C@@H](O)CC(C)=C Amb25069574 [0,1,0,0,0,0|3,0,0]=4 2105 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [0,1,0,0,0,0|2,0,0]=3 2106 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,1,0,0,0,0|1,0,0]=2 2107 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [0,1,0,0,0,0|1,0,0]=2 2108 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [0,1,0,0,0,0|3,0,0]=4 2109 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,0|2,0,0]=3 2110 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,1,0,0,0,0|1,0,0]=2 2111 B8R0.23 CC(C)[C@H](O)CC(C)=C Amb25721776 [0,1,0,0,0,0|3,0,0]=4 2112 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [0,1,0,0,0,0|2,0,0]=3 2113 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,1,0,0,0,0|1,0,0]=2 2114 B8R0.23 CC(C)[C@H](O)C[C@@H](C)O Amb25229464 [0,1,0,0,0,0|2,0,1]=4 2115 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,1,0,0,0,0|1,0,2]=4 2116 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,1,0,0,0,0|2,0,1]=4 2117 B8R0.23 CC(CC(C)=C)C(C)N Amb25136931 [0,1,0,0,0,0|2,0,0]=3 2118 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,1,0,0,0,0|1,0,0]=2 2119 B8R0.23 CC(CC(C)=O)S(C)=O Amb25712236 [0,1,0,0,0,0|2,0,0]=3 2120 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,1,0,0,0,0|1,0,2]=4 2121 B8R0.23 CC(CC(N)=O)C(N)=N Amb25325023 [0,1,0,0,0,0|2,0,1]=4 2122 B8R0.23 CC(CC(O)=O)=P(O)=O Amb25264110 [0,1,0,0,0,0|2,0,1]=4 2123 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,0|0,0,0]=1 2124 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,1,0,0,0,0|1,0,1]=3 2125 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,1,0,0,0,0|1,0,0]=2 2126 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,1,0,0,0,0|1,0,0]=2 2127 B8R0.23 CC(CC([O-])=O)S([O-])=O Amb22470749 [0,1,0,0,0,0|2,0,1]=4 2128 B8R0.23 CC(CN(C(C)C)C)O Amb17334133 [0,1,0,0,0,0|2,0,1]=4 2129 B8R0.23 CC(CN(C)C)C(C)Cl Amb24710170 [0,1,0,0,0,0|3,0,0]=4 2130 B8R0.23 CC(CN(C)C)C(C)N Amb18642823 [0,1,0,0,0,0|3,0,0]=4 2131 B8R0.23 CC(N(C)C)CC(=O)N Amb17231867 [0,1,0,0,0,0|2,0,0]=3 2132 B8R0.23 CC(N(C)C)CC(=S)N Amb17232023 [0,1,0,0,0,0|2,1,0]=4 2133 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,1,0,0,0,0|1,0,0]=2 2134 B8R0.23 CC(N)=[N+](C)CC([O-])=O Amb25339595 [0,1,0,0,0,0|1,0,2]=4 2135 B8R0.23 CC(N)C(=O)CC(N)=O Amb24712024 [0,1,0,0,0,0|2,0,1]=4 2136 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,1,0,0,0,0|2,0,0]=3 2137 B8R0.23 CC(NC(C)=O)N(C)C Amb25064332 [0,1,0,0,0,0|3,0,0]=4 2138 B8R0.23 CC(NS(C)=O)C(C)O Amb24737712 [0,1,0,0,0,0|3,0,0]=4 2139 B8R0.23 CC(O)C(C)CC(C)O Amb25308000 [0,1,0,0,0,0|1,0,1]=3 2140 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,0|0,0,0]=1 2141 B8R0.23 CC(O)C(O)CC(C)=C Amb24740055 [0,1,0,0,0,0|3,0,0]=4 2142 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,1,0,0,0,0|2,0,0]=3 2143 B8R0.23 CC(OC(C)=O)C(C)Br Amb25321799 [0,1,0,0,0,0|2,0,0]=3 2144 B8R0.23 CC(OC(C)=O)C(C)Cl Amb24480182 [0,1,0,0,0,0|2,0,0]=3 2145 B8R0.23 CC(OC(N)=O)C(Cl)Cl Amb25073848 [0,1,0,0,0,0|3,0,0]=4 2146 B8R0.23 CC(OC(N)=O)N(C)C Amb24616794 [0,1,0,0,0,0|3,0,0]=4 2147 B8R0.23 CC(OP(=O)S)C(C)O Amb24421629 [0,1,0,0,0,0|2,1,0]=4 2148 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,1,0,0,0,0|2,0,0]=3 2149 B8R0.23 CC(SC(N)=N)C(C)O Amb25858544 [0,1,0,0,0,0|3,0,0]=4 2150 B8R0.23 CC(SC(N)=S)C(C)O Amb25147127 [0,1,0,0,0,0|2,1,0]=4 2151 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,1,0,0,0,0|0,0,2]=3 2152 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,1,0,0,0,0|2,0,1]=4 2153 B8R0.23 CN(CC(C(O)C)C)C Amb17593384 [0,1,0,0,0,0|3,0,0]=4 2154 B8R0.23 CN(CC(O)=O)C(N)=N Amb22002328 [0,1,0,0,0,0|2,0,1]=4 2155 B8R0.23 CN(CC(O)=O)C(N)=N Amb22167307 [0,1,0,0,0,0|2,0,1]=4 2156 B8R0.23 CN(CC(O)=O)C(N)=S Amb25115737 [0,1,0,0,0,0|2,0,1]=4 2157 B8R0.23 CN(CC(O)=O)[13C](N)=N Amb22367285 [0,1,0,0,0,0|2,0,1]=4 2158 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,1,0,0,0,0|2,0,1]=4 2159 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,0|0,0,0]=1 2160 B8R0.23 C[C@@H](CC(C)=C)[C@H](C)N Amb25267568 [0,1,0,0,0,0|2,0,0]=3 2161 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,1,0,0,0,0|1,0,0]=2 2162 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,1,0,0,0,0|1,0,1]=3 2163 B8R0.23 C[C@@H](Cl)[C@H](C)OC(=O)Cl Amb25765785 [0,1,0,0,0,0|2,0,0]=3 2164 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,1,0,0,0,0|1,0,0]=2 2165 B8R0.23 C[C@@H](N)[C@H](O)CP(O)=O Amb25236573 [0,1,0,0,0,0|2,0,0]=3 2166 B8R0.23 C[C@@H](NC(C)=O)[C@@H](C)Br Amb24366649 [0,1,0,0,0,0|2,0,0]=3 2167 B8R0.23 C[C@@H](NC(S)=S)[C@@H](C)N Amb25194779 [0,1,0,0,0,0|1,2,0]=4 2168 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,1,0,0,0,0|1,0,0]=2 2169 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,1,0,0,0,0|1,0,0]=2 2170 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,1,0,0,0,0|1,0,0]=2 2171 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Br Amb24480012 [0,1,0,0,0,0|2,0,0]=3 2172 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Cl Amb25146769 [0,1,0,0,0,0|2,0,0]=3 2173 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,1,0,0,0,0|2,0,0]=3 2174 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Br Amb24432955 [0,1,0,0,0,0|2,0,0]=3 2175 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Cl Amb24740430 [0,1,0,0,0,0|2,0,0]=3 2176 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)N Amb25125319 [0,1,0,0,0,0|2,0,0]=3 2177 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)O Amb25113682 [0,1,0,0,0,0|2,0,0]=3 2178 B8R0.23 C[C@H](CC(N)=O)C(N)=O Amb25126983 [0,1,0,0,0,0|2,0,1]=4 2179 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,1,0,0,0,0|2,0,1]=4 2180 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,1,0,0,0,0|1,0,1]=3 2181 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,1,0,0,0,0|1,0,0]=2 2182 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)Br Amb25075106 [0,1,0,0,0,0|2,0,0]=3 2183 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,1,0,0,0,0|2,0,0]=3 2184 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)Br Amb24480158 [0,1,0,0,0,0|2,0,0]=3 2185 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,1,0,0,0,0|2,0,0]=3 2186 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)Br Amb24558149 [0,1,0,0,0,0|2,0,0]=3 2187 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,1,0,0,0,0|2,0,0]=3 2188 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,1,0,0,0,0|0,0,2]=3 2189 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,1,0,0,0,0|0,0,2]=3 2190 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,1,0,0,0,0|0,0,2]=3 2191 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,1,0,0,0,0|0,0,2]=3 2192 B8R0.23 C\C(=C\C(C)=O)\C(C)C Amb25706913 [0,1,0,0,0,0|1,0,2]=4 2193 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,1,0,0,0,0|2,0,1]=4 2194 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,1,0,0,0,0|2,0,1]=4 2195 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,1,0,0,0,0|2,0,1]=4 2196 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,1,0,0,0,0|2,0,1]=4 2197 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,1,0,0,0,0|1,0,0]=2 2198 B8R0.23 NC(CC(N)=O)C(Cl)Cl Amb25227960 [0,1,0,0,0,0|3,0,0]=4 2199 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,1,0,0,0,0|2,0,0]=3 2200 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,1,0,0,0,0|2,0,1]=4 2201 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,1,0,0,0,0|2,0,1]=4 2202 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,1,0,0,0,0|2,0,1]=4 2203 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,1,0,0,0,0|2,0,1]=4 2204 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,1,0,0,0,0|2,0,1]=4 2205 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,1,0,0,0,0|2,0,1]=4 2206 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,1,0,0,0,0|2,0,1]=4 2207 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,1,0,0,0,0|2,0,1]=4 2208 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,1,0,0,0,0|2,0,1]=4 2209 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,1,0,0,0,0|2,0,1]=4 2210 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,1,0,0,0,0|2,0,1]=4 2211 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,1,0,0,0,0|1,0,0]=2 2212 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,1,0,0,0,0|2,0,1]=4 2213 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,1,0,0,0,0|2,0,1]=4 2214 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,1,0,0,0,0|2,0,1]=4 2215 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,1,0,0,0,0|2,0,1]=4 2216 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,1,0,0,0,0|2,0,1]=4 2217 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,1,0,0,0,0|2,0,1]=4 2218 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,1,0,0,0,0|1,0,0]=2 2219 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,1,0,0,0,0|3,0,0]=4 2220 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,1,0,0,0,0|2,0,1]=4 2221 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,1,0,0,0,0|2,0,1]=4 2222 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,1,0,0,0,0|2,0,1]=4 2223 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,1,0,0,0,0|1,0,2]=4 2224 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,1,0,0,0,0|1,0,1]=3 2225 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,1,0,0,0,0|2,0,1]=4 2226 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,1,0,0,0,0|2,0,1]=4 2227 B8R0.23 OC(=O)CC([N+](=O)[O-])O Amb2222216 [0,1,0,0,0,0|3,0,0]=4 2228 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,1,0,0,0,0|1,0,1]=3 2229 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,1,0,0,0,0|2,0,1]=4 2230 B8R0.23 OC(=O)CN(C(=S)S)C Amb1042470 [0,1,0,0,0,0|2,0,1]=4 2231 B8R0.23 OC(=O)CS(=O)C(F)F Amb18979309 [0,1,0,0,0,0|3,0,0]=4 2232 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,1,0,0,0,0|2,0,1]=4 2233 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,1,0,0,0,0|1,0,0]=2 2234 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,1,0,0,0,0|2,0,1]=4 2235 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,1,0,0,0,0|2,0,1]=4 2236 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,1,0,0,0,0|2,0,1]=4 2237 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,1,0,0,0,0|2,0,1]=4 2238 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,1,0,0,0,0|2,0,1]=4 2239 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,1,0,0,0,0|2,0,1]=4 2240 B8R0.23 OC(=O)\C=C(\C(=C)C)/C Amb17593311 [0,1,0,0,0,0|0,0,3]=4 2241 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,1,0,0,0,0|1,0,0]=2 2242 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,1,0,0,0,0|2,0,1]=4 2243 B8R0.23 [13CH3]N(CC(O)=O)C(N)=N Amb22367286 [0,1,0,0,0,0|2,0,1]=4 2244 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,1,0,0,0,0|2,0,1]=4 2245 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,1,0,0,0,0|2,0,1]=4 2246 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,1,0,0,0,0|2,0,1]=4 2247 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,1,0,0,0,0|2,0,1]=4 2248 B8R0.24 CC(CBr)CS(C)(=O)=O Amb25142899 [0,1,0,0,0,0|2,0,1]=4 2249 B8R0.24 CC(CC(C)(C)O)CO Amb24588340 [0,1,0,0,0,0|2,0,1]=4 2250 B8R0.24 CC(CCl)CS(C)(=O)=O Amb20668805 [0,1,0,0,0,0|2,0,1]=4 2251 B8R0.24 CC(CN)CS(C)(=O)=O Amb18908423 [0,1,0,0,0,0|2,0,1]=4 2252 B8R0.24 CC(CN)OP(O)(O)=O Amb24407674 [0,1,0,0,0,0|3,0,0]=4 2253 B8R0.24 CC(CN)SS(O)(=O)=O Amb25147091 [0,1,0,0,0,0|3,0,0]=4 2254 B8R0.24 CC(CO)CS(N)(=O)=O Amb25284475 [0,1,0,0,0,0|2,0,1]=4 2255 B8R0.24 CC(CO)CS([O-])(=O)=O Amb24733227 [0,1,0,0,0,0|2,0,1]=4 2256 B8R0.24 CC(CO)OP(O)(O)=O Amb25121032 [0,1,0,0,0,0|3,0,0]=4 2257 B8R0.24 CC(CP(O)(O)=O)C=O Amb25134096 [0,1,0,0,0,0|2,0,1]=4 2258 B8R0.24 CC(CS(=O)(=O)Cl)CCl Amb20623341 [0,1,0,0,0,0|2,0,1]=4 2259 B8R0.24 CCC(C)CC(C)(C)C Amb22228217 [0,1,0,0,0,0|2,0,1]=4 2260 B8R0.24 CCC(C)CC(C)(C)N Amb18523796 [0,1,0,0,0,0|2,0,1]=4 2261 B8R0.24 CCC(C)CC(C)(C)O Amb25045207 [0,1,0,0,0,0|1,0,1]=3 2262 B8R0.24 CCC(C)CC(F)(F)F Amb22008015 [0,1,0,0,0,0|2,0,1]=4 2263 B8R0.24 CCC(C)CS(=O)(=O)Cl Amb18295538 [0,1,0,0,0,0|1,0,1]=3 2264 B8R0.24 CCC(C)CS(=O)(=O)F Amb19373796 [0,1,0,0,0,0|1,0,1]=3 2265 B8R0.24 CCC(C)CS(N)(=O)=O Amb18180195 [0,1,0,0,0,0|1,0,1]=3 2266 B8R0.24 CCC(C)C[B-](F)(F)F Amb25332822 [0,1,0,0,0,0|3,0,0]=4 2267 B8R0.24 CCC(C)C[Si](C)(C)Cl Amb24554875 [0,1,0,0,0,0|2,1,0]=4 2268 B8R0.24 CCC(C)NS(N)(=O)=O Amb25136438 [0,1,0,0,0,0|2,0,1]=4 2269 B8R0.24 CCC(C)OS(=O)(=O)Cl Amb25353194 [0,1,0,0,0,0|2,0,1]=4 2270 B8R0.24 CCC(C)OS(C)(=O)=O Amb22008739 [0,1,0,0,0,0|2,0,1]=4 2271 B8R0.24 CCC(C)OS(C)(=O)=S Amb25343355 [0,1,0,0,0,0|2,1,0]=4 2272 B8R0.24 CCC(CS(=O)(=O)C)N Amb17485988 [0,1,0,0,0,0|2,0,1]=4 2273 B8R0.24 CCC(Cl)CP(O)(O)=O Amb25724957 [0,1,0,0,0,0|2,0,0]=3 2274 B8R0.24 CCC(Cl)CS(=O)(=O)F Amb25349720 [0,1,0,0,0,0|2,0,1]=4 2275 B8R0.24 CCC(F)CS(C)(=O)=O Amb24474745 [0,1,0,0,0,0|2,0,1]=4 2276 B8R0.24 CCC(N)CS(=O)(=O)Cl Amb24724737 [0,1,0,0,0,0|2,0,1]=4 2277 B8R0.24 CCC(N)CS(N)(=O)=O Amb25362079 [0,1,0,0,0,0|2,0,1]=4 2278 B8R0.24 CCC(NS(=O)(=O)Cl)C Amb17193919 [0,1,0,0,0,0|2,0,1]=4 2279 B8R0.24 CCC(O)CC(C)(C)O Amb24420727 [0,1,0,0,0,0|2,0,1]=4 2280 B8R0.24 CCC(O)CS(C)(=O)=O Amb18799417 [0,1,0,0,0,0|2,0,1]=4 2281 B8R0.24 CC[C@@H](C)OS(C)(=O)=O Amb24763137 [0,1,0,0,0,0|2,0,1]=4 2282 B8R0.24 CC[C@@H](N)CS(O)(=O)=O Amb24495132 [0,1,0,0,0,0|2,0,0]=3 2283 B8R0.24 CC[C@H](N)CS(=O)(=O)Cl Amb24367389 [0,1,0,0,0,0|2,0,1]=4 2284 B8R0.24 CC[C@H](N)CS(O)(=O)=O Amb25146380 [0,1,0,0,0,0|2,0,0]=3 2285 B8R0.24 CNC(C)CP(O)(O)=O Amb24381561 [0,1,0,0,0,0|2,0,0]=3 2286 B8R0.24 CNC(C)CS(C)(=O)=O Amb18300683 [0,1,0,0,0,0|2,0,1]=4 2287 B8R0.24 COC(C)CS(=O)(=O)F Amb24532153 [0,1,0,0,0,0|2,0,1]=4 2288 B8R0.24 COC(C)CS(N)(=O)=O Amb24481677 [0,1,0,0,0,0|2,0,1]=4 2289 B8R0.24 CP(O)(=O)CC(F)CN Amb24480226 [0,1,0,0,0,0|3,0,0]=4 2290 B8R0.24 CP(O)(=O)C[C@@H](O)CN Amb25273989 [0,1,0,0,0,0|3,0,0]=4 2291 B8R0.24 CP(O)(=O)C[C@H](F)CN Amb24543828 [0,1,0,0,0,0|3,0,0]=4 2292 B8R0.24 C[C@@H](CC(C)(C)O)CO Amb25332384 [0,1,0,0,0,0|2,0,1]=4 2293 B8R0.24 C[C@@H](CS(=O)(=O)Cl)CCl Amb25125543 [0,1,0,0,0,0|2,0,1]=4 2294 B8R0.24 C[C@H](CC(C)(C)O)CO Amb24352415 [0,1,0,0,0,0|2,0,1]=4 2295 B8R0.24 NCC(O)CP(O)(O)=O Amb24376767 [0,1,0,0,0,0|3,0,0]=4 2296 B8R0.24 NCC(O)CS(O)(=O)=O Amb24373242 [0,1,0,0,0,0|3,0,0]=4 2297 B8R0.24 NC[C@@H](F)CS(O)(=O)=O Amb25375836 [0,1,0,0,0,0|3,0,0]=4 2298 B8R0.24 NC[C@@H](O)CP(O)(O)=O Amb24443084 [0,1,0,0,0,0|3,0,0]=4 2299 B8R0.24 N[C@@H](CS(O)(=O)=O)CO Amb25083500 [0,1,0,0,0,0|3,0,0]=4 2300 B8R0.24 OC(CBr)CS(O)(=O)=O Amb25383408 [0,1,0,0,0,0|3,0,0]=4 2301 B8R0.24 OC(CCl)CS(O)(=O)=O Amb22338699 [0,1,0,0,0,0|3,0,0]=4 2302 B8R0.24 OC(CCl)CS(O)(=O)=O Amb24061946 [0,1,0,0,0,0|3,0,0]=4 2303 B8R0.24 OCC(O)CS(O)(=O)=O Amb25802047 [0,1,0,0,0,0|3,0,0]=4 2304 B8R0.24 O[C@H](CCl)CS(O)(=O)=O Amb25322010 [0,1,0,0,0,0|3,0,0]=4 2305 B8R0.24 SCC(CS(=O)(=O)O)O Amb17594311 [0,1,0,0,0,0|3,0,0]=4 2306 B8R0.34 CC(=C)CC(C)(C)CCl Amb25727696 [0,1,0,0,0,0|3,0,0]=4 2307 B8R0.34 CC(=C)CC(C)(C)CN Amb25146071 [0,1,0,0,0,0|3,0,0]=4 2308 B8R0.34 CC(=C)CC(C)(O)CCl Amb25709597 [0,1,0,0,0,0|3,0,0]=4 2309 B8R0.34 CC(=O)CC(C)(C)C#N Amb18642299 [0,1,0,0,0,0|2,0,1]=4 2310 B8R0.34 CC(=O)CC(C)(C)C=O Amb18642640 [0,1,0,0,0,0|2,0,1]=4 2311 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,1,0,0,0,0|2,0,0]=3 2312 B8R0.34 CC(=O)CC(C)(C)NO Amb24736823 [0,1,0,0,0,0|3,0,0]=4 2313 B8R0.34 CC(=O)CC(C)(C)ON Amb24707795 [0,1,0,0,0,0|3,0,0]=4 2314 B8R0.34 CC(=O)CC(C)(C)OO Amb24079585 [0,1,0,0,0,0|3,0,0]=4 2315 B8R0.34 CC(=O)CC(C)(O)C#N Amb24349635 [0,1,0,0,0,0|2,0,1]=4 2316 B8R0.34 CC(=O)NC(C)(C)CF Amb25711849 [0,1,0,0,0,0|3,0,0]=4 2317 B8R0.34 CC(=O)OC(C)(C)CBr Amb24710435 [0,1,0,0,0,0|3,0,0]=4 2318 B8R0.34 CC(C)(CBr)CC(O)=O Amb24480039 [0,1,0,0,0,0|1,0,0]=2 2319 B8R0.34 CC(C)(CBr)NC(N)=O Amb24340306 [0,1,0,0,0,0|3,0,0]=4 2320 B8R0.34 CC(C)(CBr)OC(=O)Cl Amb24480342 [0,1,0,0,0,0|3,0,0]=4 2321 B8R0.34 CC(C)(CBr)OC(N)=O Amb24479975 [0,1,0,0,0,0|3,0,0]=4 2322 B8R0.34 CC(C)(CC(=O)Cl)C#N Amb24340082 [0,1,0,0,0,0|2,0,1]=4 2323 B8R0.34 CC(C)(CC(N)=O)C#N Amb18642438 [0,1,0,0,0,0|2,0,1]=4 2324 B8R0.34 CC(C)(CC(N)=O)C=C Amb25680144 [0,1,0,0,0,0|1,0,2]=4 2325 B8R0.34 CC(C)(CC(O)=O)C#C Amb24554543 [0,1,0,0,0,0|0,0,2]=3 2326 B8R0.34 CC(C)(CC(O)=O)CO Amb24116870 [0,1,0,0,0,0|1,0,0]=2 2327 B8R0.34 CC(C)(CC(O)=O)NN Amb24670787 [0,1,0,0,0,0|2,0,0]=3 2328 B8R0.34 CC(C)(CCl)NC(N)=O Amb24376096 [0,1,0,0,0,0|3,0,0]=4 2329 B8R0.34 CC(C)(CF)NC(N)=O Amb25099252 [0,1,0,0,0,0|3,0,0]=4 2330 B8R0.34 CC(C)(CN)CC(=C)Cl Amb25705163 [0,1,0,0,0,0|3,0,0]=4 2331 B8R0.34 CC(C)(CN)NC(N)=O Amb18203177 [0,1,0,0,0,0|3,0,0]=4 2332 B8R0.34 CC(C)(CO)CC(N)=O Amb25063938 [0,1,0,0,0,0|2,0,0]=3 2333 B8R0.34 CC(C)(CO)CC([O-])=O Amb24178915 [0,1,0,0,0,0|1,0,1]=3 2334 B8R0.34 CC(F)(CN)CC(O)=O Amb24481603 [0,1,0,0,0,0|1,0,0]=2 2335 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,1,0,0,0,0|0,0,2]=3 2336 B8R0.34 CC(N)(CCl)CC(O)=O Amb22641961 [0,1,0,0,0,0|1,0,0]=2 2337 B8R0.34 CC(O)(CC(O)=O)C=C Amb18642755 [0,1,0,0,0,0|0,0,2]=3 2338 B8R0.34 CC(O)(CN)CC(O)=O Amb25188898 [0,1,0,0,0,0|1,0,0]=2 2339 B8R0.34 CC(O)CC(C)(C)CN Amb19148071 [0,1,0,0,0,0|2,0,1]=4 2340 B8R0.34 CC(O)CC(C)(C)CN Amb22059606 [0,1,0,0,0,0|2,0,1]=4 2341 B8R0.34 CC(O)CC(C)(C)CO Amb25145315 [0,1,0,0,0,0|2,0,1]=4 2342 B8R0.34 CC(O)CC(C)(O)CO Amb25306407 [0,1,0,0,0,0|2,0,1]=4 2343 B8R0.34 CCC(C)(C)CC(=O)Cl Amb25032181 [0,1,0,0,0,0|1,0,0]=2 2344 B8R0.34 CCC(C)(C)CC(C)=C Amb22228307 [0,1,0,0,0,0|2,0,0]=3 2345 B8R0.34 CCC(C)(C)CC(C)=O Amb22388941 [0,1,0,0,0,0|1,0,0]=2 2346 B8R0.34 CCC(C)(C)CC(C)C Amb22228306 [0,1,0,0,0,0|2,0,1]=4 2347 B8R0.34 CCC(C)(C)CC(C)Cl Amb25737180 [0,1,0,0,0,0|2,0,1]=4 2348 B8R0.34 CCC(C)(C)CC(Cl)Cl Amb25858092 [0,1,0,0,0,0|2,0,1]=4 2349 B8R0.34 CCC(C)(C)CN(C)C Amb24532844 [0,1,0,0,0,0|3,0,0]=4 2350 B8R0.34 CCC(C)(C)C[N+]([O-])=O Amb24469650 [0,1,0,0,0,0|1,0,1]=3 2351 B8R0.34 CCC(C)(C)NC(C)=N Amb25055960 [0,1,0,0,0,0|3,0,0]=4 2352 B8R0.34 CCC(C)(C)NC(N)=N Amb25189064 [0,1,0,0,0,0|3,0,0]=4 2353 B8R0.34 CCC(C)(Cl)CC(C)C Amb22229736 [0,1,0,0,0,0|2,0,1]=4 2354 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,1,0,0,0,0|0,0,0]=1 2355 B8R0.34 CCC(C)(N)CC(F)F Amb25294694 [0,1,0,0,0,0|2,0,1]=4 2356 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,1,0,0,0,0|0,0,0]=1 2357 B8R0.34 CCC(C)(O)CC(N)=S Amb25189007 [0,1,0,0,0,0|1,1,0]=3 2358 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,1,0,0,0,0|0,0,0]=1 2359 B8R0.34 CCC(C)(O)C[N+]([O-])=O Amb25270235 [0,1,0,0,0,0|1,0,1]=3 2360 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,1,0,0,0,0|0,0,0]=1 2361 B8R0.34 CCC(NC(=O)N)(C)C Amb1139044 [0,1,0,0,0,0|2,0,0]=3 2362 B8R0.34 CCP(O)(=O)CC(O)=O Amb24480209 [0,1,0,0,0,0|2,0,0]=3 2363 B8R0.34 CCS(=O)(=O)CC(C)=O Amb19515195 [0,1,0,0,0,0|3,0,0]=4 2364 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,1,0,0,0,0|0,0,0]=1 2365 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,1,0,0,0,0|0,0,0]=1 2366 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,1,0,0,0,0|0,0,0]=1 2367 B8R0.34 CC[C@](C)(S)NC(N)=N Amb25076572 [0,1,0,0,0,0|3,0,0]=4 2368 B8R0.34 CC[N+](C)(C)CC(O)=O Amb24390383 [0,1,0,0,0,0|1,0,0]=2 2369 B8R0.34 CNC(C)(C)CC(O)=O Amb25710043 [0,1,0,0,0,0|1,0,0]=2 2370 B8R0.34 COC(C)(C)CC(N)=O Amb24473153 [0,1,0,0,0,0|2,0,0]=3 2371 B8R0.34 COP(O)(=O)CC(O)=O Amb24732061 [0,1,0,0,0,0|3,0,0]=4 2372 B8R0.34 CSC(C)(C)CC(O)=O Amb25304571 [0,1,0,0,0,0|1,0,0]=2 2373 B8R0.34 CSC(CC(=O)C)(C)C Amb16236855 [0,1,0,0,0,0|2,0,0]=3 2374 B8R0.34 C[C@@H](O)C[C@](C)(O)CO Amb25356228 [0,1,0,0,0,0|2,0,1]=4 2375 B8R0.34 C[C@@](N)(CC(O)=O)CO Amb25715205 [0,1,0,0,0,0|1,0,0]=2 2376 B8R0.34 C[C@@](O)(CN)CC(O)=O Amb24745092 [0,1,0,0,0,0|1,0,0]=2 2377 B8R0.34 C[Si](C)(CCl)CC(O)=O Amb25107199 [0,1,0,0,0,0|1,1,0]=3 2378 B8R0.34 NCC(F)(F)CC(O)=O Amb19148532 [0,1,0,0,0,0|2,0,0]=3 2379 B8R0.34 O=NC(CC(=O)C)(C)C Amb17593358 [0,1,0,0,0,0|3,0,0]=4 2380 B8R0.34 OC(=O)CS(=O)(=O)CF Amb24707946 [0,1,0,0,0,0|3,0,0]=4 2381 B8R0.34 OCC(OC(=O)C)(C)C Amb17607378 [0,1,0,0,0,0|3,0,0]=4 2382 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,0,0,1,0,0|1,0,2]=4 2383 B8R1.1 C#CC1COC(=O)O1 Amb25056381 [0,0,0,1,0,0|1,0,2]=4 2384 B8R1.1 C#C[C@@H]1COC(=O)N1 Amb23401461 [0,0,0,1,0,0|1,0,2]=4 2385 B8R1.1 C#C[C@H]1CC(=O)CC1 Amb24721679 [0,0,0,1,0,0|1,0,2]=4 2386 B8R1.1 C=CC1CNC(=O)C1 Amb25117425 [0,0,0,1,0,0|1,0,2]=4 2387 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,0,0,1,0,0|0,0,2]=3 2388 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,0,0,1,0,0|1,0,2]=4 2389 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,0,0,1,0,0|0,0,2]=3 2390 B8R1.1 C=C[C@H]1CC(=O)CC1 Amb24524536 [0,0,0,1,0,0|1,0,2]=4 2391 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,0,0,1,0,0|0,0,2]=3 2392 B8R1.1 CC1=NC(CBr)CO1 Amb25138721 [0,0,0,1,0,0|3,0,0]=4 2393 B8R1.1 CC1=NC(CO)CO1 Amb24527624 [0,0,0,1,0,0|3,0,0]=4 2394 B8R1.1 CC1CC(CBr)CO1 Amb25077494 [0,0,0,1,0,0|2,0,1]=4 2395 B8R1.1 CC1CC(CCl)CO1 Amb24630118 [0,0,0,1,0,0|2,0,1]=4 2396 B8R1.1 CC1NC(CO1)CC Amb25126945 [0,0,0,1,0,0|2,0,1]=4 2397 B8R1.1 CC=1CC(CO)CN1 Amb25204416 [0,0,0,1,0,0|3,0,0]=4 2398 B8R1.1 CC=1C[C@H](CO)CC1 Amb24481425 [0,0,0,1,0,0|3,0,0]=4 2399 B8R1.1 CCC1=COC(=O)N1 Amb25276478 [0,0,0,1,0,0|1,0,2]=4 2400 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,0,0,1,0,0|2,0,1]=4 2401 B8R1.1 CCC1C=CC(=O)S1 Amb24638103 [0,0,0,1,0,0|2,0,1]=4 2402 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,0,0,1,0,0|1,0,1]=3 2403 B8R1.1 CCC1CC(=O)CC1 Amb19267107 [0,0,0,1,0,0|1,0,0]=2 2404 B8R1.1 CCC1CC(=O)CS1 Amb25273070 [0,0,0,1,0,0|2,0,0]=3 2405 B8R1.1 CCC1CC(O)C=C1 Amb25262905 [0,0,0,1,0,0|1,0,2]=4 2406 B8R1.1 CCC1CC(O)CO1 Amb24340231 [0,0,0,1,0,0|2,0,1]=4 2407 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,0,0,1,0,0|2,0,0]=3 2408 B8R1.1 CCC1CCC(N)C1 Amb25850555 [0,0,0,1,0,0|2,0,1]=4 2409 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,0,0,1,0,0|1,0,1]=3 2410 B8R1.1 CCC1CCC(S)C1 Amb25082172 [0,0,0,1,0,0|1,1,1]=4 2411 B8R1.1 CCC1CN=C(C)N1 Amb25732193 [0,0,0,1,0,0|3,0,0]=4 2412 B8R1.1 CCC1CN=C(C)S1 Amb25197984 [0,0,0,1,0,0|3,0,0]=4 2413 B8R1.1 CCC1CN=C(Cl)O1 Amb24519084 [0,0,0,1,0,0|3,0,0]=4 2414 B8R1.1 CCC1CN=C(N)N1 Amb24483143 [0,0,0,1,0,0|3,0,0]=4 2415 B8R1.1 CCC1CN=C(N)O1 Amb25728217 [0,0,0,1,0,0|3,0,0]=4 2416 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,0,0,1,0,0|1,0,0]=2 2417 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,0,0,1,0,0|2,0,0]=3 2418 B8R1.1 CCC1CNC(S)=N1 Amb25072509 [0,0,0,1,0,0|2,1,0]=4 2419 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,0|1,0,0]=2 2420 B8R1.1 CCC1COC(N)=N1 Amb24436270 [0,0,0,1,0,0|2,0,0]=3 2421 B8R1.1 CCC1CSC(=S)N1 Amb25078191 [0,0,0,1,0,0|1,2,0]=4 2422 B8R1.1 CCC1CSC(Br)=N1 Amb25749236 [0,0,0,1,0,0|2,1,0]=4 2423 B8R1.1 CCC1CSC(C)=N1 Amb24325349 [0,0,0,1,0,0|2,1,0]=4 2424 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,0,0,1,0,0|0,0,2]=3 2425 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,0,0,1,0,0|0,0,2]=3 2426 B8R1.1 CCN1CCC(=O)N1 Amb24716029 [0,0,0,1,0,0|3,0,0]=4 2427 B8R1.1 CCN1C[C@H](O)CC1 Amb24735301 [0,0,0,1,0,0|2,0,1]=4 2428 B8R1.1 CC[C@@H]1CC(=O)CC1 Amb25142670 [0,0,0,1,0,0|1,0,0]=2 2429 B8R1.1 CC[C@@H]1CCC(=S)N1 Amb25712485 [0,0,0,1,0,0|2,1,0]=4 2430 B8R1.1 CC[C@@H]1CC[C@@H](O)C1 Amb24587422 [0,0,0,1,0,0|1,0,1]=3 2431 B8R1.1 CC[C@@H]1CNC(=O)C1 Amb25367322 [0,0,0,1,0,0|1,0,0]=2 2432 B8R1.1 CC[C@@H]1CNC(=O)O1 Amb24507830 [0,0,0,1,0,0|2,0,0]=3 2433 B8R1.1 CC[C@@H]1CSC(=S)N1 Amb24409541 [0,0,0,1,0,0|1,2,0]=4 2434 B8R1.1 CC[C@H]1CC(=O)CC1 Amb24614252 [0,0,0,1,0,0|1,0,0]=2 2435 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,0,0,1,0,0|2,0,0]=3 2436 B8R1.1 CC[C@H]1CNC(=O)C1 Amb24632784 [0,0,0,1,0,0|1,0,0]=2 2437 B8R1.1 CC[C@H]1C[C@H](O)C=C1 Amb25206636 [0,0,0,1,0,0|1,0,2]=4 2438 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,0,0,1,0,0|2,0,0]=3 2439 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,0,0,1,0,0|1,0,2]=4 2440 B8R1.1 COC1CC(=O)C=C1 Amb24425404 [0,0,0,1,0,0|2,0,1]=4 2441 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,0,0,1,0,0|2,0,0]=3 2442 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,0,0,1,0,0|3,0,0]=4 2443 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,0,0,1,0,0|2,0,0]=3 2444 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,0,0,1,0,0|2,0,0]=3 2445 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Amb25283262 [0,0,0,1,0,0|2,0,1]=4 2446 B8R1.1 CO[C@H]1CC(=O)C=C1 Amb25689601 [0,0,0,1,0,0|2,0,1]=4 2447 B8R1.1 C[C@@H]1C[C@H](CO)CO1 Amb25176664 [0,0,0,1,0,0|2,0,1]=4 2448 B8R1.1 C[C@H]1CC[C@@H](C1)CC Amb25250483 [0,0,0,1,0,0|2,0,1]=4 2449 B8R1.1 C[C@H]1CC[C@H](C1)CC Amb25061642 [0,0,0,1,0,0|2,0,1]=4 2450 B8R1.1 ClCC1CCC(=O)O1 Amb10608418 [0,0,0,1,0,0|3,0,0]=4 2451 B8R1.1 ClCC1CNC(=O)O1 Amb1152954 [0,0,0,1,0,0|3,0,0]=4 2452 B8R1.1 N#CC1CC(=O)CC1 Amb22886979 [0,0,0,1,0,0|2,0,1]=4 2453 B8R1.1 NC1=NC(CO)CO1 Amb25233954 [0,0,0,1,0,0|3,0,0]=4 2454 B8R1.1 NCC1CC(=O)CC1 Amb24644946 [0,0,0,1,0,0|2,0,0]=3 2455 B8R1.1 NCC1CC=C(Cl)C1 Amb23594525 [0,0,0,1,0,0|3,0,0]=4 2456 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,0,0,1,0,0|3,0,0]=4 2457 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,0,0,1,0,0|3,0,0]=4 2458 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,0,0,1,0,0|3,0,0]=4 2459 B8R1.1 NCC1CCC(O)C1 Amb18641846 [0,0,0,1,0,0|2,0,1]=4 2460 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,0,0,1,0,0|2,0,1]=4 2461 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,0,0,1,0,0|2,0,0]=3 2462 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,0,0,1,0,0|3,0,0]=4 2463 B8R1.1 NCC1CNC(=O)O1 Amb23439310 [0,0,0,1,0,0|3,0,0]=4 2464 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,0,0,1,0,0|1,0,0]=2 2465 B8R1.1 NCC1CSC(=O)O1 Amb25843341 [0,0,0,1,0,0|2,1,0]=4 2466 B8R1.1 NCC=1CC(=O)ON1 Amb18833041 [0,0,0,1,0,0|2,0,1]=4 2467 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,0,0,1,0,0|1,0,2]=4 2468 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,0,0,1,0,0|3,0,0]=4 2469 B8R1.1 NC[C@@H]1CCC(=O)O1 Amb24656037 [0,0,0,1,0,0|3,0,0]=4 2470 B8R1.1 NC[C@@H]1CC[C@@H](C1)O Amb10066982 [0,0,0,1,0,0|2,0,1]=4 2471 B8R1.1 NC[C@@H]1CC[C@H](C1)O Amb10066974 [0,0,0,1,0,0|2,0,1]=4 2472 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,0,0,1,0,0|2,0,0]=3 2473 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,0,0,1,0,0|2,0,0]=3 2474 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,0,0,1,0,0|3,0,0]=4 2475 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,0,0,1,0,0|3,0,0]=4 2476 B8R1.1 NC[C@H]1CC(O)=NO1 Amb25334789 [0,0,0,1,0,0|3,0,0]=4 2477 B8R1.1 NC[C@H]1CCC(=O)O1 Amb24376645 [0,0,0,1,0,0|3,0,0]=4 2478 B8R1.1 NC[C@H]1CC[C@@H](C1)O Amb10066981 [0,0,0,1,0,0|2,0,1]=4 2479 B8R1.1 NC[C@H]1CC[C@H](C1)O Amb10066975 [0,0,0,1,0,0|2,0,1]=4 2480 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,0,0,1,0,0|1,0,2]=4 2481 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,0,0,1,0,0|1,0,2]=4 2482 B8R1.1 O=C1CC(CBr)CC1 Amb24483273 [0,0,0,1,0,0|2,0,0]=3 2483 B8R1.1 O=C1CC(CBr)CN1 Amb23597459 [0,0,0,1,0,0|2,0,0]=3 2484 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,0,0,1,0,0|1,0,0]=2 2485 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,0,0,1,0,0|1,0,0]=2 2486 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,0,0,1,0,0|2,0,0]=3 2487 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,0,0,1,0,0|3,0,0]=4 2488 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,0,0,1,0,0|3,0,0]=4 2489 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,0,0,1,0,0|3,0,0]=4 2490 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,0,0,1,0,0|3,0,0]=4 2491 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,0,0,1,0,0|3,0,0]=4 2492 B8R1.1 O=C1CC[C@@H](CF)N1 Amb19148412 [0,0,0,1,0,0|3,0,0]=4 2493 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,0,0,1,0,0|1,0,0]=2 2494 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,0,0,1,0,0|1,0,0]=2 2495 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,0,0,1,0,0|1,0,0]=2 2496 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,0,0,1,0,0|3,0,0]=4 2497 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,0,0,1,0,0|3,0,0]=4 2498 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,0,0,1,0,0|3,0,0]=4 2499 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,0,0,1,0,0|3,0,0]=4 2500 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,0,0,1,0,0|2,0,0]=3 2501 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,0,0,1,0,0|2,0,0]=3 2502 B8R1.1 O=C1SCC(CBr)S1 Amb24376514 [0,0,0,1,0,0|2,1,0]=4 2503 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,0,0,1,0,0|2,0,1]=4 2504 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,0,0,1,0,0|2,0,1]=4 2505 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,0,0,1,0,0|2,0,1]=4 2506 B8R1.1 O=C[C@@H]1CNC(=O)C1 Amb24377645 [0,0,0,1,0,0|2,0,1]=4 2507 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,0,0,1,0,0|2,0,1]=4 2508 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,0,0,1,0,0|3,0,0]=4 2509 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,0,0,1,0,0|3,0,0]=4 2510 B8R1.1 O=S1OC[C@@H](CBr)O1 Amb25834609 [0,0,0,1,0,0|3,0,0]=4 2511 B8R1.1 O=S1OC[C@H](CBr)O1 Amb24654743 [0,0,0,1,0,0|3,0,0]=4 2512 B8R1.1 O=S1OC[C@H](CCl)O1 Amb24353584 [0,0,0,1,0,0|3,0,0]=4 2513 B8R1.1 OC1CC(CC1)CS Amb25853014 [0,0,0,1,0,0|2,0,1]=4 2514 B8R1.1 OC1CCC(C1)CO Amb22168730 [0,0,0,1,0,0|2,0,1]=4 2515 B8R1.1 OC=1OC(CCl)CP1 Amb24481387 [0,0,0,1,0,0|3,0,0]=4 2516 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,0,0,1,0,0|2,0,0]=3 2517 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,0,0,1,0,0|3,0,0]=4 2518 B8R1.1 OCC1CC=C(Cl)C1 Amb23594524 [0,0,0,1,0,0|3,0,0]=4 2519 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,0,0,1,0,0|3,0,0]=4 2520 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,0,0,1,0,0|3,0,0]=4 2521 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,0,0,1,0,0|3,0,0]=4 2522 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,0,0,1,0,0|3,0,0]=4 2523 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,0,0,1,0,0|1,0,0]=2 2524 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,0,0,1,0,0|2,0,0]=3 2525 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,0,0,1,0,0|2,1,0]=4 2526 B8R1.1 OCC1COP(=O)O1 Amb24475979 [0,0,0,1,0,0|3,0,0]=4 2527 B8R1.1 OCC1COS(=O)O1 Amb25802802 [0,0,0,1,0,0|3,0,0]=4 2528 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,0,0,1,0,0|1,0,2]=4 2529 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,0,0,1,0,0|2,0,1]=4 2530 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,0,0,1,0,0|2,0,0]=3 2531 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,0,0,1,0,0|3,0,0]=4 2532 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,0,0,1,0,0|3,0,0]=4 2533 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,0,0,1,0,0|2,0,0]=3 2534 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,0,0,1,0,0|3,0,0]=4 2535 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,0,0,1,0,0|1,0,0]=2 2536 B8R1.1 OC[C@@H]1COS(=O)O1 Amb24748538 [0,0,0,1,0,0|3,0,0]=4 2537 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,0,0,1,0,0|2,0,1]=4 2538 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,0,0,1,0,0|2,0,0]=3 2539 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,0,0,1,0,0|3,0,0]=4 2540 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,0,0,1,0,0|2,0,0]=3 2541 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,0,0,1,0,0|3,0,0]=4 2542 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,0,0,1,0,0|2,1,0]=4 2543 B8R1.1 O[C@@H]1CC[C@H](C1)CO Amb22748539 [0,0,0,1,0,0|2,0,1]=4 2544 B8R1.1 O[C@H]1CC[C@@H](C1)CO Amb24544575 [0,0,0,1,0,0|2,0,1]=4 2545 B8R1.1 O[C@H]1CC[C@H](C1)CO Amb24619136 [0,0,0,1,0,0|2,0,1]=4 2546 B8R1.4 C=C1CC(O)CCC1 Amb25296194 [0,0,0,1,0,0|3,0,0]=4 2547 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,1,0,0|1,0,2]=4 2548 B8R1.4 CC1CC(=C)CCC1 Amb25237522 [0,0,0,1,0,0|2,0,0]=3 2549 B8R1.4 CC1CC(=C)CCO1 Amb25235098 [0,0,0,1,0,0|3,0,0]=4 2550 B8R1.4 CC1CC(=N)NCC1 Amb19930463 [0,0,0,1,0,0|2,0,0]=3 2551 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,0,0,1,0,0|2,0,1]=4 2552 B8R1.4 CC1CC(=O)C=CS1 Amb25053096 [0,0,0,1,0,0|2,0,1]=4 2553 B8R1.4 CC1CC(=O)CC=C1 Amb25713549 [0,0,0,1,0,0|1,0,2]=4 2554 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,0,0,1,0,0|2,0,0]=3 2555 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,0,0,1,0,0|2,0,0]=3 2556 B8R1.4 CC1CC(=O)NC=C1 Amb24745438 [0,0,0,1,0,0|1,0,2]=4 2557 B8R1.4 CC1CC(=O)NCC1 Amb20668125 [0,0,0,1,0,0|1,0,0]=2 2558 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,0,0,1,0,0|2,0,1]=4 2559 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [0,0,0,1,0,0|1,0,1]=3 2560 B8R1.4 CC1CC(C)=CCN1 Amb25352197 [0,0,0,1,0,0|3,0,0]=4 2561 B8R1.4 CC1CC(C)CCC1 Amb22228339 [0,0,0,1,0,0|2,0,1]=4 2562 B8R1.4 CC1CC(C)NCC1 Amb19957920 [0,0,0,1,0,0|2,0,1]=4 2563 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [0,0,0,1,0,0|1,0,1]=3 2564 B8R1.4 CC1CC(N)=NCC1 Amb22496716 [0,0,0,1,0,0|2,0,0]=3 2565 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,0,0,1,0,0|2,0,1]=4 2566 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,0,0,1,0,0|2,0,1]=4 2567 B8R1.4 CC1CC(O)CNC1 Amb24507417 [0,0,0,1,0,0|2,0,1]=4 2568 B8R1.4 CC1CC(O)CSC1 Amb23568717 [0,0,0,1,0,0|2,0,1]=4 2569 B8R1.4 CC1CC(S)NCC1 Amb24531328 [0,0,0,1,0,0|1,1,1]=4 2570 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,0,0,1,0,0|2,0,1]=4 2571 B8R1.4 CC1CC=NC(=O)N1 Amb24580624 [0,0,0,1,0,0|2,0,1]=4 2572 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,0,0,1,0,0|1,0,0]=2 2573 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,0,0,1,0,0|2,0,0]=3 2574 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,0,0,1,0,0|2,0,0]=3 2575 B8R1.4 CC1CCCC(C1)N Amb1120465 [0,0,0,1,0,0|2,0,1]=4 2576 B8R1.4 CC1CCCC(N)=N1 Amb24674080 [0,0,0,1,0,0|3,0,0]=4 2577 B8R1.4 CC1CCCN(C1)C Amb10573560 [0,0,0,1,0,0|3,0,0]=4 2578 B8R1.4 CC1CCCN(C1)N Amb17231819 [0,0,0,1,0,0|3,0,0]=4 2579 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,0,0,1,0,0|3,0,0]=4 2580 B8R1.4 CC1CCNC(=N)C1 Amb17616048 [0,0,0,1,0,0|2,0,0]=3 2581 B8R1.4 CC1CCNC(=S)O1 Amb25836339 [0,0,0,1,0,0|2,1,0]=4 2582 B8R1.4 CC1CCNC(C)=N1 Amb25837033 [0,0,0,1,0,0|3,0,0]=4 2583 B8R1.4 CC1CCOB(O)O1 Amb24079673 [0,0,0,1,0,0|2,0,1]=4 2584 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,0,0,1,0,0|0,0,0]=1 2585 B8R1.4 CC1CCOC(=S)N1 Amb24548582 [0,0,0,1,0,0|1,1,0]=3 2586 B8R1.4 CC1CCSC(=S)N1 Amb25368051 [0,0,0,1,0,0|1,2,0]=4 2587 B8R1.4 CC1CN(C)CCO1 Amb22754927 [0,0,0,1,0,0|2,0,1]=4 2588 B8R1.4 CC1CN(N)CCC1 Amb22491393 [0,0,0,1,0,0|3,0,0]=4 2589 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,0,0,1,0,0|3,0,0]=4 2590 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,0,0,1,0,0|2,0,0]=3 2591 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,1,0,0|3,0,0]=4 2592 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,0,0,1,0,0|3,0,0]=4 2593 B8R1.4 CC1CSCC(=O)C1 Amb23568711 [0,0,0,1,0,0|2,0,0]=3 2594 B8R1.4 CC1CSCC(=O)N1 Amb25131602 [0,0,0,1,0,0|3,0,0]=4 2595 B8R1.4 CC1NCCC(=O)C1 Amb1087926 [0,0,0,1,0,0|2,0,0]=3 2596 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,0,0,1,0,0|1,0,2]=4 2597 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,0,0,1,0,0|0,0,2]=3 2598 B8R1.4 CC=1CC(O)CCC1 Amb25245575 [0,0,0,1,0,0|3,0,0]=4 2599 B8R1.4 CC=1C[C@@H](O)CCC1 Amb24619172 [0,0,0,1,0,0|3,0,0]=4 2600 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,0,0,1,0,0|2,0,0]=3 2601 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,0,0,1,0,0|2,0,0]=3 2602 B8R1.4 CN1CC(=O)NCC1 Amb19958159 [0,0,0,1,0,0|2,0,0]=3 2603 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,0,0,1,0,0|1,0,0]=2 2604 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,0,0,1,0,0|1,0,0]=2 2605 B8R1.4 CN1CC(O)CCC1 Amb24064756 [0,0,0,1,0,0|2,0,1]=4 2606 B8R1.4 CN1CCC=C(C1)Br Amb10975875 [0,0,0,1,0,0|3,0,0]=4 2607 B8R1.4 CN1CCC=C(C1)Br Amb13888761 [0,0,0,1,0,0|3,0,0]=4 2608 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,0,0,1,0,0|2,0,0]=3 2609 B8R1.4 CN1CCNC(=O)N1 Amb24426756 [0,0,0,1,0,0|3,0,0]=4 2610 B8R1.4 CN1C[C@@H](O)CCC1 Amb22225471 [0,0,0,1,0,0|2,0,1]=4 2611 B8R1.4 CN1C[C@H](O)CCC1 Amb22225150 [0,0,0,1,0,0|2,0,1]=4 2612 B8R1.4 CS=1CCCC(=O)C1 Amb25318868 [0,0,0,1,0,0|2,0,1]=4 2613 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,0,0,1,0,0|2,0,1]=4 2614 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,0,0,1,0,0|1,0,0]=2 2615 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,0,0,1,0,0|2,0,0]=3 2616 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,0,0,1,0,0|2,0,0]=3 2617 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,0,0,1,0,0|2,0,0]=3 2618 B8R1.4 C[C@@H]1CC(=O)NCC1 Amb25739591 [0,0,0,1,0,0|1,0,0]=2 2619 B8R1.4 C[C@@H]1CC(N)CCC1 Amb24674089 [0,0,0,1,0,0|2,0,1]=4 2620 B8R1.4 C[C@@H]1CC=CC(=O)N1 Amb25062539 [0,0,0,1,0,0|2,0,1]=4 2621 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,0,0,1,0,0|2,0,0]=3 2622 B8R1.4 C[C@@H]1CCCC(O)O1 Amb25680618 [0,0,0,1,0,0|2,0,1]=4 2623 B8R1.4 C[C@@H]1CCC[C@@H](O)O1 Amb25345132 [0,0,0,1,0,0|2,0,1]=4 2624 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,0,0,1,0,0|3,0,0]=4 2625 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,0,0,1,0,0|3,0,0]=4 2626 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,0,0,1,0,0|2,0,0]=3 2627 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,1,0,0|3,0,0]=4 2628 B8R1.4 C[C@@H]1CS(=O)CCN1 Amb24695988 [0,0,0,1,0,0|3,0,0]=4 2629 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,0,0,1,0,0|2,0,1]=4 2630 B8R1.4 C[C@@H]1C[C@@H](C)CCC1 Amb22800215 [0,0,0,1,0,0|2,0,1]=4 2631 B8R1.4 C[C@@H]1C[C@@H](Cl)CCC1 Amb24589765 [0,0,0,1,0,0|2,0,1]=4 2632 B8R1.4 C[C@@H]1C[C@@H](N)CCC1 Amb22746977 [0,0,0,1,0,0|2,0,1]=4 2633 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [0,0,0,1,0,0|2,0,1]=4 2634 B8R1.4 C[C@@H]1C[C@@H](O)CCS1 Amb24515322 [0,0,0,1,0,0|2,0,1]=4 2635 B8R1.4 C[C@@H]1C[C@H](C)NCC1 Amb22748742 [0,0,0,1,0,0|2,0,1]=4 2636 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [0,0,0,1,0,0|1,0,1]=3 2637 B8R1.4 C[C@@H]1C[C@H](N)CCC1 Amb25230368 [0,0,0,1,0,0|2,0,1]=4 2638 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,0,0,1,0,0|2,0,1]=4 2639 B8R1.4 C[C@@H]1C[C@H](O)C=CC1 Amb24614891 [0,0,0,1,0,0|1,0,2]=4 2640 B8R1.4 C[C@@H]1C[C@H](O)CCC1 Amb22800307 [0,0,0,1,0,0|1,0,1]=3 2641 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,0,0,1,0,0|2,0,1]=4 2642 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,0,0,1,0,0|2,0,1]=4 2643 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [0,0,0,1,0,0|2,0,1]=4 2644 B8R1.4 C[C@H]1CC(=O)C=CN1 Amb25800362 [0,0,0,1,0,0|2,0,1]=4 2645 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,0,0,1,0,0|2,0,1]=4 2646 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,0,0,1,0,0|1,0,0]=2 2647 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,0,0,1,0,0|2,0,0]=3 2648 B8R1.4 C[C@H]1CC(N)CCC1 Amb24529186 [0,0,0,1,0,0|2,0,1]=4 2649 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [0,0,0,1,0,0|0,0,2]=3 2650 B8R1.4 C[C@H]1CC=CC(=O)C1 Amb25723295 [0,0,0,1,0,0|1,0,1]=3 2651 B8R1.4 C[C@H]1CC=CC(=O)N1 Amb25326479 [0,0,0,1,0,0|2,0,1]=4 2652 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,0,0,1,0,0|2,0,1]=4 2653 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,0,0,1,0,0|2,0,0]=3 2654 B8R1.4 C[C@H]1CCC[C@@H](O)O1 Amb25175369 [0,0,0,1,0,0|2,0,1]=4 2655 B8R1.4 C[C@H]1CN(C)CCO1 Amb25162545 [0,0,0,1,0,0|2,0,1]=4 2656 B8R1.4 C[C@H]1CN(N)CCC1 Amb25807281 [0,0,0,1,0,0|3,0,0]=4 2657 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,0,0,1,0,0|3,0,0]=4 2658 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,0,0,1,0,0|3,0,0]=4 2659 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,1,0,0|3,0,0]=4 2660 B8R1.4 C[C@H]1C[C@@H](C)NCC1 Amb24603758 [0,0,0,1,0,0|2,0,1]=4 2661 B8R1.4 C[C@H]1C[C@@H](C)NCO1 Amb24515076 [0,0,0,1,0,0|2,0,1]=4 2662 B8R1.4 C[C@H]1C[C@@H](Cl)CCC1 Amb24512116 [0,0,0,1,0,0|2,0,1]=4 2663 B8R1.4 C[C@H]1C[C@@H](O)CCC1 Amb24713971 [0,0,0,1,0,0|1,0,1]=3 2664 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,0,0,1,0,0|2,0,1]=4 2665 B8R1.4 C[C@H]1C[C@@H](O)CCS1 Amb24515349 [0,0,0,1,0,0|2,0,1]=4 2666 B8R1.4 C[C@H]1C[C@H](Br)CCC1 Amb24519716 [0,0,0,1,0,0|2,0,1]=4 2667 B8R1.4 C[C@H]1C[C@H](C)CCC1 Amb25101983 [0,0,0,1,0,0|2,0,1]=4 2668 B8R1.4 C[C@H]1C[C@H](N)CCC1 Amb24629158 [0,0,0,1,0,0|2,0,1]=4 2669 B8R1.4 C[C@H]1C[C@H](O)CCC1 Amb24383351 [0,0,0,1,0,0|1,0,1]=3 2670 B8R1.4 C[C@H]1C[C@H](O)CCS1 Amb24515394 [0,0,0,1,0,0|2,0,1]=4 2671 B8R1.4 C[C@H]1C[C@H](O)CNC1 Amb25206204 [0,0,0,1,0,0|2,0,1]=4 2672 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,0,0,1,0,0|2,0,0]=3 2673 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,0,0,1,0,0|2,0,0]=3 2674 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,0,0,1,0,0|2,0,0]=3 2675 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,0,0,1,0,0|1,0,0]=2 2676 B8R1.4 NC1CC(N)=NCC1 Amb25225367 [0,0,0,1,0,0|3,0,0]=4 2677 B8R1.4 NC1CC(O)CCC1 Amb22491291 [0,0,0,1,0,0|2,0,1]=4 2678 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,1,0,0|2,0,0]=3 2679 B8R1.4 NC1CS(=O)CCC1 Amb18124391 [0,0,0,1,0,0|3,0,0]=4 2680 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,0,0,1,0,0|2,0,0]=3 2681 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22828171 [0,0,0,1,0,0|2,0,1]=4 2682 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22886176 [0,0,0,1,0,0|2,0,1]=4 2683 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22746547 [0,0,0,1,0,0|2,0,1]=4 2684 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22752827 [0,0,0,1,0,0|2,0,1]=4 2685 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,0,0,1,0,0|1,0,0]=2 2686 B8R1.4 N[C@H]1CS(=O)CCC1 Amb25168909 [0,0,0,1,0,0|3,0,0]=4 2687 B8R1.4 N[C@H]1C[C@@H](O)CCC1 Amb22270007 [0,0,0,1,0,0|2,0,1]=4 2688 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24074365 [0,0,0,1,0,0|2,0,1]=4 2689 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24671187 [0,0,0,1,0,0|2,0,1]=4 2690 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,0,0,1,0,0|1,0,2]=4 2691 B8R1.4 O=C1CC(Cl)CNN1 Amb22728306 [0,0,0,1,0,0|3,0,0]=4 2692 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,0,0,1,0,0|2,0,0]=3 2693 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,0,0,1,0,0|3,0,0]=4 2694 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,0,0,1,0,0|2,0,0]=3 2695 B8R1.4 O=C1CC(I)CCN1 Amb24387789 [0,0,0,1,0,0|2,0,0]=3 2696 B8R1.4 O=C1CC(I)CNN1 Amb25250615 [0,0,0,1,0,0|3,0,0]=4 2697 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,0,0,1,0,0|2,0,0]=3 2698 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,0,0,1,0,0|2,0,1]=4 2699 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,0,0,1,0,0|2,0,1]=4 2700 B8R1.4 O=S1C[C@@H](Cl)CCC1 Amb24533964 [0,0,0,1,0,0|3,0,0]=4 2701 B8R1.4 O=S1C[C@H](Cl)CCC1 Amb25779923 [0,0,0,1,0,0|3,0,0]=4 2702 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,0,0,1,0,0|2,0,1]=4 2703 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,0,0,1,0,0|2,0,1]=4 2704 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,0,0,1,0,0|2,0,0]=3 2705 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,0,0,1,0,0|3,0,0]=4 2706 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,0,0,1,0,0|1,0,0]=2 2707 B8R1.4 OC1CC(Br)CCC1 Amb24483115 [0,0,0,1,0,0|2,0,1]=4 2708 B8R1.4 OC1CC(O)OCC1 Amb25808083 [0,0,0,1,0,0|1,0,2]=4 2709 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,0,0,1,0,0|2,0,0]=3 2710 B8R1.4 OC1CCNC(C1)C Amb1051141 [0,0,0,1,0,0|2,0,1]=4 2711 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,0,0,1,0,0|2,0,0]=3 2712 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,0,0,1,0,0|2,0,0]=3 2713 B8R1.4 O[C@@H]1C[C@@H](O)CCC1 Amb22801014 [0,0,0,1,0,0|2,0,1]=4 2714 B8R1.4 O[C@@H]1C[C@H](Br)CCC1 Amb24739845 [0,0,0,1,0,0|2,0,1]=4 2715 B8R1.4 O[C@@H]1C[C@H](Cl)CCC1 Amb24512124 [0,0,0,1,0,0|2,0,1]=4 2716 B8R1.4 O[C@@H]1C[C@H](O)CCC1 Amb22801622 [0,0,0,1,0,0|2,0,1]=4 2717 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,0,0,1,0,0|2,0,0]=3 2718 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,0,0,1,0,0|1,0,0]=2 2719 B8R1.4 O[C@H]1C[C@H](Br)CCC1 Amb24558410 [0,0,0,1,0,0|2,0,1]=4 2720 B8R1.4 O[C@H]1C[C@H](Cl)CCC1 Amb24739695 [0,0,0,1,0,0|2,0,1]=4 2721 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,0,0,1,0,0|3,0,0]=4 2722 B8R1.18 CC1=CC(=O)CC1Br Amb24552421 [0,0,0,1,0,0|2,0,1]=4 2723 B8R1.18 CC1=CC(=O)CC1Cl Amb24711398 [0,0,0,1,0,0|2,0,1]=4 2724 B8R1.18 CC1=CC(=O)CC1O Amb24633748 [0,0,0,1,0,0|2,0,1]=4 2725 B8R1.18 CC1=CC(=O)C[C@@H]1O Amb25093715 [0,0,0,1,0,0|2,0,1]=4 2726 B8R1.18 CC1=CC(=O)C[C@H]1O Amb24612700 [0,0,0,1,0,0|2,0,1]=4 2727 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,0,0,1,0,0|1,0,2]=4 2728 B8R1.18 CC1=CC(=O)OC1Cl Amb24601836 [0,0,0,1,0,0|1,0,2]=4 2729 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,0,0,1,0,0|1,0,2]=4 2730 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,0,0,1,0,0|2,0,0]=3 2731 B8R1.18 CC1CC(=O)NC1=N Amb25039964 [0,0,0,1,0,0|2,0,1]=4 2732 B8R1.18 CC1CC(C)OC1O Amb25226270 [0,0,0,1,0,0|2,0,1]=4 2733 B8R1.18 CC1CC(Cl)=NN1C Amb24696905 [0,0,0,1,0,0|3,0,0]=4 2734 B8R1.18 CC1CC(O)CC1N Amb25169593 [0,0,0,1,0,0|2,0,1]=4 2735 B8R1.18 CC1CC(O)CC1O Amb25055810 [0,0,0,1,0,0|2,0,1]=4 2736 B8R1.18 CC1CC(O)CN1C Amb23453942 [0,0,0,1,0,0|2,0,1]=4 2737 B8R1.18 CC1CN(C)OC1O Amb25129773 [0,0,0,1,0,0|3,0,0]=4 2738 B8R1.18 CC1C[C@@H](C)[C@H](C)C1 Amb24099376 [0,0,0,1,0,0|2,0,1]=4 2739 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,0,0,1,0,0|2,0,1]=4 2740 B8R1.18 CC1NC(=O)CC1C Amb20623595 [0,0,0,1,0,0|1,0,0]=2 2741 B8R1.18 CC1NC(=O)CC1S Amb24441528 [0,0,0,1,0,0|2,0,0]=3 2742 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,0,0,1,0,0|2,0,1]=4 2743 B8R1.18 CC1NC(=S)CC1C Amb24532333 [0,0,0,1,0,0|1,1,0]=3 2744 B8R1.18 CC1NC(C)CC1C Amb25327752 [0,0,0,1,0,0|2,0,1]=4 2745 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,0,0,1,0,0|1,0,0]=2 2746 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,0,0,1,0,0|2,0,1]=4 2747 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,0,0,1,0,0|1,0,0]=2 2748 B8R1.18 CC1OC(=O)NC1N Amb24568318 [0,0,0,1,0,0|2,0,0]=3 2749 B8R1.18 CC1OC(C)CC1Cl Amb24699077 [0,0,0,1,0,0|2,0,1]=4 2750 B8R1.18 CC1OC(C)CC1N Amb24619349 [0,0,0,1,0,0|2,0,1]=4 2751 B8R1.18 CC1OC(C)CC1O Amb25238640 [0,0,0,1,0,0|2,0,1]=4 2752 B8R1.18 CC1OC(C)CC1S Amb22234723 [0,0,0,1,0,0|2,0,1]=4 2753 B8R1.18 CC1OC(N)=NC1C Amb24452888 [0,0,0,1,0,0|2,0,0]=3 2754 B8R1.18 CC1OC(O)CC1O Amb25696669 [0,0,0,1,0,0|1,0,2]=4 2755 B8R1.18 CC1SC(C)=NC1C Amb24395336 [0,0,0,1,0,0|2,1,0]=4 2756 B8R1.18 CC=1CC(=O)CC1C Amb25318947 [0,0,0,1,0,0|1,0,2]=4 2757 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,0,0,1,0,0|1,0,2]=4 2758 B8R1.18 CC=1OC(=O)NC1C Amb19516947 [0,0,0,1,0,0|1,0,2]=4 2759 B8R1.18 CC=1OC(=O)OC1C Amb19654027 [0,0,0,1,0,0|1,0,2]=4 2760 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,0,0,1,0,0|2,0,1]=4 2761 B8R1.18 C[C@@H]1CC(=O)C[C@@H]1C Amb22230244 [0,0,0,1,0,0|1,0,0]=2 2762 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,0,0,1,0,0|1,0,0]=2 2763 B8R1.18 C[C@@H]1CC(=O)NC1=O Amb25709913 [0,0,0,1,0,0|2,0,1]=4 2764 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,0,0,1,0,0|1,0,1]=3 2765 B8R1.18 C[C@@H]1C[C@@H](O)C[C@H]1O Amb25261754 [0,0,0,1,0,0|2,0,1]=4 2766 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,0,0,1,0,0|2,0,1]=4 2767 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O Amb24760967 [0,0,0,1,0,0|2,0,0]=3 2768 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1S Amb24586770 [0,0,0,1,0,0|2,0,0]=3 2769 B8R1.18 C[C@@H]1NC(=O)C[C@H]1C Amb24550340 [0,0,0,1,0,0|1,0,0]=2 2770 B8R1.18 C[C@@H]1NC(=O)C[C@H]1O Amb25203404 [0,0,0,1,0,0|2,0,0]=3 2771 B8R1.18 C[C@@H]1NC(=O)C[C@H]1S Amb24685136 [0,0,0,1,0,0|2,0,0]=3 2772 B8R1.18 C[C@@H]1NC(=O)N[C@@H]1C Amb25791194 [0,0,0,1,0,0|2,0,0]=3 2773 B8R1.18 C[C@@H]1OC(=N)N[C@@H]1C Amb24523145 [0,0,0,1,0,0|2,0,0]=3 2774 B8R1.18 C[C@@H]1OC(=O)C=C1O Amb25087875 [0,0,0,1,0,0|1,0,2]=4 2775 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,0,0,1,0,0|1,0,0]=2 2776 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,0,0,1,0,0|0,0,0]=1 2777 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,0,0,1,0,0|1,0,0]=2 2778 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,0,0,1,0,0|1,0,0]=2 2779 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,0,0,1,0,0|1,0,0]=2 2780 B8R1.18 C[C@@H]1OC(=S)N[C@H]1C Amb24746694 [0,0,0,1,0,0|1,1,0]=3 2781 B8R1.18 C[C@@H]1OC(C)C[C@H]1O Amb25176118 [0,0,0,1,0,0|2,0,1]=4 2782 B8R1.18 C[C@@H]1OC(O)C[C@H]1O Amb25177050 [0,0,0,1,0,0|1,0,2]=4 2783 B8R1.18 C[C@@H]1O[C@@H](O)C[C@H]1C Amb24597062 [0,0,0,1,0,0|0,0,2]=3 2784 B8R1.18 C[C@@H]1SC(=O)N[C@@H]1C Amb24606920 [0,0,0,1,0,0|1,1,0]=3 2785 B8R1.18 C[C@@H]1SC(=S)N[C@@H]1C Amb24760931 [0,0,0,1,0,0|1,2,0]=4 2786 B8R1.18 C[C@@H]1SC(=S)N[C@H]1C Amb24761044 [0,0,0,1,0,0|1,2,0]=4 2787 B8R1.18 C[C@H]1NC(=S)N[C@@H]1C Amb25203822 [0,0,0,1,0,0|2,1,0]=4 2788 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,0,0,1,0,0|0,0,0]=1 2789 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,0,0,1,0,0|1,0,0]=2 2790 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,0,0,1,0,0|1,0,0]=2 2791 B8R1.18 C[C@H]1OC(C)C[C@H]1O Amb24588218 [0,0,0,1,0,0|2,0,1]=4 2792 B8R1.18 C[C@H]1OC(O)C[C@@H]1C Amb24616560 [0,0,0,1,0,0|0,0,2]=3 2793 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,0,0,1,0,0|2,0,1]=4 2794 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,0,0,1,0,0|2,0,0]=3 2795 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,0,0,1,0,0|2,0,1]=4 2796 B8R1.18 O=C1C=C(C(C1)C)C Amb16191977 [0,0,0,1,0,0|1,0,1]=3 2797 B8R1.18 O=C1CC(C(=O)N1)C Amb10609734 [0,0,0,1,0,0|2,0,1]=4 2798 B8R1.18 O=C1C[C@@H](Cl)[C@H](Cl)C1 Amb25139007 [0,0,0,1,0,0|3,0,0]=4 2799 B8R1.18 O=C1C[C@H](Cl)[C@@H](Cl)C1 Amb24515104 [0,0,0,1,0,0|3,0,0]=4 2800 B8R1.18 O=C1OC(=O)CC1Cl Amb24677749 [0,0,0,1,0,0|2,0,1]=4 2801 B8R1.18 O=C1OC(=O)C[C@@H]1Br Amb24558394 [0,0,0,1,0,0|2,0,1]=4 2802 B8R1.18 O=C1OC(=O)C[C@@H]1Cl Amb25837364 [0,0,0,1,0,0|2,0,1]=4 2803 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,0,0,1,0,0|3,0,0]=4 2804 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,0,0,1,0,0|3,0,0]=4 2805 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,0,0,1,0,0|3,0,0]=4 2806 B8R1.18 O[C@@H]1CC(=O)OC1=O Amb25142904 [0,0,0,1,0,0|2,0,1]=4 2807 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 2808 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,0|0,0,2]=3 2809 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,0|0,0,2]=3 2810 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,0,0,1,0,0|0,0,2]=3 2811 B8R1.20 CC1CC1CB(O)O Amb24641424 [0,0,0,1,0,0|1,0,1]=3 2812 B8R1.20 CC1CC1CC(N)=O Amb25772500 [0,0,0,1,0,0|1,0,0]=2 2813 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,0|0,0,0]=1 2814 B8R1.20 CC1CC1NC(N)=O Amb25074259 [0,0,0,1,0,0|2,0,0]=3 2815 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,0|2,1,0]=4 2816 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,0|1,0,0]=2 2817 B8R1.20 CC1OC1C[N+]([O-])=O Amb25205724 [0,0,0,1,0,0|2,0,1]=4 2818 B8R1.20 C[C@@H]1C[C@H]1CC(C)=O Amb24373459 [0,0,0,1,0,0|1,0,0]=2 2819 B8R1.20 C[C@@H]1C[C@H]1NC(C)=O Amb24619123 [0,0,0,1,0,0|2,0,0]=3 2820 B8R1.20 C[C@@H]1O[C@H]1CC(N)=O Amb24629162 [0,0,0,1,0,0|2,0,0]=3 2821 B8R1.20 C[C@H]1C[C@H]1CC(C)=O Amb25257655 [0,0,0,1,0,0|1,0,0]=2 2822 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,0|0,0,0]=1 2823 B8R1.20 C[C@H]1C[C@H]1NC(N)=O Amb24532410 [0,0,0,1,0,0|2,0,0]=3 2824 B8R1.20 C[C@H]1O[C@@H]1CC(C)O Amb25176687 [0,0,0,1,0,0|2,0,1]=4 2825 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,0|1,0,0]=2 2826 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,0|1,0,0]=2 2827 B8R1.31 CC(=C)[C@@H]1CC[C@H]1O Amb24625276 [0,0,0,1,0,0|3,0,0]=4 2828 B8R1.31 CC(=O)C1CCN1C Amb25196048 [0,0,0,1,0,0|2,0,0]=3 2829 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,0,0,1,0,0|1,0,0]=2 2830 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,0,0,1,0,0|1,0,0]=2 2831 B8R1.31 CC1CCC1C(C)Br Amb25823473 [0,0,0,1,0,0|2,0,1]=4 2832 B8R1.31 CC1CCC1C(C)N Amb24476174 [0,0,0,1,0,0|2,0,1]=4 2833 B8R1.31 CC1CCC1C(C)O Amb25270791 [0,0,0,1,0,0|1,0,1]=3 2834 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,0,0,1,0,0|1,0,0]=2 2835 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,0|0,0,0]=1 2836 B8R1.31 CC1CCN1C(N)=O Amb24748909 [0,0,0,1,0,0|2,0,0]=3 2837 B8R1.31 CN1CCC1C(N)=O Amb22227962 [0,0,0,1,0,0|2,0,0]=3 2838 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,1,0,0|1,0,0]=2 2839 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,1,0,0|1,0,0]=2 2840 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,1,0,0|1,0,0]=2 2841 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,0|0,0,0]=1 2842 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,0,0,1,0,0|1,0,0]=2 2843 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,0|0,0,0]=1 2844 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,0|0,0,0]=1 2845 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,0,0,1,0,0|1,0,0]=2 2846 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,0,0,1,0,0|2,0,0]=3 2847 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,0,0,1,0,0|2,0,0]=3 2848 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,0,0,1,0,0|2,0,0]=3 2849 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,0,0,1,0,0|2,0,0]=3 2850 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,0,0,1,0,0|3,0,0]=4 2851 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,1,0,0|2,0,0]=3 2852 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,0,0,1,0,0|2,0,0]=3 2853 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,1,0,0|1,0,0]=2 2854 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,1,0,0|1,0,0]=2 2855 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,0,0,1,0,0|2,0,0]=3 2856 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,0,0,1,0,0|2,0,0]=3 2857 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,0,0,1,0,0|2,0,0]=3 2858 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,0,0,1,0,0|2,0,0]=3 2859 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,0,0,1,0,0|2,0,0]=3 2860 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,0,0,1,0,0|2,0,0]=3 2861 B8R1.31 OC(=O)C1C=CC1Cl Amb24482989 [0,0,0,1,0,0|1,0,2]=4 2862 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,1,0,0|1,0,0]=2 2863 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,0,0,1,0,0|2,0,1]=4 2864 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,1,0,0|1,0,0]=2 2865 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,1,0,0|1,0,0]=2 2866 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,1,0,0|1,0,0]=2 2867 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,0,0,1,0,0|1,0,2]=4 2868 B8R1.34 C=C(Br)CN1CCC1 Amb22896555 [0,0,0,1,0,0|3,0,0]=4 2869 B8R1.34 C=C(Br)CN1CCC1 Amb25136715 [0,0,0,1,0,0|3,0,0]=4 2870 B8R1.34 CC(=C)CC1CCC1 Amb25141378 [0,0,0,1,0,0|2,0,0]=3 2871 B8R1.34 CC(=C)CC1CNC1 Amb24576858 [0,0,0,1,0,0|3,0,0]=4 2872 B8R1.34 CC(=O)C=C1CCC1 Amb21858878 [0,0,0,1,0,0|1,0,2]=4 2873 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,0,0,1,0,0|1,0,0]=2 2874 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,0,0,1,0,0|2,0,0]=3 2875 B8R1.34 CC(=O)CN1CCC1 Amb25266769 [0,0,0,1,0,0|2,0,0]=3 2876 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,0,0,1,0,0|3,0,0]=4 2877 B8R1.34 CC(=O)OC1CCC1 Amb25215621 [0,0,0,1,0,0|2,0,0]=3 2878 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,0,0,1,0,0|3,0,0]=4 2879 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,0,0,1,0,0|3,0,0]=4 2880 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,0,0,1,0,0|3,0,0]=4 2881 B8R1.34 CC(Br)CC1CCC1 Amb25335129 [0,0,0,1,0,0|2,0,1]=4 2882 B8R1.34 CC(N)CC1CCC1 Amb25368240 [0,0,0,1,0,0|2,0,1]=4 2883 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,0,0,1,0,0|1,0,1]=3 2884 B8R1.34 CC(O)CC1CSC1 Amb25746467 [0,0,0,1,0,0|2,0,1]=4 2885 B8R1.34 CC(S)CC1CCC1 Amb24421800 [0,0,0,1,0,0|1,1,1]=4 2886 B8R1.34 CN(CC1CCC1)C Amb1779269 [0,0,0,1,0,0|3,0,0]=4 2887 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,0,0,1,0,0|1,0,1]=3 2888 B8R1.34 C[C@@H](O)CN1CCC1 Amb25787395 [0,0,0,1,0,0|2,0,1]=4 2889 B8R1.34 C[C@H](N)CC1CCC1 Amb24483051 [0,0,0,1,0,0|2,0,1]=4 2890 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,0,0,1,0,0|1,0,1]=3 2891 B8R1.34 C[C@H](O)CN1CCC1 Amb24735102 [0,0,0,1,0,0|2,0,1]=4 2892 B8R1.34 NC(=N)CC1CCC1 Amb25693457 [0,0,0,1,0,0|2,0,0]=3 2893 B8R1.34 NC(=N)NC1CCC1 Amb24433597 [0,0,0,1,0,0|3,0,0]=4 2894 B8R1.34 NC(=O)CC1CCN1 Amb24561003 [0,0,0,1,0,0|2,0,0]=3 2895 B8R1.34 NC(=O)CC1COC1 Amb25080580 [0,0,0,1,0,0|2,0,0]=3 2896 B8R1.34 NC(=O)CN1CCC1 Amb25167404 [0,0,0,1,0,0|2,0,0]=3 2897 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,0,0,1,0,0|2,0,0]=3 2898 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,0,0,1,0,0|3,0,0]=4 2899 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,0,0,1,0,0|3,0,0]=4 2900 B8R1.34 NC(=S)NC1CCC1 Amb24619949 [0,0,0,1,0,0|2,1,0]=4 2901 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,0,0,1,0,0|1,0,0]=2 2902 B8R1.34 OB(O)CN1CCC1 Amb24526709 [0,0,0,1,0,0|2,0,1]=4 2903 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,0,0,1,0,0|0,0,2]=3 2904 B8R1.34 OC(=O)C=C1CSC1 Amb24379733 [0,0,0,1,0,0|1,0,2]=4 2905 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,0,0,1,0,0|1,0,0]=2 2906 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,0,0,1,0,0|1,0,0]=2 2907 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,0,0,1,0,0|1,0,0]=2 2908 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,0,0,1,0,0|1,0,0]=2 2909 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,0,0,1,0,0|1,0,0]=2 2910 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,0,0,1,0,0|0,0,2]=3 2911 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,0,0,1,0,0|1,0,0]=2 2912 B8R1.34 [O-][N+](=O)CC1COC1 Amb21961002 [0,0,0,1,0,0|2,0,1]=4 2913 B8R1.40 CC(CC1CO1)SC Amb24376170 [0,0,0,1,0,0|2,0,1]=4 2914 B8R1.42 CC(=N)NC1(C)CC1 Amb24584180 [0,0,0,1,0,0|3,0,0]=4 2915 B8R1.42 CC(=O)CC1(C)CC1 Amb10607353 [0,0,0,1,0,0|1,0,0]=2 2916 B8R1.42 CC(=O)CC1(C)CO1 Amb25232199 [0,0,0,1,0,0|2,0,0]=3 2917 B8R1.42 CC(=O)CC1(F)CC1 Amb24748494 [0,0,0,1,0,0|2,0,0]=3 2918 B8R1.42 CC(=O)NC1(C)CC1 Amb24372211 [0,0,0,1,0,0|2,0,0]=3 2919 B8R1.42 CC(=O)OC1(C)CC1 Amb10069988 [0,0,0,1,0,0|2,0,0]=3 2920 B8R1.42 CC(O)CC1(C)CO1 Amb25135513 [0,0,0,1,0,0|2,0,1]=4 2921 B8R1.42 CC(O)CC1(N)CC1 Amb18833015 [0,0,0,1,0,0|2,0,1]=4 2922 B8R1.42 CC(O)CC1(O)CC1 Amb25336996 [0,0,0,1,0,0|2,0,1]=4 2923 B8R1.42 CC1(CC(N)=O)CC1 Amb24393728 [0,0,0,1,0,0|1,0,0]=2 2924 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,0,0,1,0,0|0,0,0]=1 2925 B8R1.42 CC1(CC1)NC(N)=N Amb24695132 [0,0,0,1,0,0|3,0,0]=4 2926 B8R1.42 CC1(CC1)NC(N)=O Amb24579273 [0,0,0,1,0,0|2,0,0]=3 2927 B8R1.42 CC1(CC1)NC(N)=S Amb25233978 [0,0,0,1,0,0|2,1,0]=4 2928 B8R1.42 C[C@@H](O)C[C@]1(C)CO1 Amb25218841 [0,0,0,1,0,0|2,0,1]=4 2929 B8R1.42 NC1(CC(O)=O)CC1 Amb18833024 [0,0,0,1,0,0|1,0,0]=2 2930 B8R1.42 NC1(CC(O)=O)CC1 Amb21964520 [0,0,0,1,0,0|1,0,0]=2 2931 B8R1.42 OC(=O)CC1(O)CC1 Amb24117238 [0,0,0,1,0,0|1,0,0]=2 2932 B8R1.43 C#C[C@@H]1C[C@H]1C(O)=O Amb25294666 [0,0,0,1,0,0|0,0,2]=3 2933 B8R1.43 C#C[C@H]1C[C@@H]1C(O)=O Amb24076488 [0,0,0,1,0,0|0,0,2]=3 2934 B8R1.43 C=CC1CC1C(N)=O Amb24530246 [0,0,0,1,0,0|1,0,2]=4 2935 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,0,0,1,0,0|0,0,2]=3 2936 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,0,0,1,0,0|0,0,2]=3 2937 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,0,0,1,0,0|2,0,0]=3 2938 B8R1.43 CC(=O)[C@@H]1C[C@@H]1C=C Amb25784181 [0,0,0,1,0,0|1,0,2]=4 2939 B8R1.43 CC(=O)[C@H]1C[C@@H]1C=C Amb24570441 [0,0,0,1,0,0|1,0,2]=4 2940 B8R1.43 CC(O)[C@@H]1C[C@H]1CC Amb24733487 [0,0,0,1,0,0|1,0,1]=3 2941 B8R1.43 CC(O)[C@H]1C[C@H]1CO Amb25260054 [0,0,0,1,0,0|2,0,1]=4 2942 B8R1.43 CCC1CC1C(N)=O Amb24482378 [0,0,0,1,0,0|1,0,0]=2 2943 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,0,0,1,0,0|0,0,0]=1 2944 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,0,0,1,0,0|1,0,0]=2 2945 B8R1.43 CC[C@@H]1C[C@@H]1C(C)=O Amb25779618 [0,0,0,1,0,0|1,0,0]=2 2946 B8R1.43 CC[C@@H]1C[C@H]1C(=O)Cl Amb24606720 [0,0,0,1,0,0|1,0,0]=2 2947 B8R1.43 CC[C@@H]1C[C@H]1C(C)=O Amb25809901 [0,0,0,1,0,0|1,0,0]=2 2948 B8R1.43 CC[C@@H]1C[C@H]1C(N)=O Amb24532446 [0,0,0,1,0,0|1,0,0]=2 2949 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,0,0,1,0,0|0,0,0]=1 2950 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,0,0,1,0,0|1,0,0]=2 2951 B8R1.43 CC[C@H]1C[C@H]1C(C)=O Amb24635581 [0,0,0,1,0,0|1,0,0]=2 2952 B8R1.43 COC1CC1C(C)=O Amb25252874 [0,0,0,1,0,0|2,0,0]=3 2953 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,0,0,1,0,0|1,0,0]=2 2954 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,0,0,1,0,0|1,0,0]=2 2955 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CC Amb25358065 [0,0,0,1,0,0|1,0,1]=3 2956 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CO Amb25206739 [0,0,0,1,0,0|2,0,1]=4 2957 B8R1.43 C[C@H](O)[C@@H]1C[C@@H]1CO Amb25175328 [0,0,0,1,0,0|2,0,1]=4 2958 B8R1.43 C[C@H](O)[C@@H]1C[C@H]1CO Amb24588289 [0,0,0,1,0,0|2,0,1]=4 2959 B8R1.43 C[C@H](O)[C@H]1C[C@H]1CO Amb24732834 [0,0,0,1,0,0|2,0,1]=4 2960 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,0,0,1,0,0|0,0,2]=3 2961 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,0,0,1,0,0|0,0,2]=3 2962 B8R1.43 N#CC1CC1C(O)=O Amb24183452 [0,0,0,1,0,0|1,0,1]=3 2963 B8R1.43 N#C[C@@H]1C[C@@H]1C(O)=O Amb24183522 [0,0,0,1,0,0|1,0,1]=3 2964 B8R1.43 N#C[C@@H]1C[C@H]1C(O)=O Amb24183456 [0,0,0,1,0,0|1,0,1]=3 2965 B8R1.43 N#C[C@H]1C[C@H]1C(O)=O Amb25168974 [0,0,0,1,0,0|1,0,1]=3 2966 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,0,0,1,0,0|2,0,0]=3 2967 B8R1.43 NC(=O)C1OC1CBr Amb25702387 [0,0,0,1,0,0|3,0,0]=4 2968 B8R1.43 NC(=O)C1OC1CO Amb25351466 [0,0,0,1,0,0|3,0,0]=4 2969 B8R1.43 NC(=O)[C@@H]1O[C@H]1CO Amb25229010 [0,0,0,1,0,0|3,0,0]=4 2970 B8R1.43 NCC1CC1C(N)=O Amb24604918 [0,0,0,1,0,0|2,0,0]=3 2971 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,0,0,1,0,0|1,0,0]=2 2972 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,0,0,1,0,0|2,0,0]=3 2973 B8R1.43 OB(O)[C@H]1C[C@@H]1CCl Amb24551898 [0,0,0,1,0,0|2,0,1]=4 2974 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,0,0,1,0,0|1,0,1]=3 2975 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,0,0,1,0,0|1,0,0]=2 2976 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,0,0,1,0,0|1,0,1]=3 2977 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,0,0,1,0,0|1,0,0]=2 2978 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,0,0,1,0,0|2,0,0]=3 2979 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,0,0,1,0,0|1,0,0]=2 2980 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,0,0,1,0,0|1,0,0]=2 2981 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,0,0,1,0,0|1,0,0]=2 2982 B8R1.43 [O-]C(=O)C1OC1CO Amb24557010 [0,0,0,1,0,0|2,0,1]=4 2983 B8R1.43 [O-]C(=O)[C@@H]1O[C@H]1CO Amb25215740 [0,0,0,1,0,0|2,0,1]=4 2984 B8R1.43 [O-]C(=O)[C@H]1O[C@@H]1CO Amb24541614 [0,0,0,1,0,0|2,0,1]=4 2985 B8R1.43 [O-][N+](=O)C1CC1CO Amb23571861 [0,0,0,1,0,0|2,0,1]=4 2986 B8R1.51 BrC1CCS(=O)(=O)C1 Amb2548437 [0,0,0,1,0,0|2,0,1]=4 2987 B8R1.51 CC1(O)CC(N)CC1 Amb24483255 [0,0,0,1,0,0|2,0,1]=4 2988 B8R1.51 CC1CC(C)(O)CS1 Amb24332391 [0,0,0,1,0,0|2,0,1]=4 2989 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,0,0,1,0,0|1,0,1]=3 2990 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,0,0,1,0,0|2,0,1]=4 2991 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,0,0,1,0,0|2,0,1]=4 2992 B8R1.51 CN1CC(C)(O)CC1 Amb24529596 [0,0,0,1,0,0|2,0,1]=4 2993 B8R1.51 ClC1CCS(=O)(=O)C1 Amb2505054 [0,0,0,1,0,0|2,0,1]=4 2994 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,0,0,1,0,0|2,0,1]=4 2995 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,0,0,1,0,0|2,0,1]=4 2996 B8R1.51 NC1CC[S+]([O-])(=O)C1 Amb17726901 [0,0,0,1,0,0|2,0,1]=4 2997 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,0,0,1,0,0|2,0,0]=3 2998 B8R1.51 NC1CS(=O)(=O)CC1 Amb22345691 [0,0,0,1,0,0|2,0,1]=4 2999 B8R1.51 N[C@@H]1CS(=O)(=O)CC1 Amb24563288 [0,0,0,1,0,0|2,0,1]=4 3000 B8R1.51 O=S1(=O)CC(I)CC1 Amb19517046 [0,0,0,1,0,0|2,0,1]=4 3001 B8R1.51 O=S1(=O)CC([S-])CC1 Amb18526895 [0,0,0,1,0,0|2,0,1]=4 3002 B8R1.51 OC1CCS(=O)(=O)C1 Amb1068281 [0,0,0,1,0,0|2,0,1]=4 3003 B8R1.51 OC1CC[S+](=O)(C1)[O-] Amb10236942 [0,0,0,1,0,0|2,0,1]=4 3004 B8R1.51 O[C@@H]1CS(=O)(=O)CC1 Amb25837922 [0,0,0,1,0,0|2,0,1]=4 3005 B8R1.51 [18OH]C1CCS(=O)(=O)C1 Amb2548438 [0,0,0,1,0,0|2,0,1]=4 3006 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2459236 [0,0,0,1,0,0|2,0,1]=4 3007 B8R1.53 CNC1CS(=O)(=O)C1 Amb24631404 [0,0,0,1,0,0|2,0,1]=4 3008 B8R1.53 C[C@@]1(O)C[C@@H](CN)C1 Amb23440209 [0,0,0,1,0,0|2,0,1]=4 3009 B8R1.53 C[C@@]1(O)C[C@H](CN)C1 Amb23440242 [0,0,0,1,0,0|2,0,1]=4 3010 B8R1.53 O=S1(=O)CC(CBr)C1 Amb24663256 [0,0,0,1,0,0|2,0,1]=4 3011 B8R1.62 CC1(CC(=O)C1)C#N Amb25830064 [0,0,0,1,0,0|2,0,1]=4 3012 B8R1.62 CC1(CC(=O)N1)C=C Amb24347816 [0,0,0,1,0,0|1,0,2]=4 3013 B8R1.62 CC1(CCl)CC(=O)O1 Amb25784185 [0,0,0,1,0,0|1,0,0]=2 3014 B8R1.62 CC1(CN)CC(=C)C1 Amb25227928 [0,0,0,1,0,0|3,0,0]=4 3015 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,0,0,1,0,0|2,0,0]=3 3016 B8R1.62 CC1(CS)CC(=O)N1 Amb25771053 [0,0,0,1,0,0|2,0,0]=3 3017 B8R1.62 CCC1(C)CC(=O)N1 Amb24443895 [0,0,0,1,0,0|1,0,0]=2 3018 B8R1.62 CC[C@@]1(C)CC(=O)N1 Amb25766440 [0,0,0,1,0,0|1,0,0]=2 3019 B8R1.62 COC1(C)CC(=O)C1 Amb24686485 [0,0,0,1,0,0|2,0,0]=3 3020 B8R1.62 C[C@@H]1C[C@@](C)(CO)O1 Amb24719752 [0,0,0,1,0,0|2,0,1]=4 3021 B8R1.62 C[C@@]1(CC(=O)N1)C=C Amb25770505 [0,0,0,1,0,0|1,0,2]=4 3022 B8R1.62 C[C@H]1C[C@@](C)(CO)O1 Amb24688454 [0,0,0,1,0,0|2,0,1]=4 3023 B8R1.67 CC(=O)C1C(C)C1C Amb24722893 [0,0,0,1,0,0|1,0,0]=2 3024 B8R1.67 CC(=O)[C@@H]1[C@@H](C)C1=C Amb24634605 [0,0,0,1,0,0|1,0,2]=4 3025 B8R1.67 CC(=O)[C@H]1[C@H](C)C1=C Amb25336490 [0,0,0,1,0,0|1,0,2]=4 3026 B8R1.67 CC(O)C1C(C)C1C Amb25199981 [0,0,0,1,0,0|1,0,1]=3 3027 B8R1.67 CC1C(C1C)C(N)=O Amb24627878 [0,0,0,1,0,0|1,0,0]=2 3028 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,0,0,1,0,0|0,0,0]=1 3029 B8R1.67 CC1C(Cl)C1C(C)=O Amb25122776 [0,0,0,1,0,0|2,0,0]=3 3030 B8R1.67 CC1C(N)C1C(O)=O Amb25764435 [0,0,0,1,0,0|1,0,0]=2 3031 B8R1.67 CC=1C(C(O)=O)C1C Amb25737086 [0,0,0,1,0,0|0,0,2]=3 3032 B8R1.67 CC=1C(C)C1C(O)=O Amb24586301 [0,0,0,1,0,0|0,0,2]=3 3033 B8R1.67 CC=1[C@H](C)C1C(O)=O Amb24445514 [0,0,0,1,0,0|0,0,2]=3 3034 B8R1.67 C[C@@H]1[C@@H](Br)[C@H]1C(C)=O Amb24654990 [0,0,0,1,0,0|2,0,0]=3 3035 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(N)=O Amb24332855 [0,0,0,1,0,0|1,0,0]=2 3036 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,0,0,1,0,0|0,0,0]=1 3037 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,0,0,1,0,0|0,0,0]=1 3038 B8R1.67 C[C@H]1[C@@H](Br)[C@@H]1C(C)=O Amb25216918 [0,0,0,1,0,0|2,0,0]=3 3039 B8R1.67 C[C@H]1[C@@H](Cl)[C@@H]1C(C)=O Amb25179034 [0,0,0,1,0,0|2,0,0]=3 3040 B8R1.67 C[C@H]1[C@H](Br)[C@@H]1C(C)=O Amb25300342 [0,0,0,1,0,0|2,0,0]=3 3041 B8R1.67 C[C@H]1[C@H](N)[C@@H]1C(O)=O Amb24698691 [0,0,0,1,0,0|1,0,0]=2 3042 B8R1.83 CC1OC1C(O)CC Amb25296412 [0,0,0,1,0,0|2,0,1]=4 3043 B6R0.3 C#CC(O)C(O)=O Amb22731622 [0,0,0,0,1,0|1,0,2]=4 3044 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [0,0,0,0,1,0|1,0,2]=4 3045 B6R0.3 C=C(CF)C(O)=O Amb25215375 [0,0,0,0,1,0|1,0,2]=4 3046 B6R0.3 C=C(CI)C(O)=O Amb24419641 [0,0,0,0,1,0|1,0,2]=4 3047 B6R0.3 C=C(CN)C(O)=O Amb25200864 [0,0,0,0,1,0|1,0,2]=4 3048 B6R0.3 C=C(CO)C(O)=O Amb18121817 [0,0,0,0,1,0|1,0,2]=4 3049 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [0,0,0,0,1,0|1,0,2]=4 3050 B6R0.3 C=CC(N)C(O)=O Amb20240543 [0,0,0,0,1,0|1,0,2]=4 3051 B6R0.3 C=CC(O)C(O)=O Amb24061247 [0,0,0,0,1,0|1,0,2]=4 3052 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [0,0,0,0,1,0|1,0,2]=4 3053 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [0,0,0,0,1,0|1,0,2]=4 3054 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [0,0,0,0,1,0|1,0,2]=4 3055 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [0,0,0,0,1,0|1,0,2]=4 3056 B6R0.3 CC(=C=C)C(=O)O Amb17593066 [0,0,0,0,1,0|0,0,3]=4 3057 B6R0.3 CC(=CCl)C(O)=O Amb25692582 [0,0,0,0,1,0|1,0,2]=4 3058 B6R0.3 CC(=CN)C(O)=O Amb25375168 [0,0,0,0,1,0|1,0,2]=4 3059 B6R0.3 CC(=CO)C(O)=O Amb25745269 [0,0,0,0,1,0|1,0,2]=4 3060 B6R0.3 CC(=NBr)C(O)=O Amb24518467 [0,0,0,0,1,0|2,0,1]=4 3061 B6R0.3 CC(=NC)C(C)=O Amb25179556 [0,0,0,0,1,0|2,0,1]=4 3062 B6R0.3 CC(=NC)C(N)=O Amb25339049 [0,0,0,0,1,0|2,0,1]=4 3063 B6R0.3 CC(=O)C(Br)CO Amb24649743 [0,0,0,0,1,0|3,0,0]=4 3064 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [0,0,0,0,1,0|3,0,0]=4 3065 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [0,0,0,0,1,0|3,0,0]=4 3066 B6R0.3 CC(=O)C(F)CO Amb24725289 [0,0,0,0,1,0|3,0,0]=4 3067 B6R0.3 CC(=O)C(N)CN Amb24479898 [0,0,0,0,1,0|3,0,0]=4 3068 B6R0.3 CC(=O)C(N)CO Amb18640011 [0,0,0,0,1,0|3,0,0]=4 3069 B6R0.3 CC(=O)C(N)CS Amb24479874 [0,0,0,0,1,0|3,0,0]=4 3070 B6R0.3 CC(=O)C(O)CN Amb24636554 [0,0,0,0,1,0|3,0,0]=4 3071 B6R0.3 CC(=O)N(C)CCl Amb24428489 [0,0,0,0,1,0|3,0,0]=4 3072 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [0,0,0,0,1,0|3,0,0]=4 3073 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [0,0,0,0,1,0|3,0,0]=4 3074 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,0,0,0,1,0|3,0,0]=4 3075 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [0,0,0,0,1,0|3,0,0]=4 3076 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [0,0,0,0,1,0|3,0,0]=4 3077 B6R0.3 CC(C#C)C(O)=O Amb25085390 [0,0,0,0,1,0|0,0,2]=3 3078 B6R0.3 CC(C#N)C(N)=O Amb25336872 [0,0,0,0,1,0|2,0,1]=4 3079 B6R0.3 CC(C#N)C([O-])=O Amb22057371 [0,0,0,0,1,0|1,0,2]=4 3080 B6R0.3 CC(C#N)S(O)=O Amb25745526 [0,0,0,0,1,0|2,0,1]=4 3081 B6R0.3 CC(C(=C)C)CN Amb17593078 [0,0,0,0,1,0|3,0,0]=4 3082 B6R0.3 CC(C(=O)C)CO Amb10844844 [0,0,0,0,1,0|2,0,0]=3 3083 B6R0.3 CC(C(=O)O)C#N Amb17210512 [0,0,0,0,1,0|1,0,1]=3 3084 B6R0.3 CC(C(O)C)CN Amb10068614 [0,0,0,0,1,0|2,0,1]=4 3085 B6R0.3 CC(C=C)C(O)=O Amb21618706 [0,0,0,0,1,0|0,0,2]=3 3086 B6R0.3 CC(C=O)C(C)=O Amb18639572 [0,0,0,0,1,0|2,0,1]=4 3087 B6R0.3 CC(C=O)C(N)=O Amb24479831 [0,0,0,0,1,0|2,0,1]=4 3088 B6R0.3 CC(CBr)C(C)=O Amb25296678 [0,0,0,0,1,0|2,0,0]=3 3089 B6R0.3 CC(CBr)C(O)=O Amb22002601 [0,0,0,0,1,0|1,0,0]=2 3090 B6R0.3 CC(CBr)C(O)Cl Amb24724792 [0,0,0,0,1,0|2,0,1]=4 3091 B6R0.3 CC(CC)C(C)Br Amb18180085 [0,0,0,0,1,0|2,0,1]=4 3092 B6R0.3 CC(CC)C(C)N Amb19338145 [0,0,0,0,1,0|2,0,1]=4 3093 B6R0.3 CC(CC)C(C)S Amb25354585 [0,0,0,0,1,0|1,1,1]=4 3094 B6R0.3 CC(CC)C(Cl)Cl Amb25765238 [0,0,0,0,1,0|2,0,1]=4 3095 B6R0.3 CC(CC)C(O)Br Amb24635628 [0,0,0,0,1,0|1,0,1]=3 3096 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [0,0,0,0,1,0|2,0,0]=3 3097 B6R0.3 CC(CCl)C(=O)S Amb24410197 [0,0,0,0,1,0|1,1,0]=3 3098 B6R0.3 CC(CCl)C(C)=C Amb25147594 [0,0,0,0,1,0|3,0,0]=4 3099 B6R0.3 CC(CCl)C(C)O Amb25662521 [0,0,0,0,1,0|2,0,1]=4 3100 B6R0.3 CC(CCl)C(N)=O Amb25061744 [0,0,0,0,1,0|2,0,0]=3 3101 B6R0.3 CC(CCl)C(O)=O Amb18522181 [0,0,0,0,1,0|1,0,0]=2 3102 B6R0.3 CC(CF)C(C)=O Amb25253758 [0,0,0,0,1,0|2,0,0]=3 3103 B6R0.3 CC(CF)C(O)=O Amb24432331 [0,0,0,0,1,0|1,0,0]=2 3104 B6R0.3 CC(CI)C(C)=C Amb25701888 [0,0,0,0,1,0|3,0,0]=4 3105 B6R0.3 CC(CI)C(O)=O Amb25695307 [0,0,0,0,1,0|1,0,0]=2 3106 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [0,0,0,0,1,0|2,0,0]=3 3107 B6R0.3 CC(CN)C(C)=O Amb18639690 [0,0,0,0,1,0|2,0,0]=3 3108 B6R0.3 CC(CN)C(N)=S Amb24479604 [0,0,0,0,1,0|2,1,0]=4 3109 B6R0.3 CC(CN)S(C)=O Amb22157251 [0,0,0,0,1,0|3,0,0]=4 3110 B6R0.3 CC(CN)[N+]([O-])=O Amb24738614 [0,0,0,0,1,0|2,0,1]=4 3111 B6R0.3 CC(CO)C(C)=C Amb24539367 [0,0,0,0,1,0|3,0,0]=4 3112 B6R0.3 CC(CO)C([O-])=O Amb24123145 [0,0,0,0,1,0|1,0,1]=3 3113 B6R0.3 CC(CO)S(C)=O Amb25173825 [0,0,0,0,1,0|3,0,0]=4 3114 B6R0.3 CC(CS)C(C)=O Amb25830693 [0,0,0,0,1,0|2,0,0]=3 3115 B6R0.3 CC(CS)C(C)O Amb24334206 [0,0,0,0,1,0|2,0,1]=4 3116 B6R0.3 CC(CS)C(N)=O Amb25759660 [0,0,0,0,1,0|2,0,0]=3 3117 B6R0.3 CC(N=C)C(O)=O Amb24591339 [0,0,0,0,1,0|1,0,1]=3 3118 B6R0.3 CC(NBr)C(O)=O Amb24677636 [0,0,0,0,1,0|2,0,0]=3 3119 B6R0.3 CC(NCl)C(O)=O Amb25267473 [0,0,0,0,1,0|2,0,0]=3 3120 B6R0.3 CC(NN)C(O)=O Amb18640367 [0,0,0,0,1,0|2,0,0]=3 3121 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [0,0,0,0,1,0|2,0,1]=4 3122 B6R0.3 CC(OC)C(C)O Amb22757090 [0,0,0,0,1,0|2,0,1]=4 3123 B6R0.3 CC(OC)[C@@H](C)O Amb25831986 [0,0,0,0,1,0|2,0,1]=4 3124 B6R0.3 CC(ON)C(O)=O Amb24479235 [0,0,0,0,1,0|2,0,0]=3 3125 B6R0.3 CC(SC)C(C)O Amb25326277 [0,0,0,0,1,0|2,0,1]=4 3126 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [0,0,0,0,1,0|1,0,2]=4 3127 B6R0.3 CCC(=C)C(N)=O Amb24480748 [0,0,0,0,1,0|1,0,2]=4 3128 B6R0.3 CCC(=C)C(O)=O Amb18639591 [0,0,0,0,1,0|0,0,2]=3 3129 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,1,0|2,0,1]=4 3130 B6R0.3 CCC(=O)C(O)=O Amb22274199 [0,0,0,0,1,0|1,0,1]=3 3131 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [0,0,0,0,1,0|1,0,2]=4 3132 B6R0.3 CCC(B(O)O)C Amb10071974 [0,0,0,0,1,0|1,0,1]=3 3133 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,0,0,1,0|2,0,0]=3 3134 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,0,0,1,0|2,0,0]=3 3135 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [0,0,0,0,1,0|2,0,0]=3 3136 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [0,0,0,0,1,0|2,0,1]=4 3137 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [0,0,0,0,1,0|2,0,0]=3 3138 B6R0.3 CCC(C(=O)N)Br Amb13952819 [0,0,0,0,1,0|2,0,0]=3 3139 B6R0.3 CCC(C(=O)N)N Amb1914080 [0,0,0,0,1,0|2,0,0]=3 3140 B6R0.3 CCC(C(=O)O)S Amb17501370 [0,0,0,0,1,0|1,0,0]=2 3141 B6R0.3 CCC(C(O)C)O Amb2227553 [0,0,0,0,1,0|2,0,1]=4 3142 B6R0.3 CCC(C)C(=C)Br Amb22583745 [0,0,0,0,1,0|2,0,0]=3 3143 B6R0.3 CCC(C)N(C)C Amb24479871 [0,0,0,0,1,0|3,0,0]=4 3144 B6R0.3 CCC(C)N(C)N Amb25067967 [0,0,0,0,1,0|3,0,0]=4 3145 B6R0.3 CCC(C)S([O-])=O Amb19893328 [0,0,0,0,1,0|1,0,1]=3 3146 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [0,0,0,0,1,0|3,0,0]=4 3147 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,0,0,1,0|2,0,0]=3 3148 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,0,0,1,0|2,0,0]=3 3149 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,0,0,1,0|2,0,0]=3 3150 B6R0.3 CCC(F)C(C)=O Amb24736393 [0,0,0,0,1,0|2,0,0]=3 3151 B6R0.3 CCC(F)C(N)=O Amb25811426 [0,0,0,0,1,0|2,0,0]=3 3152 B6R0.3 CCC(F)C(O)=O Amb25716167 [0,0,0,0,1,0|1,0,0]=2 3153 B6R0.3 CCC(I)C(N)=O Amb25131171 [0,0,0,0,1,0|2,0,0]=3 3154 B6R0.3 CCC(N)C(=O)S Amb24479075 [0,0,0,0,1,0|1,1,0]=3 3155 B6R0.3 CCC(N)C(C)=O Amb18202785 [0,0,0,0,1,0|2,0,0]=3 3156 B6R0.3 CCC(N)C(N)=S Amb24573684 [0,0,0,0,1,0|2,1,0]=4 3157 B6R0.3 CCC(N)P(O)=O Amb25269903 [0,0,0,0,1,0|2,0,0]=3 3158 B6R0.3 CCC(O)C(=C)Br Amb25236591 [0,0,0,0,1,0|3,0,0]=4 3159 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,0,0,1,0|2,0,0]=3 3160 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,0,0,1,0|2,0,0]=3 3161 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,0,0,0,1,0|2,1,0]=4 3162 B6R0.3 CCC(O)C(O)=O Amb22352315 [0,0,0,0,1,0|1,0,0]=2 3163 B6R0.3 CCC(O)C(O)=O Amb22360643 [0,0,0,0,1,0|1,0,0]=2 3164 B6R0.3 CCC(O)C([O-])=O Amb17943026 [0,0,0,0,1,0|1,0,1]=3 3165 B6R0.3 CCC(O)C([O-])=O Amb24325325 [0,0,0,0,1,0|1,0,1]=3 3166 B6R0.3 CCC(O)P(O)=O Amb25169578 [0,0,0,0,1,0|2,0,0]=3 3167 B6R0.3 CCC(S)C(N)=O Amb24479879 [0,0,0,0,1,0|2,0,0]=3 3168 B6R0.3 CCN(C)C(C)=N Amb25107219 [0,0,0,0,1,0|3,0,0]=4 3169 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,0,0,0,1,0|2,0,0]=3 3170 B6R0.3 CCN(O)C(N)=O Amb24669876 [0,0,0,0,1,0|3,0,0]=4 3171 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [0,0,0,0,1,0|2,0,0]=3 3172 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [0,0,0,0,1,0|2,0,0]=3 3173 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [0,0,0,0,1,0|1,0,0]=2 3174 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [0,0,0,0,1,0|1,0,0]=2 3175 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,0,0,1,0|2,0,0]=3 3176 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [0,0,0,0,1,0|1,0,0]=2 3177 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [0,0,0,0,1,0|1,0,0]=2 3178 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,0,0,1,0|2,0,0]=3 3179 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,0,0,1,0|2,0,0]=3 3180 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [0,0,0,0,1,0|2,0,0]=3 3181 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [0,0,0,0,1,0|1,0,0]=2 3182 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [0,0,0,0,1,0|2,0,0]=3 3183 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [0,0,0,0,1,0|1,0,0]=2 3184 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [0,0,0,0,1,0|1,0,0]=2 3185 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,0,0,0,1,0|1,0,1]=3 3186 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [0,0,0,0,1,0|1,0,0]=2 3187 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [0,0,0,0,1,0|1,1,0]=3 3188 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [0,0,0,0,1,0|2,0,0]=3 3189 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [0,0,0,0,1,0|1,0,0]=2 3190 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [0,0,0,0,1,0|1,0,0]=2 3191 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [0,0,0,0,1,0|2,0,0]=3 3192 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [0,0,0,0,1,0|2,0,0]=3 3193 B6R0.3 CN(CCl)C(=O)Cl Amb25076174 [0,0,0,0,1,0|3,0,0]=4 3194 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [0,0,0,0,1,0|2,0,1]=4 3195 B6R0.3 CNC(=C)C(O)=O Amb25743212 [0,0,0,0,1,0|1,0,2]=4 3196 B6R0.3 CNC(=N)C(O)=O Amb18639921 [0,0,0,0,1,0|2,0,1]=4 3197 B6R0.3 CNC(=S)C(O)=O Amb24479905 [0,0,0,0,1,0|2,0,1]=4 3198 B6R0.3 CNC(C)C(C)=C Amb22231024 [0,0,0,0,1,0|3,0,0]=4 3199 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,0,0,0,1,0|2,0,0]=3 3200 B6R0.3 CNC(C)C(N)=N Amb24719013 [0,0,0,0,1,0|3,0,0]=4 3201 B6R0.3 CNC(C)C(O)=O Amb19373699 [0,0,0,0,1,0|1,0,0]=2 3202 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,0,0,1,0|2,0,0]=3 3203 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,0,0,1,0|2,0,0]=3 3204 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,0,0,1,0|2,0,0]=3 3205 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,0,0,1,0|2,0,0]=3 3206 B6R0.3 COC(=C)C(O)=O Amb18639906 [0,0,0,0,1,0|1,0,2]=4 3207 B6R0.3 COC(=O)C(O)=O Amb22011503 [0,0,0,0,1,0|2,0,1]=4 3208 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,0,0,0,1,0|3,0,0]=4 3209 B6R0.3 COC(C)C(N)=N Amb20622329 [0,0,0,0,1,0|3,0,0]=4 3210 B6R0.3 COC(C)C(N)=N Amb22059004 [0,0,0,0,1,0|3,0,0]=4 3211 B6R0.3 COC(C)C(N)=S Amb20622535 [0,0,0,0,1,0|2,1,0]=4 3212 B6R0.3 COC(N)C(N)=O Amb25178891 [0,0,0,0,1,0|3,0,0]=4 3213 B6R0.3 COC(N)C(O)=O Amb24621851 [0,0,0,0,1,0|2,0,0]=3 3214 B6R0.3 COC(O)C(O)=O Amb24479754 [0,0,0,0,1,0|2,0,0]=3 3215 B6R0.3 CON(C)C(N)=O Amb25305178 [0,0,0,0,1,0|3,0,0]=4 3216 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [0,0,0,0,1,0|2,0,0]=3 3217 B6R0.3 CSC(=O)C(O)=O Amb24731100 [0,0,0,0,1,0|2,0,1]=4 3218 B6R0.3 CSC(=S)C(O)=O Amb25702678 [0,0,0,0,1,0|2,0,1]=4 3219 B6R0.3 CSC(Br)C(O)=O Amb25169549 [0,0,0,0,1,0|2,0,0]=3 3220 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [0,0,0,0,1,0|2,0,0]=3 3221 B6R0.3 CSC(F)C(O)=O Amb25043740 [0,0,0,0,1,0|2,0,0]=3 3222 B6R0.3 CSC(O)C(C)=O Amb24479166 [0,0,0,0,1,0|3,0,0]=4 3223 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [0,0,0,0,1,0|1,0,0]=2 3224 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [0,0,0,0,1,0|1,0,0]=2 3225 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [0,0,0,0,1,0|1,0,0]=2 3226 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [0,0,0,0,1,0|1,0,0]=2 3227 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [0,0,0,0,1,0|2,0,1]=4 3228 B6R0.3 C[C@@H](CBr)C(C)=C Amb25772655 [0,0,0,0,1,0|3,0,0]=4 3229 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [0,0,0,0,1,0|1,0,0]=2 3230 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [0,0,0,0,1,0|1,0,1]=3 3231 B6R0.3 C[C@@H](CCl)[C@@H](C)O Amb25137880 [0,0,0,0,1,0|2,0,1]=4 3232 B6R0.3 C[C@@H](CCl)[N+]([O-])=O Amb24407369 [0,0,0,0,1,0|2,0,1]=4 3233 B6R0.3 C[C@@H](CI)C(C)=C Amb25025023 [0,0,0,0,1,0|3,0,0]=4 3234 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [0,0,0,0,1,0|1,0,0]=2 3235 B6R0.3 C[C@@H](CO)C(C)=C Amb25025795 [0,0,0,0,1,0|3,0,0]=4 3236 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [0,0,0,0,1,0|2,0,0]=3 3237 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [0,0,0,0,1,0|1,0,0]=2 3238 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [0,0,0,0,1,0|2,0,0]=3 3239 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [0,0,0,0,1,0|2,0,0]=3 3240 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [0,0,0,0,1,0|2,0,1]=4 3241 B6R0.3 C[C@@H](O)[C@H](C)CO Amb25810619 [0,0,0,0,1,0|2,0,1]=4 3242 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [0,0,0,0,1,0|2,0,1]=4 3243 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [0,0,0,0,1,0|2,0,0]=3 3244 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [0,0,0,0,1,0|1,0,0]=2 3245 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [0,0,0,0,1,0|1,0,0]=2 3246 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [0,0,0,0,1,0|2,0,1]=4 3247 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [0,0,0,0,1,0|1,0,1]=3 3248 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,0,0,1,0|2,0,0]=3 3249 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [0,0,0,0,1,0|1,0,0]=2 3250 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [0,0,0,0,1,0|1,0,0]=2 3251 B6R0.3 C[C@H](CN)[C@@H](C)O Amb24479790 [0,0,0,0,1,0|2,0,1]=4 3252 B6R0.3 C[C@H](CO)S(C)=O Amb24334035 [0,0,0,0,1,0|3,0,0]=4 3253 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [0,0,0,0,1,0|1,0,0]=2 3254 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [0,0,0,0,1,0|1,0,1]=3 3255 B6R0.3 C[C@H](NC)[C@@H](C)O Amb25113372 [0,0,0,0,1,0|2,0,1]=4 3256 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [0,0,0,0,1,0|2,0,0]=3 3257 B6R0.3 C[C@H](O)[C@@H](C)CO Amb24480821 [0,0,0,0,1,0|2,0,1]=4 3258 B6R0.3 C[C@H](O)[C@H](C)CO Amb25127201 [0,0,0,0,1,0|2,0,1]=4 3259 B6R0.3 C[C@H](OC)[C@@H](C)O Amb25084361 [0,0,0,0,1,0|2,0,1]=4 3260 B6R0.3 C[C@H](OC)[C@H](C)O Amb25167384 [0,0,0,0,1,0|2,0,1]=4 3261 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [0,0,0,0,1,0|2,0,0]=3 3262 B6R0.3 C\C(=C/N)\C(O)=O Amb24507602 [0,0,0,0,1,0|1,0,2]=4 3263 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [0,0,0,0,1,0|1,0,2]=4 3264 B6R0.3 C\C(=C\C)\C(=O)Cl Amb25173910 [0,0,0,0,1,0|1,0,2]=4 3265 B6R0.3 C\C(=C\C)\C(C)=O Amb25718935 [0,0,0,0,1,0|1,0,2]=4 3266 B6R0.3 C\C(=N\Br)\C(O)=O Amb25745370 [0,0,0,0,1,0|2,0,1]=4 3267 B6R0.3 C\C(=N\O)\C(O)=O Amb23523075 [0,0,0,0,1,0|2,0,1]=4 3268 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [0,0,0,0,1,0|1,0,2]=4 3269 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [0,0,0,0,1,0|1,0,2]=4 3270 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [0,0,0,0,1,0|1,0,2]=4 3271 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,0,0,0,1,0|3,0,0]=4 3272 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [0,0,0,0,1,0|3,0,0]=4 3273 B6R0.3 NC(=O)C(F)CF Amb25128008 [0,0,0,0,1,0|3,0,0]=4 3274 B6R0.3 NC(=O)C(F)CO Amb24507432 [0,0,0,0,1,0|3,0,0]=4 3275 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [0,0,0,0,1,0|3,0,0]=4 3276 B6R0.3 NC(C#N)C(O)=O Amb25328320 [0,0,0,0,1,0|2,0,1]=4 3277 B6R0.3 NC(C(=O)N)CO Amb17593097 [0,0,0,0,1,0|3,0,0]=4 3278 B6R0.3 NC(C(=O)O)CF Amb10839589 [0,0,0,0,1,0|2,0,0]=3 3279 B6R0.3 NC(C(=O)O)CS Amb13961966 [0,0,0,0,1,0|2,0,0]=3 3280 B6R0.3 NC(C=O)C(O)=O Amb24349579 [0,0,0,0,1,0|2,0,1]=4 3281 B6R0.3 NC(C=S)C(O)=O Amb25227802 [0,0,0,0,1,0|2,0,1]=4 3282 B6R0.3 NC(CCl)C(O)=O Amb19651457 [0,0,0,0,1,0|2,0,0]=3 3283 B6R0.3 NC(CCl)C(O)=O Amb21961077 [0,0,0,0,1,0|2,0,0]=3 3284 B6R0.3 NC(CI)C(O)=O Amb25177412 [0,0,0,0,1,0|2,0,0]=3 3285 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [0,0,0,0,1,0|2,0,0]=3 3286 B6R0.3 NC(CS)C(N)=O Amb18641990 [0,0,0,0,1,0|3,0,0]=4 3287 B6R0.3 NC(CS)C(O)=O Amb22489523 [0,0,0,0,1,0|2,0,0]=3 3288 B6R0.3 NC(CS)P(O)=O Amb25772157 [0,0,0,0,1,0|3,0,0]=4 3289 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [0,0,0,0,1,0|2,0,0]=3 3290 B6R0.3 NCC(=O)C(O)=O Amb24361938 [0,0,0,0,1,0|2,0,1]=4 3291 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [0,0,0,0,1,0|2,0,0]=3 3292 B6R0.3 NCC(C(=O)O)S Amb17593238 [0,0,0,0,1,0|2,0,0]=3 3293 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [0,0,0,0,1,0|3,0,0]=4 3294 B6R0.3 NCC(F)C(O)=O Amb22733051 [0,0,0,0,1,0|2,0,0]=3 3295 B6R0.3 NCC(N)C(N)=O Amb18122079 [0,0,0,0,1,0|3,0,0]=4 3296 B6R0.3 NCC(N)C(O)=O Amb22899095 [0,0,0,0,1,0|2,0,0]=3 3297 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [0,0,0,0,1,0|2,0,0]=3 3298 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [0,0,0,0,1,0|2,0,0]=3 3299 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [0,0,0,0,1,0|2,0,0]=3 3300 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [0,0,0,0,1,0|3,0,0]=4 3301 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [0,0,0,0,1,0|3,0,0]=4 3302 B6R0.3 NOC(F)C(O)=O Amb24446310 [0,0,0,0,1,0|3,0,0]=4 3303 B6R0.3 NOC(O)C(O)=O Amb24735537 [0,0,0,0,1,0|3,0,0]=4 3304 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [0,0,0,0,1,0|2,0,0]=3 3305 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [0,0,0,0,1,0|2,0,0]=3 3306 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [0,0,0,0,1,0|2,0,0]=3 3307 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [0,0,0,0,1,0|2,0,0]=3 3308 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [0,0,0,0,1,0|2,0,0]=3 3309 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [0,0,0,0,1,0|2,0,0]=3 3310 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [0,0,0,0,1,0|3,0,0]=4 3311 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [0,0,0,0,1,0|3,0,0]=4 3312 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [0,0,0,0,1,0|2,0,0]=3 3313 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [0,0,0,0,1,0|2,0,0]=3 3314 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [0,0,0,0,1,0|2,0,0]=3 3315 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [0,0,0,0,1,0|3,0,0]=4 3316 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [0,0,0,0,1,0|2,0,0]=3 3317 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [0,0,0,0,1,0|3,0,0]=4 3318 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [0,0,0,0,1,0|2,1,0]=4 3319 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [0,0,0,0,1,0|2,0,1]=4 3320 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [0,0,0,0,1,0|2,0,1]=4 3321 B6R0.3 OC(=O)C(=O)CF Amb22008247 [0,0,0,0,1,0|2,0,1]=4 3322 B6R0.3 OC(=O)C(=O)CF Amb22274202 [0,0,0,0,1,0|2,0,1]=4 3323 B6R0.3 OC(=O)C(=O)CS Amb22360785 [0,0,0,0,1,0|2,0,1]=4 3324 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [0,0,0,0,1,0|2,0,0]=3 3325 B6R0.3 OC(=O)C(CF)Br Amb10605519 [0,0,0,0,1,0|2,0,0]=3 3326 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [0,0,0,0,1,0|2,0,1]=4 3327 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [0,0,0,0,1,0|2,0,0]=3 3328 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [0,0,0,0,1,0|2,0,0]=3 3329 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [0,0,0,0,1,0|2,0,0]=3 3330 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [0,0,0,0,1,0|2,0,0]=3 3331 B6R0.3 OC(=O)C(F)C=O Amb22055301 [0,0,0,0,1,0|2,0,1]=4 3332 B6R0.3 OC(=O)C(F)CF Amb24746801 [0,0,0,0,1,0|2,0,0]=3 3333 B6R0.3 OC(=O)C(S)CS Amb18643295 [0,0,0,0,1,0|2,0,0]=3 3334 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [0,0,0,0,1,0|2,0,0]=3 3335 B6R0.3 OC(C=O)C(O)=O Amb18640325 [0,0,0,0,1,0|2,0,1]=4 3336 B6R0.3 OC(CBr)C(O)=O Amb24061932 [0,0,0,0,1,0|2,0,0]=3 3337 B6R0.3 OC(CCl)P(O)=O Amb25069434 [0,0,0,0,1,0|3,0,0]=4 3338 B6R0.3 OC(CS)C(O)=O Amb18642053 [0,0,0,0,1,0|2,0,0]=3 3339 B6R0.3 OCC(Br)C(O)=O Amb18126327 [0,0,0,0,1,0|2,0,0]=3 3340 B6R0.3 OCC(C(=O)O)F Amb17593117 [0,0,0,0,1,0|2,0,0]=3 3341 B6R0.3 OCC(C(=O)O)O Amb17593103 [0,0,0,0,1,0|2,0,0]=3 3342 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [0,0,0,0,1,0|2,0,0]=3 3343 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [0,0,0,0,1,0|2,0,0]=3 3344 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [0,0,0,0,1,0|1,0,0]=2 3345 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [0,0,0,0,1,0|1,0,0]=2 3346 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [0,0,0,0,1,0|2,0,0]=3 3347 B6R0.3 ONC(O)C(O)=O Amb25832155 [0,0,0,0,1,0|3,0,0]=4 3348 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [0,0,0,0,1,0|2,0,1]=4 3349 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [0,0,0,0,1,0|2,0,0]=3 3350 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [0,0,0,0,1,0|2,0,0]=3 3351 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [0,0,0,0,1,0|2,0,0]=3 3352 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [0,0,0,0,1,0|2,0,0]=3 3353 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [0,0,0,0,1,0|1,0,2]=4 3354 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [0,0,0,0,1,0|1,0,0]=2 3355 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [0,0,0,0,1,0|2,0,0]=3 3356 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [0,0,0,0,1,0|2,0,0]=3 3357 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [0,0,0,0,1,0|2,0,1]=4 3358 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [0,0,0,0,1,0|2,0,1]=4 3359 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [0,0,0,0,1,0|2,0,1]=4 3360 B6R0.3 [O-][N+](=O)C(CO)C Amb17600148 [0,0,0,0,1,0|2,0,1]=4 3361 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,0,0,0,0,1|1,0,2]=4 3362 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,0,0,0,0,1|1,0,2]=4 3363 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,0,0,0,0,1|1,0,2]=4 3364 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,0,0,0,0,1|1,0,2]=4 3365 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,0,0,0,0,1|1,0,2]=4 3366 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,0,0,0,0,1|1,0,2]=4 3367 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,0,0,0,0,1|3,0,0]=4 3368 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,0,0,0,0,1|3,0,0]=4 3369 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,0,0,0,0,1|3,0,0]=4 3370 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,0,0,0,1|3,0,0]=4 3371 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,0,0,0,0,1|3,0,0]=4 3372 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,0,0,0,0,1|3,0,0]=4 3373 B8R0.9 CC(=O)CNC(=O)CC Amb25292227 [0,0,0,0,0,1|2,0,1]=4 3374 B8R0.9 CC(=O)NCC(=O)CC Amb23555728 [0,0,0,0,0,1|2,0,1]=4 3375 B8R0.9 CC(=O)NCC(F)CBr Amb24676009 [0,0,0,0,0,1|3,0,0]=4 3376 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,0,0,0,0,1|3,0,0]=4 3377 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,0,0,0,0,1|3,0,0]=4 3378 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,0,0,0,0,1|3,0,0]=4 3379 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,0,0,0,0,1|3,0,0]=4 3380 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,0,0,0,0,1|3,0,0]=4 3381 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,0,0,0,0,1|3,0,0]=4 3382 B8R0.9 CC(=O)OCC(=C)CC Amb24571642 [0,0,0,0,0,1|1,0,2]=4 3383 B8R0.9 CC(=O)OCC(Br)CCl Amb24713634 [0,0,0,0,0,1|3,0,0]=4 3384 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,0,0,0,0,1|3,0,0]=4 3385 B8R0.9 CC(=O)OCC(Cl)CBr Amb25113223 [0,0,0,0,0,1|3,0,0]=4 3386 B8R0.9 CC(=O)OCC(Cl)CCl Amb24415406 [0,0,0,0,0,1|3,0,0]=4 3387 B8R0.9 CC(=O)OCC(F)CBr Amb25275153 [0,0,0,0,0,1|3,0,0]=4 3388 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,0,0,0,0,1|3,0,0]=4 3389 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,0,0,0,0,1|3,0,0]=4 3390 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,0,0,0,0,1|3,0,0]=4 3391 B8R0.9 CC(=O)OC[C@@H](Cl)CCl Amb24470042 [0,0,0,0,0,1|3,0,0]=4 3392 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,0,0,0,0,1|3,0,0]=4 3393 B8R0.9 CC(=O)OC[C@H](Cl)CCl Amb25300289 [0,0,0,0,0,1|3,0,0]=4 3394 B8R0.9 CC(=O)SCC(Cl)CCl Amb24572286 [0,0,0,0,0,1|3,0,0]=4 3395 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,0,0,0,0,1|3,0,0]=4 3396 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,0,0,0,0,1|3,0,0]=4 3397 B8R0.9 CC(C#C)OCC(O)=O Amb25092433 [0,0,0,0,0,1|0,0,2]=3 3398 B8R0.9 CC(C#N)NCC(N)=O Amb18981185 [0,0,0,0,0,1|2,0,1]=4 3399 B8R0.9 CC(C#N)NCC(O)=O Amb18293465 [0,0,0,0,0,1|1,0,1]=3 3400 B8R0.9 CC(C#N)SCC(C)=O Amb25134370 [0,0,0,0,0,1|2,0,1]=4 3401 B8R0.9 CC(C#N)SCC(N)=O Amb25691103 [0,0,0,0,0,1|2,0,1]=4 3402 B8R0.9 CC(C#N)SCC(O)=O Amb18293809 [0,0,0,0,0,1|1,0,1]=3 3403 B8R0.9 CC(C)CCC(C)CC Amb22228305 [0,0,0,0,0,1|2,0,1]=4 3404 B8R0.9 CC(C)NC[C@@H](C)CC Amb25711431 [0,0,0,0,0,1|2,0,1]=4 3405 B8R0.9 CC(C)SCC(C)CC Amb24642898 [0,0,0,0,0,1|2,0,1]=4 3406 B8R0.9 CC(C=C)NCC(N)=O Amb24592190 [0,0,0,0,0,1|1,0,2]=4 3407 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,0,0,0,0,1|0,0,2]=3 3408 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,0,0,0,0,1|0,0,2]=3 3409 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,0,0,0,0,1|0,0,2]=3 3410 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,0,0,0,0,1|1,0,0]=2 3411 B8R0.9 CC(CBr)COC(C)=O Amb22386917 [0,0,0,0,0,1|2,0,0]=3 3412 B8R0.9 CC(CC)=C=CC(N)=O Amb25146087 [0,0,0,0,0,1|1,0,2]=4 3413 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,0,0,0,0,1|0,0,2]=3 3414 B8R0.9 CC(CC)=NNC(C)=O Amb24732912 [0,0,0,0,0,1|2,0,1]=4 3415 B8R0.9 CC(CC)=NNC(N)=O Amb25855979 [0,0,0,0,0,1|2,0,1]=4 3416 B8R0.9 CC(CC)NCC(Cl)Cl Amb25134236 [0,0,0,0,0,1|2,0,1]=4 3417 B8R0.9 CC(CC)NCC(F)F Amb25208905 [0,0,0,0,0,1|2,0,1]=4 3418 B8R0.9 CC(CC)\C=C\C(C)O Amb24678726 [0,0,0,0,0,1|1,0,2]=4 3419 B8R0.9 CC(CCC(C)=O)C#N Amb18642304 [0,0,0,0,0,1|2,0,1]=4 3420 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,0,0,0,0,1|2,0,1]=4 3421 B8R0.9 CC(CCC(N)=O)C#N Amb25146074 [0,0,0,0,0,1|2,0,1]=4 3422 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,0,0,0,0,1|2,0,0]=3 3423 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,0,0,0,0,1|2,0,1]=4 3424 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,0,0,0,0,1|2,0,1]=4 3425 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,0,0,0,0,1|1,0,1]=3 3426 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,0,0,0,0,1|0,0,2]=3 3427 B8R0.9 CC(CCl)CCC(C)=C Amb25068704 [0,0,0,0,0,1|3,0,0]=4 3428 B8R0.9 CC(CCl)OCC(C)=O Amb25118198 [0,0,0,0,0,1|2,0,0]=3 3429 B8R0.9 CC(CCl)OCC(N)=O Amb25789772 [0,0,0,0,0,1|2,0,0]=3 3430 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,0,0,0,0,1|1,0,0]=2 3431 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,0,0,0,0,1|2,0,0]=3 3432 B8R0.9 CC(CN)NCC(=C)Cl Amb24732228 [0,0,0,0,0,1|3,0,0]=4 3433 B8R0.9 CC(CN)NC[C@H](C)O Amb25044715 [0,0,0,0,0,1|2,0,1]=4 3434 B8R0.9 CC(CN)OCC(C)=C Amb18630505 [0,0,0,0,0,1|3,0,0]=4 3435 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,0,0,0,0,1|2,0,0]=3 3436 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,0,0,0,0,1|1,0,0]=2 3437 B8R0.9 CC(CN)SCC(=C)Br Amb24391885 [0,0,0,0,0,1|3,0,0]=4 3438 B8R0.9 CC(CN)SCC(=C)Cl Amb25276051 [0,0,0,0,0,1|3,0,0]=4 3439 B8R0.9 CC(CN)SCC(C)O Amb24478776 [0,0,0,0,0,1|2,0,1]=4 3440 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,0,0,0,0,1|2,0,0]=3 3441 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,0,0,0,0,1|2,0,0]=3 3442 B8R0.9 CC(CO)CCC(C)=C Amb24389869 [0,0,0,0,0,1|3,0,0]=4 3443 B8R0.9 CC(CO)CN=C(C)N Amb24349921 [0,0,0,0,0,1|3,0,0]=4 3444 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,0,0,0,0,1|2,0,0]=3 3445 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,0,0,0,0,1|2,0,0]=3 3446 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,0,0,0,0,1|2,0,0]=3 3447 B8R0.9 CC(CO)NCC(=C)Br Amb18303323 [0,0,0,0,0,1|3,0,0]=4 3448 B8R0.9 CC(CO)NCC(=C)Cl Amb18303324 [0,0,0,0,0,1|3,0,0]=4 3449 B8R0.9 CC(CO)NCC(C)=C Amb25289088 [0,0,0,0,0,1|3,0,0]=4 3450 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,0,0,0,0,1|1,0,0]=2 3451 B8R0.9 CC(CO)SCC(=C)Br Amb25204830 [0,0,0,0,0,1|3,0,0]=4 3452 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,0,0,0,0,1|2,0,0]=3 3453 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,0,0,0,0,1|1,0,0]=2 3454 B8R0.9 CC(COC(C)=O)C#N Amb24395253 [0,0,0,0,0,1|2,0,1]=4 3455 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,0,0,0,0,1|2,0,1]=4 3456 B8R0.9 CC(COC(C)=O)NN Amb24439584 [0,0,0,0,0,1|3,0,0]=4 3457 B8R0.9 CC(O)CCC(Cl)CC Amb24480214 [0,0,0,0,0,1|2,0,1]=4 3458 B8R0.9 CC(O)CCC(O)CC Amb25090764 [0,0,0,0,0,1|2,0,1]=4 3459 B8R0.9 CC(O)CNC(C)CO Amb19005093 [0,0,0,0,0,1|2,0,1]=4 3460 B8R0.9 CC(O)COC(C)CO Amb22167327 [0,0,0,0,0,1|2,0,1]=4 3461 B8R0.9 CC(O)CO[C@H](C)CO Amb25343738 [0,0,0,0,0,1|2,0,1]=4 3462 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,0,0,0,0,1|3,0,0]=4 3463 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,0,0,0,0,1|2,0,1]=4 3464 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,0,0,0,0,1|2,0,1]=4 3465 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,0,0,0,1|1,0,1]=3 3466 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,0,0,0,0,1|2,0,1]=4 3467 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,0,0,0,0,1|2,0,1]=4 3468 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,0,0,0,0,1|2,0,1]=4 3469 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,0,0,0,0,1|1,0,1]=3 3470 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,0,0,0,0,1|1,0,1]=3 3471 B8R0.9 CCC(=O)\C=C\C(O)=O Amb18642585 [0,0,0,0,0,1|1,0,2]=4 3472 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,0,0,0,0,1|1,0,1]=3 3473 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,0,0,0,0,1|2,0,0]=3 3474 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,0,0,0,0,1|2,0,0]=3 3475 B8R0.9 CCC(Br)\C=C\C(C)=O Amb25800220 [0,0,0,0,0,1|2,0,1]=4 3476 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,0,0,0,0,1|1,0,1]=3 3477 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,0,0,0,0,1|1,0,1]=3 3478 B8R0.9 CCC(C)C=CC(C)=O Amb24062970 [0,0,0,0,0,1|1,0,1]=3 3479 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,0,0,0,0,1|1,0,1]=3 3480 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,0,0,0,0,1|1,0,0]=2 3481 B8R0.9 CCC(C)CCC(C)Br Amb19078823 [0,0,0,0,0,1|2,0,1]=4 3482 B8R0.9 CCC(C)CCC(C)Cl Amb25361898 [0,0,0,0,0,1|2,0,1]=4 3483 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,0,0,0,0,1|1,0,1]=3 3484 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,0,0,0,0,1|0,0,0]=1 3485 B8R0.9 CCC(C)CNC(C)=N Amb25770210 [0,0,0,0,0,1|2,0,0]=3 3486 B8R0.9 CCC(C)CNC(N)=N Amb25810483 [0,0,0,0,0,1|2,0,0]=3 3487 B8R0.9 CCC(C)CNC(N)=S Amb24436213 [0,0,0,0,0,1|1,1,0]=3 3488 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,0,0,0,0,1|1,0,0]=2 3489 B8R0.9 CCC(C)COC(C)=O Amb20621577 [0,0,0,0,0,1|1,0,0]=2 3490 B8R0.9 CCC(C)COC(N)=O Amb25188918 [0,0,0,0,0,1|1,0,0]=2 3491 B8R0.9 CCC(C)CSC(N)=N Amb25306741 [0,0,0,0,0,1|2,0,0]=3 3492 B8R0.9 CCC(C)NCC(=C)Br Amb19005214 [0,0,0,0,0,1|2,0,0]=3 3493 B8R0.9 CCC(C)NCC(=C)Cl Amb19004829 [0,0,0,0,0,1|2,0,0]=3 3494 B8R0.9 CCC(C)NCC(C)=O Amb25062894 [0,0,0,0,0,1|1,0,0]=2 3495 B8R0.9 CCC(C)NCC(C)Cl Amb24363856 [0,0,0,0,0,1|2,0,1]=4 3496 B8R0.9 CCC(C)NCC(C)N Amb19009701 [0,0,0,0,0,1|2,0,1]=4 3497 B8R0.9 CCC(C)NC[C@H](C)N Amb24750100 [0,0,0,0,0,1|2,0,1]=4 3498 B8R0.9 CCC(C)NNC(N)=S Amb24377573 [0,0,0,0,0,1|2,1,0]=4 3499 B8R0.9 CCC(C)OCC(=C)Br Amb24740504 [0,0,0,0,0,1|2,0,0]=3 3500 B8R0.9 CCC(C)OCC(C)N Amb19018764 [0,0,0,0,0,1|2,0,1]=4 3501 B8R0.9 CCC(C)OCC(N)=N Amb24501524 [0,0,0,0,0,1|2,0,0]=3 3502 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,0,0,0,0,1|0,0,0]=1 3503 B8R0.9 CCC(C)OC[C@@H](C)N Amb24374473 [0,0,0,0,0,1|2,0,1]=4 3504 B8R0.9 CCC(C)OC[C@H](C)N Amb24711079 [0,0,0,0,0,1|2,0,1]=4 3505 B8R0.9 CCC(C)ON=C(C)C Amb25682628 [0,0,0,0,0,1|3,0,0]=4 3506 B8R0.9 CCC(C)ONC(C)=O Amb24360136 [0,0,0,0,0,1|2,0,0]=3 3507 B8R0.9 CCC(C)ONC(N)=N Amb25694364 [0,0,0,0,0,1|3,0,0]=4 3508 B8R0.9 CCC(C)ONC(N)=O Amb24618660 [0,0,0,0,0,1|2,0,0]=3 3509 B8R0.9 CCC(C)SCC(=C)Br Amb25696158 [0,0,0,0,0,1|2,0,0]=3 3510 B8R0.9 CCC(C)SCC(C)O Amb24738776 [0,0,0,0,0,1|1,0,1]=3 3511 B8R0.9 CCC(C)SC[C@@H](C)O Amb25283171 [0,0,0,0,0,1|1,0,1]=3 3512 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,0,0,0,0,1|0,0,1]=2 3513 B8R0.9 CCC(C)\C=C\[N+]([O-])=O Amb25823649 [0,0,0,0,0,1|1,0,2]=4 3514 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,0,0,0,0,1|1,0,1]=3 3515 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,0,0,0,0,1|2,0,0]=3 3516 B8R0.9 CCC(Cl)CCC(C)=C Amb24387453 [0,0,0,0,0,1|3,0,0]=4 3517 B8R0.9 CCC(Cl)CNC(C)=O Amb25292231 [0,0,0,0,0,1|2,0,0]=3 3518 B8R0.9 CCC(Cl)COC(N)=O Amb22274267 [0,0,0,0,0,1|2,0,0]=3 3519 B8R0.9 CCC(Cl)\C=C\C(C)=O Amb25060704 [0,0,0,0,0,1|2,0,1]=4 3520 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,0,0,0,0,1|1,0,1]=3 3521 B8R0.9 CCC(F)COC(C)=O Amb24361428 [0,0,0,0,0,1|2,0,0]=3 3522 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,0,0,0,0,1|1,0,0]=2 3523 B8R0.9 CCC(N)CCS(C)=O Amb25281105 [0,0,0,0,0,1|3,0,0]=4 3524 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,0,0,0,0,1|2,0,0]=3 3525 B8R0.9 CCC(N)CNS(C)=O Amb25263509 [0,0,0,0,0,1|3,0,0]=4 3526 B8R0.9 CCC(NCC(=C)C)C Amb17308623 [0,0,0,0,0,1|2,0,0]=3 3527 B8R0.9 CCC(O)C#CC(N)=O Amb25070339 [0,0,0,0,0,1|2,0,1]=4 3528 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,0,0,0,0,1|2,0,1]=4 3529 B8R0.9 CCC(O)CCC(C)=C Amb25073903 [0,0,0,0,0,1|3,0,0]=4 3530 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,0,0,0,0,1|2,0,0]=3 3531 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,0,0,0,0,1|2,0,0]=3 3532 B8R0.9 CCC(O)CNS(C)=O Amb25176378 [0,0,0,0,0,1|3,0,0]=4 3533 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,0,0,0,0,1|1,0,0]=2 3534 B8R0.9 CCC(O)\C=C\C(C)=O Amb25107127 [0,0,0,0,0,1|2,0,1]=4 3535 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,0,0,0,0,1|1,0,1]=3 3536 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,0,0,0,0,1|1,0,1]=3 3537 B8R0.9 CCN(C)CCC(C)=C Amb24501501 [0,0,0,0,0,1|3,0,0]=4 3538 B8R0.9 CCN(C)CCC(C)O Amb25306759 [0,0,0,0,0,1|2,0,1]=4 3539 B8R0.9 CCN(C)\C=C/C(C)=O Amb25724295 [0,0,0,0,0,1|2,0,1]=4 3540 B8R0.9 CCN(C)\C=C\C(C)=O Amb24634600 [0,0,0,0,0,1|2,0,1]=4 3541 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,0,0,0,0,1|3,0,0]=4 3542 B8R0.9 CCS(=O)NCC(C)=O Amb25177389 [0,0,0,0,0,1|3,0,0]=4 3543 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,0,0,0,0,1|1,0,0]=2 3544 B8R0.9 CC[C@@H](C)CC[C@@H](C)O Amb22896942 [0,0,0,0,0,1|1,0,1]=3 3545 B8R0.9 CC[C@@H](C)CC[C@H](C)O Amb22896941 [0,0,0,0,0,1|1,0,1]=3 3546 B8R0.9 CC[C@@H](C)COC(N)=O Amb24586795 [0,0,0,0,0,1|1,0,0]=2 3547 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,0,0,0,0,1|0,0,1]=2 3548 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,0,0,0,0,1|1,0,0]=2 3549 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,0,0,0,0,1|1,0,1]=3 3550 B8R0.9 CC[C@H](C)CCN(C)C Amb25263133 [0,0,0,0,0,1|3,0,0]=4 3551 B8R0.9 CC[C@H](C)CC[C@@H](C)O Amb25055436 [0,0,0,0,0,1|1,0,1]=3 3552 B8R0.9 CC[C@H](C)COC(N)=O Amb24333141 [0,0,0,0,0,1|1,0,0]=2 3553 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,0,0,0,0,1|0,0,0]=1 3554 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,0,0,0,0,1|0,0,0]=1 3555 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,0,0,0,0,1|1,0,0]=2 3556 B8R0.9 CC[C@H](N)CSC(N)=N Amb25328324 [0,0,0,0,0,1|3,0,0]=4 3557 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,0,0,0,0,1|2,0,0]=3 3558 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,0,0,0,0,1|1,0,0]=2 3559 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,0,0,0,0,1|1,0,1]=3 3560 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,0,0,0,0,1|1,0,1]=3 3561 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,0,0,0,0,1|2,0,1]=4 3562 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [0,0,0,0,0,1|3,0,0]=4 3563 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,0,0,0,0,1|2,0,1]=4 3564 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,0,0,0,0,1|2,0,1]=4 3565 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,0,0,0,0,1|2,0,1]=4 3566 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,0,0,0,0,1|2,0,1]=4 3567 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,0,0,0,0,1|2,0,1]=4 3568 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,0,0,0,0,1|2,0,1]=4 3569 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,0,0,0,0,1|1,0,0]=2 3570 B8R0.9 CNC(C)CNC(N)=O Amb24405703 [0,0,0,0,0,1|2,0,0]=3 3571 B8R0.9 CNC(C)CNS(C)=O Amb24753150 [0,0,0,0,0,1|3,0,0]=4 3572 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,0,0,0,0,1|2,0,1]=4 3573 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,0,0,0,0,1|1,0,0]=2 3574 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,0,0,0,0,1|2,0,0]=3 3575 B8R0.9 COC(C)CNC(N)=N Amb24459639 [0,0,0,0,0,1|3,0,0]=4 3576 B8R0.9 COC(C)CNS(C)=O Amb25359541 [0,0,0,0,0,1|3,0,0]=4 3577 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,0,0,0,0,1|2,0,0]=3 3578 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,0,0,0,0,1|2,0,0]=3 3579 B8R0.9 COC(C)OCC(C)O Amb25284474 [0,0,0,0,0,1|2,0,1]=4 3580 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,0,0,0,0,1|1,0,0]=2 3581 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,0,0,0,0,1|3,0,0]=4 3582 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,0,0,0,0,1|1,0,0]=2 3583 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,0,0,0,0,1|2,0,1]=4 3584 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,0,0,0,0,1|2,0,1]=4 3585 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,0,0,0,0,1|1,0,0]=2 3586 B8R0.9 CSC(C)CNC(C)=O Amb25744770 [0,0,0,0,0,1|2,0,0]=3 3587 B8R0.9 CSC(C)CNC(N)=O Amb25688045 [0,0,0,0,0,1|2,0,0]=3 3588 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,0,0,0,0,1|1,0,0]=2 3589 B8R0.9 C[C@@H](CBr)COC(C)=O Amb24373843 [0,0,0,0,0,1|2,0,0]=3 3590 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,0,0,0,0,1|0,0,0]=1 3591 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,0,0,0,0,1|2,0,1]=4 3592 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,0,0,0,0,1|0,0,2]=3 3593 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,0,0,0,0,1|2,0,0]=3 3594 B8R0.9 C[C@@H](O)CC[C@H](C)CO Amb25271414 [0,0,0,0,0,1|2,0,1]=4 3595 B8R0.9 C[C@@H](O)CN[C@@H](C)CO Amb25112017 [0,0,0,0,0,1|2,0,1]=4 3596 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,0,0,0,0,1|0,0,2]=3 3597 B8R0.9 C[C@H](CO)CC=C(C)C Amb25044656 [0,0,0,0,0,1|3,0,0]=4 3598 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,0,0,0,0,1|2,0,0]=3 3599 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,0,0,0,0,1|2,0,0]=3 3600 B8R0.9 C[C@H](CO)SCC(C)=C Amb25052251 [0,0,0,0,0,1|3,0,0]=4 3601 B8R0.9 C[C@H](O)CC[C@H](O)CC Amb25794691 [0,0,0,0,0,1|2,0,1]=4 3602 B8R0.9 C[C@H](O)CNC(C)CO Amb25700081 [0,0,0,0,0,1|2,0,1]=4 3603 B8R0.9 C[C@H](O)CSC(C)CO Amb25032273 [0,0,0,0,0,1|2,0,1]=4 3604 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,0,0,0,0,1|0,0,3]=4 3605 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [0,0,0,0,0,1|0,0,3]=4 3606 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,0,0,0,0,1|0,0,1]=2 3607 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,0,0,0,0,1|1,0,2]=4 3608 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,0,0,0,0,1|1,0,2]=4 3609 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,0,0,0,0,1|0,0,2]=3 3610 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,0,0,0,0,1|2,0,1]=4 3611 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,0,0,0,0,1|1,0,2]=4 3612 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,0,0,0,0,1|1,0,2]=4 3613 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,0,0,0,0,1|1,0,2]=4 3614 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,0,0,0,0,1|3,0,0]=4 3615 B8R0.9 NC(=O)NCC(S)CS Amb25337646 [0,0,0,0,0,1|3,0,0]=4 3616 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,0,0,0,0,1|3,0,0]=4 3617 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,0,0,0,0,1|3,0,0]=4 3618 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,0,0,0,0,1|1,0,2]=4 3619 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,0,0,0,0,1|2,0,0]=3 3620 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,0,0,0,0,1|3,0,0]=4 3621 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,0,0,0,0,1|2,0,0]=3 3622 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,0,0,0,0,1|2,0,1]=4 3623 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,0,0,0,0,1|2,0,1]=4 3624 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,0,0,0,0,1|2,0,1]=4 3625 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,0,0,0,0,1|2,0,1]=4 3626 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,0,0,0,0,1|2,0,1]=4 3627 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,0,0,0,0,1|2,0,0]=3 3628 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,0,0,0,0,1|3,0,0]=4 3629 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,0,0,0,0,1|2,0,0]=3 3630 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,0,0,0,0,1|3,0,0]=4 3631 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,0,0,0,0,1|2,0,0]=3 3632 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,0,0,0,0,1|2,0,1]=4 3633 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,0,0,0,0,1|2,0,1]=4 3634 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,0,0,0,0,1|2,0,0]=3 3635 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,0,0,0,0,1|1,0,2]=4 3636 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,0,0,0,0,1|2,0,0]=3 3637 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,0,0,0,0,1|2,0,0]=3 3638 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,0,0,0,0,1|3,0,0]=4 3639 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,0,0,0,0,1|2,0,0]=3 3640 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [0,0,0,0,0,1|3,0,0]=4 3641 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,0,0,0,0,1|2,0,1]=4 3642 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,0,0,0,0,1|2,0,1]=4 3643 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,0,0,0,0,1|2,0,1]=4 3644 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,0,0,0,0,1|2,0,0]=3 3645 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,0,0,0,0,1|1,0,2]=4 3646 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,0,0,0,0,1|2,0,1]=4 3647 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,0,0,0,0,1|2,0,1]=4 3648 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,0,0,0,0,1|2,0,1]=4 3649 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,0,0,0,0,1|2,0,1]=4 3650 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,0,0,0,0,1|2,0,1]=4 3651 B8R0.9 OC(CCl)COS(O)=O Amb24726370 [0,0,0,0,0,1|3,0,0]=4 3652 B8R0.9 OC(CS)COP(O)=O Amb24523020 [0,0,0,0,0,1|3,0,0]=4 3653 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,0,0,0,0,1|2,0,0]=3 3654 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,0,0,0,0,1|3,0,0]=4 3655 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,0,0,0,0,1|2,0,1]=4 3656 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,0,0,0,0,1|2,0,0]=3 3657 B8R0.9 [O-][N+](=O)CC[C@H](CO)C Amb13883660 [0,0,0,0,0,1|2,0,1]=4 3658 B5R0.1 BC(=O)NCC Amb22343194 [2,0,0,0,0,0|2,0,0]=4 3659 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|1,0,1]=4 3660 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|2,0,0]=4 3661 B5R0.1 CC(=O)CCN Amb10067110 [2,0,0,0,0,0|2,0,0]=4 3662 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|2,0,0]=4 3663 B5R0.1 CC(Br)CC=O Amb25074611 [2,0,0,0,0,0|1,0,0]=3 3664 B5R0.1 CC(C)C#CO Amb22492599 [2,0,0,0,0,0|0,0,2]=4 3665 B5R0.1 CC(C)CCF Amb24117499 [2,0,0,0,0,0|1,0,1]=4 3666 B5R0.1 CC(C)CCN Amb22337707 [2,0,0,0,0,0|1,0,1]=4 3667 B5R0.1 CC(C)CNN Amb22886984 [2,0,0,0,0,0|2,0,0]=4 3668 B5R0.1 CC(C)CON Amb19889788 [2,0,0,0,0,0|2,0,0]=4 3669 B5R0.1 CC(C)C[13CH]=O Amb22353955 [2,0,0,0,0,0|0,0,0]=2 3670 B5R0.1 CC(C)C[Mg]Br Amb22336608 [2,0,0,0,0,0|2,0,0]=4 3671 B5R0.1 CC(C)C[Mg]Cl Amb22351464 [2,0,0,0,0,0|2,0,0]=4 3672 B5R0.1 CC(C)C[Zn]Br Amb22000395 [2,0,0,0,0,0|2,0,0]=4 3673 B5R0.1 CC(C)NCO Amb24384251 [2,0,0,0,0,0|1,0,1]=4 3674 B5R0.1 CC(C)OC=C Amb22230777 [2,0,0,0,0,0|2,0,0]=4 3675 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 3676 B5R0.1 CC(C)OC=N Amb25248353 [2,0,0,0,0,0|2,0,0]=4 3677 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|2,0,0]=4 3678 B5R0.1 CC(C)O[PH2]=O Amb24599573 [2,0,0,0,0,0|2,0,0]=4 3679 B5R0.1 CC(C)SC=C Amb24599592 [2,0,0,0,0,0|2,0,0]=4 3680 B5R0.1 CC(C)\C=C/C Amb22731717 [2,0,0,0,0,0|1,0,1]=4 3681 B5R0.1 CC(C)\C=C\Br Amb25690202 [2,0,0,0,0,0|1,0,1]=4 3682 B5R0.1 CC(C)\C=C\Cl Amb25793515 [2,0,0,0,0,0|1,0,1]=4 3683 B5R0.1 CC(CC#N)C Amb1162737 [2,0,0,0,0,0|1,0,1]=4 3684 B5R0.1 CC(Cl)CC=O Amb18640602 [2,0,0,0,0,0|1,0,0]=3 3685 B5R0.1 CC(Cl)OC=O Amb25811235 [2,0,0,0,0,0|2,0,0]=4 3686 B5R0.1 CC(Cl)\C=C\O Amb22734803 [2,0,0,0,0,0|1,0,1]=4 3687 B5R0.1 CC(F)CCO Amb21951900 [2,0,0,0,0,0|1,0,1]=4 3688 B5R0.1 CC(N)CC=C Amb17673480 [2,0,0,0,0,0|2,0,0]=4 3689 B5R0.1 CC(N)CC=C Amb19515336 [2,0,0,0,0,0|2,0,0]=4 3690 B5R0.1 CC(N)CC=O Amb25292247 [2,0,0,0,0,0|1,0,0]=3 3691 B5R0.1 CC(O)CCO Amb22227721 [2,0,0,0,0,0|1,0,1]=4 3692 B5R0.1 CC(O)CCO Amb22232248 [2,0,0,0,0,0|1,0,1]=4 3693 B5R0.1 CC(O)CN=O Amb25746175 [2,0,0,0,0,0|2,0,0]=4 3694 B5R0.1 CC(O)CNO Amb24333693 [2,0,0,0,0,0|2,0,0]=4 3695 B5R0.1 CC(S)CC=O Amb18122380 [2,0,0,0,0,0|1,0,0]=3 3696 B5R0.1 CC(S)CCO Amb19148316 [2,0,0,0,0,0|1,0,1]=4 3697 B5R0.1 CC(S)NC=O Amb25835741 [2,0,0,0,0,0|2,0,0]=4 3698 B5R0.1 CC(\C=N\O)C Amb2455920 [2,0,0,0,0,0|1,0,1]=4 3699 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|1,0,1]=4 3700 B5R0.1 CCCC(=C)Br Amb22583743 [2,0,0,0,0,0|2,0,0]=4 3701 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 3702 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 3703 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 3704 B5R0.1 CCCC(N)O Amb25147414 [2,0,0,0,0,0|1,0,1]=4 3705 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,0]=3 3706 B5R0.1 CCCC(O)Br Amb25106743 [2,0,0,0,0,0|1,0,1]=4 3707 B5R0.1 CCCC(O)Cl Amb22552567 [2,0,0,0,0,0|1,0,1]=4 3708 B5R0.1 CCCC([O-])=O Amb17772223 [2,0,0,0,0,0|0,0,1]=3 3709 B5R0.1 CCCC([O-])=O Amb22732283 [2,0,0,0,0,0|0,0,1]=3 3710 B5R0.1 CCCC([O-])=O Amb22732651 [2,0,0,0,0,0|0,0,1]=3 3711 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|2,0,0]=4 3712 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 3713 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 3714 B5R0.1 CCCS(O)=O Amb24615072 [2,0,0,0,0,0|1,0,0]=3 3715 B5R0.1 CCCS([O-])=O Amb19929119 [2,0,0,0,0,0|1,0,1]=4 3716 B5R0.1 CCC[13C](O)=O Amb22337992 [2,0,0,0,0,0|0,0,0]=2 3717 B5R0.1 CCC[13C](O)=O Amb22338339 [2,0,0,0,0,0|0,0,0]=2 3718 B5R0.1 CCNC(=O)Br Amb24563760 [2,0,0,0,0,0|2,0,0]=4 3719 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 3720 B5R0.1 CCNC(O)=S Amb24612743 [2,0,0,0,0,0|1,1,0]=4 3721 B5R0.1 CCOC([13CH3])=O Amb22363103 [2,0,0,0,0,0|2,0,0]=4 3722 B5R0.1 CCOP(O)=O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 3723 B5R0.1 CCO[13C](C)=O Amb22363160 [2,0,0,0,0,0|2,0,0]=4 3724 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [2,0,0,0,0,0|2,0,0]=4 3725 B5R0.1 CCO[14C](N)=O Amb22732757 [2,0,0,0,0,0|2,0,0]=4 3726 B5R0.1 CCSC(N)=O Amb24394612 [2,0,0,0,0,0|2,0,0]=4 3727 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [2,0,0,0,0,0|0,0,0]=2 3728 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [2,0,0,0,0,0|0,0,1]=3 3729 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [2,0,0,0,0,0|0,0,0]=2 3730 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,0]=3 3731 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,0]=3 3732 B5R0.1 CN(C)CC=O Amb22491584 [2,0,0,0,0,0|1,0,0]=3 3733 B5R0.1 CN(C)CC=O Amb22756473 [2,0,0,0,0,0|1,0,0]=3 3734 B5R0.1 CN(C)CC=O Amb23440511 [2,0,0,0,0,0|1,0,0]=3 3735 B5R0.1 CNCC(=O)C Amb17621974 [2,0,0,0,0,0|2,0,0]=4 3736 B5R0.1 CNCC(=O)N Amb10610205 [2,0,0,0,0,0|2,0,0]=4 3737 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 3738 B5R0.1 CNCC(C)C Amb1119103 [2,0,0,0,0,0|2,0,0]=4 3739 B5R0.1 CNCC(C)C Amb13951443 [2,0,0,0,0,0|2,0,0]=4 3740 B5R0.1 CNCC([O-])=O Amb20246714 [2,0,0,0,0,0|1,0,1]=4 3741 B5R0.1 CNCP(O)=O Amb24478116 [2,0,0,0,0,0|2,0,0]=4 3742 B5R0.1 COCC(=O)Br Amb25282928 [2,0,0,0,0,0|2,0,0]=4 3743 B5R0.1 COCC(=O)N Amb1153776 [2,0,0,0,0,0|2,0,0]=4 3744 B5R0.1 CS(=O)CC=O Amb25173706 [2,0,0,0,0,0|2,0,0]=4 3745 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 3746 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 3747 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 3748 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 3749 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [2,0,0,0,0,0|0,0,1]=3 3750 B5R0.1 C[C@@H](Cl)CC=C Amb25123337 [2,0,0,0,0,0|2,0,0]=4 3751 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [2,0,0,0,0,0|1,0,1]=4 3752 B5R0.1 C[C@@H](N)CCO Amb19515999 [2,0,0,0,0,0|1,0,1]=4 3753 B5R0.1 C[C@@H](N)CCO Amb22746127 [2,0,0,0,0,0|1,0,1]=4 3754 B5R0.1 C[C@@H](O)CC=C Amb22225370 [2,0,0,0,0,0|2,0,0]=4 3755 B5R0.1 C[C@@H](O)CC=O Amb24356009 [2,0,0,0,0,0|1,0,0]=3 3756 B5R0.1 C[C@H](Cl)CC=C Amb24626620 [2,0,0,0,0,0|2,0,0]=4 3757 B5R0.1 C[C@H](N)CCO Amb19515998 [2,0,0,0,0,0|1,0,1]=4 3758 B5R0.1 C[C@H](N)CCO Amb24055217 [2,0,0,0,0,0|1,0,1]=4 3759 B5R0.1 C[C@H](O)CC=C Amb22226758 [2,0,0,0,0,0|2,0,0]=4 3760 B5R0.1 C[NH+](C)CCO Amb22493791 [2,0,0,0,0,0|1,0,1]=4 3761 B5R0.1 C[S+](C)CCO Amb24420852 [2,0,0,0,0,0|1,0,1]=4 3762 B5R0.1 C[SiH](C)CC=C Amb19930034 [2,0,0,0,0,0|1,1,0]=4 3763 B5R0.1 C[SiH](C)CCO Amb25184701 [2,0,0,0,0,0|0,1,1]=4 3764 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|1,0,1]=4 3765 B5R0.1 N#CCC(O)=O Amb20247050 [2,0,0,0,0,0|1,0,1]=4 3766 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 3767 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 3768 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 3769 B5R0.1 NCCC(=O)N Amb1137251 [2,0,0,0,0,0|2,0,0]=4 3770 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,0]=3 3771 B5R0.1 NCCP(O)=O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 3772 B5R0.1 NNCC(C)C Amb1105732 [2,0,0,0,0,0|2,0,0]=4 3773 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 3774 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 3775 B5R0.1 O=C(Br)CCCl Amb24474527 [2,0,0,0,0,0|2,0,0]=4 3776 B5R0.1 O=C(I)CCCl Amb25146462 [2,0,0,0,0,0|2,0,0]=4 3777 B5R0.1 O=CCC(Br)Br Amb25026607 [2,0,0,0,0,0|2,0,0]=4 3778 B5R0.1 O=CNN(C)C Amb1930732 [2,0,0,0,0,0|2,0,0]=4 3779 B5R0.1 OC(=O)CC=O Amb22169407 [2,0,0,0,0,0|1,0,1]=4 3780 B5R0.1 OC(=O)CCF Amb10603694 [2,0,0,0,0,0|1,0,0]=3 3781 B5R0.1 OC(=O)CI=O Amb25146428 [2,0,0,0,0,0|2,0,0]=4 3782 B5R0.1 OC(=O)CNBr Amb25053433 [2,0,0,0,0,0|2,0,0]=4 3783 B5R0.1 OC(=O)CNCl Amb24653229 [2,0,0,0,0,0|2,0,0]=4 3784 B5R0.1 OC(=O)CNI Amb25216175 [2,0,0,0,0,0|2,0,0]=4 3785 B5R0.1 OC(=O)CSCl Amb24597301 [2,0,0,0,0,0|2,0,0]=4 3786 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [2,0,0,0,0,0|2,0,0]=4 3787 B5R0.1 ONCC(O)=O Amb24120360 [2,0,0,0,0,0|2,0,0]=4 3788 B5R0.1 OP(=O)CCBr Amb24634095 [2,0,0,0,0,0|2,0,0]=4 3789 B5R0.1 OP(=O)CCCl Amb24465178 [2,0,0,0,0,0|2,0,0]=4 3790 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [2,0,0,0,0,0|0,0,1]=3 3791 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [2,0,0,0,0,0|0,0,1]=3 3792 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [2,0,0,0,0,0|0,0,1]=3 3793 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [2,0,0,0,0,0|1,0,0]=3 3794 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [2,0,0,0,0,0|1,0,0]=3 3795 B5R0.1 [2H]C(=O)OCC Amb22336312 [2,0,0,0,0,0|2,0,0]=4 3796 B5R0.1 [C-]#[N+]CC(C)C Amb22900913 [2,0,0,0,0,0|2,0,0]=4 3797 B5R0.1 [O-]C(=O)CCBr Amb22229633 [2,0,0,0,0,0|1,0,1]=4 3798 B5R0.1 [O-]C(=O)CCCl Amb10604124 [2,0,0,0,0,0|1,0,1]=4 3799 B5R0.1 [O-]C(=O)CCCl Amb22051669 [2,0,0,0,0,0|1,0,1]=4 3800 B5R0.1 [O-]C(=O)CCO Amb22055495 [2,0,0,0,0,0|1,0,1]=4 3801 B5R0.2 BSCCCC Amb25339480 [2,0,0,0,0,0|2,0,0]=4 3802 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|2,0,0]=4 3803 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|2,0,0]=4 3804 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|2,0,0]=4 3805 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|2,0,0]=4 3806 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|2,0,0]=4 3807 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 3808 B5R0.2 CCC/C=C/Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 3809 B5R0.2 CCCCC=C Amb22338530 [2,0,0,0,0,0|1,0,0]=3 3810 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|1,0,1]=4 3811 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,1]=4 3812 B5R0.2 CCCCC[13CH3] Amb22353529 [2,0,0,0,0,0|1,0,1]=4 3813 B5R0.2 CCCCC[Mg+] Amb22045757 [2,0,0,0,0,0|1,0,1]=4 3814 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|1,0,1]=4 3815 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 3816 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 3817 B5R0.2 CCCCNN Amb22732372 [2,0,0,0,0,0|2,0,0]=4 3818 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 3819 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 3820 B5R0.2 CCCCO[2H] Amb16185547 [2,0,0,0,0,0|2,0,0]=4 3821 B5R0.2 CCCCS[Na] Amb22360783 [2,0,0,0,0,0|2,0,0]=4 3822 B5R0.2 CCCC[Hg]Cl Amb22366548 [2,0,0,0,0,0|2,0,0]=4 3823 B5R0.2 CCCC[Mg]Br Amb17666637 [2,0,0,0,0,0|2,0,0]=4 3824 B5R0.2 CCCC[Zn]Br Amb22000415 [2,0,0,0,0,0|2,0,0]=4 3825 B5R0.2 CCCN=C=O Amb22338287 [2,0,0,0,0,0|1,0,1]=4 3826 B5R0.2 CCCNCO Amb25746089 [2,0,0,0,0,0|1,0,1]=4 3827 B5R0.2 CCCOC=C Amb17940706 [2,0,0,0,0,0|2,0,0]=4 3828 B5R0.2 CCCON=O Amb22732190 [2,0,0,0,0,0|2,0,0]=4 3829 B5R0.2 CCCSCO Amb24466323 [2,0,0,0,0,0|1,0,1]=4 3830 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 3831 B5R0.2 CCC\C=C\I Amb24333664 [2,0,0,0,0,0|1,0,1]=4 3832 B5R0.2 CCNCC=C Amb13951161 [2,0,0,0,0,0|2,0,0]=4 3833 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 3834 B5R0.2 CCNCCO Amb22284537 [2,0,0,0,0,0|1,0,1]=4 3835 B5R0.2 CCNCN=O Amb24382131 [2,0,0,0,0,0|2,0,0]=4 3836 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 3837 B5R0.2 CNCCC=C Amb18993048 [2,0,0,0,0,0|2,0,0]=4 3838 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 3839 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 3840 B5R0.2 CSCCC=C Amb24431590 [2,0,0,0,0,0|2,0,0]=4 3841 B5R0.2 CSCNC=O Amb24421815 [2,0,0,0,0,0|2,0,0]=4 3842 B5R0.2 C\C=C/CC=O Amb24728871 [2,0,0,0,0,0|0,0,2]=4 3843 B5R0.2 NCCNC=O Amb25213948 [2,0,0,0,0,0|2,0,0]=4 3844 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 3845 B5R0.2 O=CCCC=O Amb22231966 [2,0,0,0,0,0|1,0,1]=4 3846 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 3847 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 3848 B5R0.2 O=CCCSCl Amb25146622 [2,0,0,0,0,0|2,0,0]=4 3849 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 3850 B5R0.2 O=CCOCBr Amb25765436 [2,0,0,0,0,0|2,0,0]=4 3851 B5R0.2 O=CCOCC Amb24052108 [2,0,0,0,0,0|1,0,0]=3 3852 B5R0.2 O=CCOCCl Amb24671305 [2,0,0,0,0,0|2,0,0]=4 3853 B5R0.2 O=COCCCl Amb22345927 [2,0,0,0,0,0|2,0,0]=4 3854 B5R0.2 O=CSCCCl Amb25808568 [2,0,0,0,0,0|2,0,0]=4 3855 B5R0.2 OC=NCCCl Amb24684796 [2,0,0,0,0,0|2,0,0]=4 3856 B5R0.2 OCCCC=O Amb24589235 [2,0,0,0,0,0|1,0,0]=3 3857 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 3858 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 3859 B5R0.2 OCCCCI Amb25689806 [2,0,0,0,0,0|1,0,1]=4 3860 B5R0.2 OCCCCS Amb22229807 [2,0,0,0,0,0|1,0,1]=4 3861 B5R0.2 OCCCNO Amb24719785 [2,0,0,0,0,0|2,0,0]=4 3862 B5R0.2 OCCSCC Amb1085958 [2,0,0,0,0,0|1,0,1]=4 3863 B5R0.2 O\C=C\CCO Amb24333503 [2,0,0,0,0,0|1,0,1]=4 3864 B5R0.2 SCCCC=C Amb17939241 [2,0,0,0,0,0|2,0,0]=4 3865 B5R0.2 [C-]#[N+]CCC=O Amb24706723 [2,0,0,0,0,0|1,0,1]=4 3866 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|2,0,0]=4 3867 B5R0.3 BrCC(Br)C=O Amb17670591 [2,0,0,0,0,0|2,0,0]=4 3868 B5R0.3 CC(C=C)C=O Amb25737956 [2,0,0,0,0,0|0,0,2]=4 3869 B5R0.3 CC(C=O)C#C Amb24557170 [2,0,0,0,0,0|0,0,2]=4 3870 B5R0.3 CC(CBr)C=C Amb25310976 [2,0,0,0,0,0|1,0,1]=4 3871 B5R0.3 CC(CBr)C=O Amb24478503 [2,0,0,0,0,0|1,0,0]=3 3872 B5R0.3 CC(CBr)CBr Amb21962898 [2,0,0,0,0,0|2,0,0]=4 3873 B5R0.3 CC(CCl)C=O Amb24691518 [2,0,0,0,0,0|1,0,0]=3 3874 B5R0.3 CC(CCl)CBr Amb22002150 [2,0,0,0,0,0|2,0,0]=4 3875 B5R0.3 CC(CF)C=O Amb24638421 [2,0,0,0,0,0|1,0,0]=3 3876 B5R0.3 CC(CN)C=C Amb18286499 [2,0,0,0,0,0|1,0,1]=4 3877 B5R0.3 CC(CN)CCl Amb22886205 [2,0,0,0,0,0|2,0,0]=4 3878 B5R0.3 CC(CN)CF Amb25025690 [2,0,0,0,0,0|2,0,0]=4 3879 B5R0.3 CC(CN)CN Amb18957946 [2,0,0,0,0,0|2,0,0]=4 3880 B5R0.3 CC(CN)CS Amb18251064 [2,0,0,0,0,0|1,1,0]=4 3881 B5R0.3 CC(CO)C=C Amb22347861 [2,0,0,0,0,0|0,0,2]=4 3882 B5R0.3 CC(CO)C=O Amb25745800 [2,0,0,0,0,0|1,0,0]=3 3883 B5R0.3 CC(CO)CBr Amb24061911 [2,0,0,0,0,0|1,0,0]=3 3884 B5R0.3 CC(CO)CP Amb24619153 [2,0,0,0,0,0|1,0,0]=3 3885 B5R0.3 CC(CO)CS Amb19375381 [2,0,0,0,0,0|1,0,0]=3 3886 B5R0.3 CC(CO)NN Amb20622512 [2,0,0,0,0,0|2,0,0]=4 3887 B5R0.3 CC(CO)NN Amb22231763 [2,0,0,0,0,0|2,0,0]=4 3888 B5R0.3 CC(CS)C=O Amb25758635 [2,0,0,0,0,0|1,0,0]=3 3889 B5R0.3 CC(OC)CN Amb2140564 [2,0,0,0,0,0|2,0,0]=4 3890 B5R0.3 CC(SC)CN Amb17485956 [2,0,0,0,0,0|2,0,0]=4 3891 B5R0.3 CC/C(C)=C/C Amb17940137 [2,0,0,0,0,0|1,0,1]=4 3892 B5R0.3 CCC(=C)C=O Amb17940102 [2,0,0,0,0,0|0,0,2]=4 3893 B5R0.3 CCC(=O)C=O Amb22228532 [2,0,0,0,0,0|1,0,1]=4 3894 B5R0.3 CCC(=O)CO Amb22227965 [2,0,0,0,0,0|1,0,1]=4 3895 B5R0.3 CCC(Br)C=C Amb25703129 [2,0,0,0,0,0|1,0,1]=4 3896 B5R0.3 CCC(Br)C=O Amb18124003 [2,0,0,0,0,0|1,0,0]=3 3897 B5R0.3 CCC(Br)CCl Amb25779185 [2,0,0,0,0,0|2,0,0]=4 3898 B5R0.3 CCC(Br)CF Amb24441930 [2,0,0,0,0,0|2,0,0]=4 3899 B5R0.3 CCC(C)=C=O Amb25788880 [2,0,0,0,0,0|0,0,2]=4 3900 B5R0.3 CCC(C)=CI Amb25810062 [2,0,0,0,0,0|1,0,1]=4 3901 B5R0.3 CCC(C)C#C Amb22229366 [2,0,0,0,0,0|0,0,2]=4 3902 B5R0.3 CCC(C)CI Amb22227967 [2,0,0,0,0,0|1,0,0]=3 3903 B5R0.3 CCC(C)SC Amb22043308 [2,0,0,0,0,0|1,0,1]=4 3904 B5R0.3 CCC(C)[Mg]Br Amb22733176 [2,0,0,0,0,0|2,0,0]=4 3905 B5R0.3 CCC(CBr)O Amb10844729 [2,0,0,0,0,0|2,0,0]=4 3906 B5R0.3 CCC(CC)N Amb1154143 [2,0,0,0,0,0|1,0,1]=4 3907 B5R0.3 CCC(Cl)C=O Amb18122610 [2,0,0,0,0,0|1,0,0]=3 3908 B5R0.3 CCC(Cl)CBr Amb22227798 [2,0,0,0,0,0|2,0,0]=4 3909 B5R0.3 CCC(Cl)CO Amb22011826 [2,0,0,0,0,0|1,0,0]=3 3910 B5R0.3 CCC(F)C=O Amb24606916 [2,0,0,0,0,0|1,0,0]=3 3911 B5R0.3 CCC(F)CBr Amb24525153 [2,0,0,0,0,0|2,0,0]=4 3912 B5R0.3 CCC(F)CC Amb24372682 [2,0,0,0,0,0|1,0,1]=4 3913 B5R0.3 CCC(F)CI Amb25146611 [2,0,0,0,0,0|2,0,0]=4 3914 B5R0.3 CCC(F)CN Amb20622434 [2,0,0,0,0,0|2,0,0]=4 3915 B5R0.3 CCC(I)C=O Amb25365077 [2,0,0,0,0,0|1,0,0]=3 3916 B5R0.3 CCC(I)CC Amb17673918 [2,0,0,0,0,0|1,0,1]=4 3917 B5R0.3 CCC(I)CO Amb24444860 [2,0,0,0,0,0|1,0,0]=3 3918 B5R0.3 CCC(N)CN Amb19338113 [2,0,0,0,0,0|2,0,0]=4 3919 B5R0.3 CCC(N)CS Amb18122513 [2,0,0,0,0,0|1,1,0]=4 3920 B5R0.3 CCC(NC)C Amb10609216 [2,0,0,0,0,0|1,0,1]=4 3921 B5R0.3 CCC(O)C=O Amb25347970 [2,0,0,0,0,0|1,0,0]=3 3922 B5R0.3 CCC(O)C=S Amb25115922 [2,0,0,0,0,0|1,1,0]=4 3923 B5R0.3 CCC(O)CCl Amb22011825 [2,0,0,0,0,0|2,0,0]=4 3924 B5R0.3 CCC(O)CF Amb25810601 [2,0,0,0,0,0|2,0,0]=4 3925 B5R0.3 CCC(O)CI Amb24683390 [2,0,0,0,0,0|2,0,0]=4 3926 B5R0.3 CCC(O)CO Amb22367049 [2,0,0,0,0,0|1,0,0]=3 3927 B5R0.3 CCC(OC)C Amb10069005 [2,0,0,0,0,0|1,0,1]=4 3928 B5R0.3 CCC(S)C=O Amb18122377 [2,0,0,0,0,0|1,0,0]=3 3929 B5R0.3 CCC(S)CN Amb18908249 [2,0,0,0,0,0|2,0,0]=4 3930 B5R0.3 CCN(C)C=O Amb20627285 [2,0,0,0,0,0|1,0,0]=3 3931 B5R0.3 CCN(C)CO Amb24407447 [2,0,0,0,0,0|1,0,0]=3 3932 B5R0.3 CCN(C)N=O Amb22055856 [2,0,0,0,0,0|2,0,0]=4 3933 B5R0.3 CCN(N)C=O Amb24428031 [2,0,0,0,0,0|2,0,0]=4 3934 B5R0.3 CC[C@@H](Br)CBr Amb25688293 [2,0,0,0,0,0|2,0,0]=4 3935 B5R0.3 CC[C@@H](C)CBr Amb22800948 [2,0,0,0,0,0|1,0,0]=3 3936 B5R0.3 CC[C@@H](C)CCl Amb22800693 [2,0,0,0,0,0|1,0,0]=3 3937 B5R0.3 CC[C@@H](C)CI Amb24332577 [2,0,0,0,0,0|1,0,0]=3 3938 B5R0.3 CC[C@@H](C)CN Amb22800554 [2,0,0,0,0,0|1,0,0]=3 3939 B5R0.3 CC[C@@H](C)CO Amb22799907 [2,0,0,0,0,0|0,0,0]=2 3940 B5R0.3 CC[C@@H](CO)C Amb10844611 [2,0,0,0,0,0|0,0,0]=2 3941 B5R0.3 CC[C@@H](Cl)C=O Amb24645873 [2,0,0,0,0,0|1,0,0]=3 3942 B5R0.3 CC[C@@H](Cl)CBr Amb24334324 [2,0,0,0,0,0|2,0,0]=4 3943 B5R0.3 CC[C@@H](N)CCl Amb24562851 [2,0,0,0,0,0|2,0,0]=4 3944 B5R0.3 CC[C@@H](N)CN Amb24120352 [2,0,0,0,0,0|2,0,0]=4 3945 B5R0.3 CC[C@@H](N)CS Amb24617754 [2,0,0,0,0,0|1,1,0]=4 3946 B5R0.3 CC[C@@H](O)C=C Amb24529645 [2,0,0,0,0,0|1,0,1]=4 3947 B5R0.3 CC[C@@H](O)CCl Amb25305181 [2,0,0,0,0,0|2,0,0]=4 3948 B5R0.3 CC[C@@H](O)CI Amb25146583 [2,0,0,0,0,0|2,0,0]=4 3949 B5R0.3 CC[C@@H](O)CN Amb22232086 [2,0,0,0,0,0|2,0,0]=4 3950 B5R0.3 CC[C@@H](O)CO Amb20241381 [2,0,0,0,0,0|1,0,0]=3 3951 B5R0.3 CC[C@H](Br)CBr Amb24704052 [2,0,0,0,0,0|2,0,0]=4 3952 B5R0.3 CC[C@H](Br)CO Amb25147674 [2,0,0,0,0,0|1,0,0]=3 3953 B5R0.3 CC[C@H](C)C#N Amb22351647 [2,0,0,0,0,0|1,0,1]=4 3954 B5R0.3 CC[C@H](C)CBr Amb22351674 [2,0,0,0,0,0|1,0,0]=3 3955 B5R0.3 CC[C@H](C)CCl Amb25728424 [2,0,0,0,0,0|1,0,0]=3 3956 B5R0.3 CC[C@H](C)CN Amb20241892 [2,0,0,0,0,0|1,0,0]=3 3957 B5R0.3 CC[C@H](Cl)C=O Amb24478146 [2,0,0,0,0,0|1,0,0]=3 3958 B5R0.3 CC[C@H](N)C=C Amb24615622 [2,0,0,0,0,0|1,0,1]=4 3959 B5R0.3 CC[C@H](N)CCl Amb24461621 [2,0,0,0,0,0|2,0,0]=4 3960 B5R0.3 CC[C@H](O)C=O Amb24333959 [2,0,0,0,0,0|1,0,0]=3 3961 B5R0.3 CC[C@H](O)CN Amb23385250 [2,0,0,0,0,0|2,0,0]=4 3962 B5R0.3 CC[C@H](O)CO Amb20241380 [2,0,0,0,0,0|1,0,0]=3 3963 B5R0.3 CC\C(\C)=C/C Amb25332651 [2,0,0,0,0,0|1,0,1]=4 3964 B5R0.3 CN(CCl)C=O Amb24478418 [2,0,0,0,0,0|2,0,0]=4 3965 B5R0.3 CN(CO)CO Amb25847061 [2,0,0,0,0,0|2,0,0]=4 3966 B5R0.3 CNC(C)CCl Amb25774314 [2,0,0,0,0,0|2,0,0]=4 3967 B5R0.3 CNC(C)CN Amb18284352 [2,0,0,0,0,0|2,0,0]=4 3968 B5R0.3 COC(C)C=C Amb25232785 [2,0,0,0,0,0|1,0,1]=4 3969 B5R0.3 COC(C)CBr Amb24711458 [2,0,0,0,0,0|2,0,0]=4 3970 B5R0.3 COC(C)CI Amb24371608 [2,0,0,0,0,0|2,0,0]=4 3971 B5R0.3 COC(C)CO Amb19517078 [2,0,0,0,0,0|1,0,0]=3 3972 B5R0.3 COC(N)CO Amb24615890 [2,0,0,0,0,0|2,0,0]=4 3973 B5R0.3 COC(O)CO Amb25747170 [2,0,0,0,0,0|2,0,0]=4 3974 B5R0.3 CON(C)C=O Amb22234045 [2,0,0,0,0,0|2,0,0]=4 3975 B5R0.3 CON(C)CO Amb25745642 [2,0,0,0,0,0|2,0,0]=4 3976 B5R0.3 CO[C@@H](C)CN Amb22746816 [2,0,0,0,0,0|2,0,0]=4 3977 B5R0.3 CSC(C)CO Amb24438636 [2,0,0,0,0,0|1,0,0]=3 3978 B5R0.3 CS[C@@H](C)CO Amb25255982 [2,0,0,0,0,0|1,0,0]=3 3979 B5R0.3 CS[C@H](C)CO Amb25376268 [2,0,0,0,0,0|1,0,0]=3 3980 B5R0.3 C[C@@H](CBr)C=C Amb24334134 [2,0,0,0,0,0|1,0,1]=4 3981 B5R0.3 C[C@@H](CBr)C=O Amb25024867 [2,0,0,0,0,0|1,0,0]=3 3982 B5R0.3 C[C@@H](CCl)CBr Amb25798880 [2,0,0,0,0,0|2,0,0]=4 3983 B5R0.3 C[C@@H](CF)CI Amb25220903 [2,0,0,0,0,0|2,0,0]=4 3984 B5R0.3 C[C@@H](CN)CO Amb24181882 [2,0,0,0,0,0|1,0,0]=3 3985 B5R0.3 C[C@@H](CO)C=C Amb25145603 [2,0,0,0,0,0|0,0,2]=4 3986 B5R0.3 C[C@@H](CO)C=O Amb24750144 [2,0,0,0,0,0|1,0,0]=3 3987 B5R0.3 C[C@@H](CO)CCl Amb25129442 [2,0,0,0,0,0|1,0,0]=3 3988 B5R0.3 C[C@@H](CO)CI Amb25107296 [2,0,0,0,0,0|1,0,0]=3 3989 B5R0.3 C[C@@H](OC)CO Amb10603218 [2,0,0,0,0,0|1,0,0]=3 3990 B5R0.3 C[C@H](CF)CI Amb25810221 [2,0,0,0,0,0|2,0,0]=4 3991 B5R0.3 C[C@H](CI)C=C Amb25147661 [2,0,0,0,0,0|1,0,1]=4 3992 B5R0.3 C[C@H](CO)CCl Amb24333846 [2,0,0,0,0,0|1,0,0]=3 3993 B5R0.3 C[C@H](CO)CS Amb24719511 [2,0,0,0,0,0|1,0,0]=3 3994 B5R0.3 C[SiH](CC)CC Amb19893812 [2,0,0,0,0,0|0,1,1]=4 3995 B5R0.3 C\C(\CC)=C/C Amb22733177 [2,0,0,0,0,0|1,0,1]=4 3996 B5R0.3 C\C=C(\C)/C=O Amb24333046 [2,0,0,0,0,0|0,0,2]=4 3997 B5R0.3 NC(CO)CCl Amb24680312 [2,0,0,0,0,0|2,0,0]=4 3998 B5R0.3 NC(CO)CF Amb20622637 [2,0,0,0,0,0|2,0,0]=4 3999 B5R0.3 NC(CO)CF Amb25734803 [2,0,0,0,0,0|2,0,0]=4 4000 B5R0.3 NC(CO)CO Amb22730767 [2,0,0,0,0,0|2,0,0]=4 4001 B5R0.3 NC(CO)CS Amb18640677 [2,0,0,0,0,0|2,0,0]=4 4002 B5R0.3 NCC(Br)CO Amb25147258 [2,0,0,0,0,0|2,0,0]=4 4003 B5R0.3 NCC(N)CO Amb24117147 [2,0,0,0,0,0|2,0,0]=4 4004 B5R0.3 NCC(O)C=O Amb24419762 [2,0,0,0,0,0|2,0,0]=4 4005 B5R0.3 NC[C@@H](N)CO Amb19374894 [2,0,0,0,0,0|2,0,0]=4 4006 B5R0.3 NC[C@H](O)CO Amb20670545 [2,0,0,0,0,0|2,0,0]=4 4007 B5R0.3 N[C@H](CO)CS Amb24560326 [2,0,0,0,0,0|2,0,0]=4 4008 B5R0.3 O=CC(Br)CCl Amb18647566 [2,0,0,0,0,0|2,0,0]=4 4009 B5R0.3 O=CC(C=O)C Amb17593026 [2,0,0,0,0,0|1,0,1]=4 4010 B5R0.3 O=CC(Cl)CCl Amb18124314 [2,0,0,0,0,0|2,0,0]=4 4011 B5R0.3 OC(CCl)CO Amb22338175 [2,0,0,0,0,0|2,0,0]=4 4012 B5R0.3 OC(CF)C=O Amb25210931 [2,0,0,0,0,0|2,0,0]=4 4013 B5R0.3 OC(CI)C=O Amb25694739 [2,0,0,0,0,0|2,0,0]=4 4014 B5R0.3 OC(CO)C=O Amb21618959 [2,0,0,0,0,0|2,0,0]=4 4015 B5R0.3 OC(CO)CO Amb22052560 [2,0,0,0,0,0|2,0,0]=4 4016 B5R0.3 OC(CO)CO Amb22167864 [2,0,0,0,0,0|2,0,0]=4 4017 B5R0.3 OC(CO)CO Amb22349321 [2,0,0,0,0,0|2,0,0]=4 4018 B5R0.3 OC(CO)CO Amb22351872 [2,0,0,0,0,0|2,0,0]=4 4019 B5R0.3 OC(CO)CO Amb22353313 [2,0,0,0,0,0|2,0,0]=4 4020 B5R0.3 OC(CO)CO Amb22367100 [2,0,0,0,0,0|2,0,0]=4 4021 B5R0.3 OC(CO)CO Amb22730938 [2,0,0,0,0,0|2,0,0]=4 4022 B5R0.3 OC(CO)CO Amb22731173 [2,0,0,0,0,0|2,0,0]=4 4023 B5R0.3 OC([13CH2]O)[13CH2]O Amb22336314 [2,0,0,0,0,0|2,0,0]=4 4024 B5R0.3 OCC(Br)C=O Amb18644196 [2,0,0,0,0,0|2,0,0]=4 4025 B5R0.3 OCC(Br)CCl Amb24736275 [2,0,0,0,0,0|2,0,0]=4 4026 B5R0.3 OCC(Br)CF Amb24635772 [2,0,0,0,0,0|2,0,0]=4 4027 B5R0.3 OCC(Br)CO Amb22054566 [2,0,0,0,0,0|2,0,0]=4 4028 B5R0.3 OCC(C=O)Cl Amb17593122 [2,0,0,0,0,0|2,0,0]=4 4029 B5R0.3 OCC(CBr)Br Amb10070836 [2,0,0,0,0,0|2,0,0]=4 4030 B5R0.3 OCC(CO)Cl Amb17611073 [2,0,0,0,0,0|2,0,0]=4 4031 B5R0.3 OCC(CS)Cl Amb17593329 [2,0,0,0,0,0|2,0,0]=4 4032 B5R0.3 OCC(Cl)CF Amb21951908 [2,0,0,0,0,0|2,0,0]=4 4033 B5R0.3 OCC(F)CBr Amb24061909 [2,0,0,0,0,0|2,0,0]=4 4034 B5R0.3 OCC(F)CF Amb25344040 [2,0,0,0,0,0|2,0,0]=4 4035 B5R0.3 OCC(I)CO Amb25146352 [2,0,0,0,0,0|2,0,0]=4 4036 B5R0.3 OCC(O)CF Amb21961974 [2,0,0,0,0,0|2,0,0]=4 4037 B5R0.3 OCC(O)CI Amb22055356 [2,0,0,0,0,0|2,0,0]=4 4038 B5R0.3 OCC(S)CBr Amb25101077 [2,0,0,0,0,0|2,0,0]=4 4039 B5R0.3 OC[C@@H](Br)CBr Amb25051836 [2,0,0,0,0,0|2,0,0]=4 4040 B5R0.3 OC[C@@H](Cl)CCl Amb25204068 [2,0,0,0,0,0|2,0,0]=4 4041 B5R0.3 OC[C@@H](O)C=O Amb20242417 [2,0,0,0,0,0|2,0,0]=4 4042 B5R0.3 OC[C@@H](O)CBr Amb22225154 [2,0,0,0,0,0|2,0,0]=4 4043 B5R0.3 OC[C@@H](O)CF Amb23401456 [2,0,0,0,0,0|2,0,0]=4 4044 B5R0.3 OC[C@@H](O)CI Amb24352881 [2,0,0,0,0,0|2,0,0]=4 4045 B5R0.3 OC[C@H](Br)CBr Amb25688292 [2,0,0,0,0,0|2,0,0]=4 4046 B5R0.3 OC[C@H](O)CBr Amb22226653 [2,0,0,0,0,0|2,0,0]=4 4047 B5R0.3 OC[C@H](O)CCl Amb22226649 [2,0,0,0,0,0|2,0,0]=4 4048 B5R0.3 OC[C@H](O)CI Amb24420532 [2,0,0,0,0,0|2,0,0]=4 4049 B5R0.3 O[13CH2][13CH](O)[13CH2]Cl Amb22054729 [2,0,0,0,0,0|2,0,0]=4 4050 B5R0.3 O[13CH](CO)CO Amb22337993 [2,0,0,0,0,0|2,0,0]=4 4051 B5R0.3 O[13CH]([13CH2]O)[13CH2]O Amb22338082 [2,0,0,0,0,0|2,0,0]=4 4052 B5R0.3 O[14CH]([14CH2]O)[14CH2]O Amb22362924 [2,0,0,0,0,0|2,0,0]=4 4053 B5R0.3 O[C@@H](CBr)C=O Amb24626840 [2,0,0,0,0,0|2,0,0]=4 4054 B5R0.3 O[C@@H](CS)C=O Amb25709640 [2,0,0,0,0,0|2,0,0]=4 4055 B5R0.3 O[C@H](C=O)CO Amb16232009 [2,0,0,0,0,0|2,0,0]=4 4056 B5R0.3 O[C@H](CCl)C=O Amb25662443 [2,0,0,0,0,0|2,0,0]=4 4057 B5R0.3 [C-]#[N+]C(CC)C Amb2235426 [2,0,0,0,0,0|1,0,1]=4 4058 B5R0.3 [CH2-]C(CC)CC Amb24117230 [2,0,0,0,0,0|0,0,2]=4 4059 B7R0.3 CC(C#N)OCC=O Amb24429384 [1,1,0,0,0,0|1,0,1]=4 4060 B7R0.3 CC(CBr)NCC=C Amb24339231 [1,1,0,0,0,0|2,0,0]=4 4061 B7R0.3 CC(CBr)OCC=C Amb25258900 [1,1,0,0,0,0|2,0,0]=4 4062 B7R0.3 CC(CC)\C=C/CC Amb22733598 [1,1,0,0,0,0|1,0,1]=4 4063 B7R0.3 CC(CCC=O)C#N Amb18641636 [1,1,0,0,0,0|1,0,1]=4 4064 B7R0.3 CC(CCC=O)C=C Amb18641704 [1,1,0,0,0,0|0,0,2]=4 4065 B7R0.3 CC(CCCO)CO Amb25098490 [1,1,0,0,0,0|1,0,1]=4 4066 B7R0.3 CC(CCl)CCC=C Amb24481361 [1,1,0,0,0,0|2,0,0]=4 4067 B7R0.3 CC(CCl)OCC=C Amb25703271 [1,1,0,0,0,0|2,0,0]=4 4068 B7R0.3 CC(CCl)SCC=C Amb24714255 [1,1,0,0,0,0|2,0,0]=4 4069 B7R0.3 CC(CN)CCC=C Amb25189032 [1,1,0,0,0,0|2,0,0]=4 4070 B7R0.3 CC(CN)CCOC Amb17569915 [1,1,0,0,0,0|1,0,1]=4 4071 B7R0.3 CC(CN)NCCO Amb24738477 [1,1,0,0,0,0|1,0,1]=4 4072 B7R0.3 CC(CN)OCC=C Amb18523837 [1,1,0,0,0,0|2,0,0]=4 4073 B7R0.3 CC(CN)SCC=C Amb25104670 [1,1,0,0,0,0|2,0,0]=4 4074 B7R0.3 CC(CN)SCCO Amb25104065 [1,1,0,0,0,0|1,0,1]=4 4075 B7R0.3 CC(CNCC)CC Amb20623802 [1,1,0,0,0,0|1,0,1]=4 4076 B7R0.3 CC(CO)CCC=O Amb25693017 [1,1,0,0,0,0|1,0,0]=3 4077 B7R0.3 CC(CO)\C=C\C=O Amb24744749 [1,1,0,0,0,0|1,0,1]=4 4078 B7R0.3 CC(C\C=C\C)CC Amb22730660 [1,1,0,0,0,0|1,0,0]=3 4079 B7R0.3 CC(NC)CCCO Amb17569902 [1,1,0,0,0,0|1,0,1]=4 4080 B7R0.3 CCC(=C)CNC=O Amb25299418 [1,1,0,0,0,0|0,0,2]=4 4081 B7R0.3 CCC(=O)CCC=O Amb18641783 [1,1,0,0,0,0|1,0,1]=4 4082 B7R0.3 CCC(=O)CNC=O Amb23442770 [1,1,0,0,0,0|1,0,1]=4 4083 B7R0.3 CCC(=O)NCC=O Amb17102054 [1,1,0,0,0,0|1,0,1]=4 4084 B7R0.3 CCC(=O)OCC=O Amb25779377 [1,1,0,0,0,0|1,0,1]=4 4085 B7R0.3 CCC(Br)CCCO Amb24627076 [1,1,0,0,0,0|1,0,1]=4 4086 B7R0.3 CCC(C)=CCC=C Amb22230003 [1,1,0,0,0,0|1,0,1]=4 4087 B7R0.3 CCC(C)=NCCO Amb25332989 [1,1,0,0,0,0|0,0,2]=4 4088 B7R0.3 CCC(C)C#CCO Amb25052244 [1,1,0,0,0,0|0,0,2]=4 4089 B7R0.3 CCC(C)C=NOC Amb25357259 [1,1,0,0,0,0|1,0,1]=4 4090 B7R0.3 CCC(C)CCC=O Amb25125664 [1,1,0,0,0,0|0,0,0]=2 4091 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,1]=4 4092 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,1]=4 4093 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|1,0,1]=4 4094 B7R0.3 CCC(C)CN=C=O Amb25783333 [1,1,0,0,0,0|0,0,1]=3 4095 B7R0.3 CCC(C)CNOC Amb25039681 [1,1,0,0,0,0|1,0,0]=3 4096 B7R0.3 CCC(C)COCBr Amb25697189 [1,1,0,0,0,0|1,0,1]=4 4097 B7R0.3 CCC(C)NC=S=O Amb24697590 [1,1,0,0,0,0|1,0,0]=3 4098 B7R0.3 CCC(C)NCCF Amb24557964 [1,1,0,0,0,0|1,0,1]=4 4099 B7R0.3 CCC(C)OCC#N Amb25189020 [1,1,0,0,0,0|1,0,1]=4 4100 B7R0.3 CCC(C)OCC=O Amb25169598 [1,1,0,0,0,0|0,0,0]=2 4101 B7R0.3 CCC(C)OCCBr Amb18181117 [1,1,0,0,0,0|1,0,1]=4 4102 B7R0.3 CCC(C)OCCN Amb18307952 [1,1,0,0,0,0|1,0,1]=4 4103 B7R0.3 CCC(C)OCCO Amb19516036 [1,1,0,0,0,0|0,0,1]=3 4104 B7R0.3 CCC(C)PCCN Amb25224337 [1,1,0,0,0,0|1,0,1]=4 4105 B7R0.3 CCC(C)SCC#C Amb25689337 [1,1,0,0,0,0|1,0,1]=4 4106 B7R0.3 CCC(C)\C=C\C#N Amb24402781 [1,1,0,0,0,0|1,0,1]=4 4107 B7R0.3 CCC(C)\C=C\C=O Amb18641694 [1,1,0,0,0,0|0,0,1]=3 4108 B7R0.3 CCC(Cl)CCCO Amb24526635 [1,1,0,0,0,0|1,0,1]=4 4109 B7R0.3 CCC(Cl)COC=O Amb24483209 [1,1,0,0,0,0|1,0,0]=3 4110 B7R0.3 CCC(Cl)OCC=C Amb24482355 [1,1,0,0,0,0|2,0,0]=4 4111 B7R0.3 CCC(F)CNOC Amb25134366 [1,1,0,0,0,0|2,0,0]=4 4112 B7R0.3 CCC(N)CCC=C Amb24434717 [1,1,0,0,0,0|2,0,0]=4 4113 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|1,0,1]=4 4114 B7R0.3 CCC(N)CCOC Amb19016193 [1,1,0,0,0,0|1,0,1]=4 4115 B7R0.3 CCC(O)C#CC=O Amb24483046 [1,1,0,0,0,0|1,0,1]=4 4116 B7R0.3 CCC(O)CCC=C Amb22052608 [1,1,0,0,0,0|2,0,0]=4 4117 B7R0.3 CCC(O)CCOC Amb22058972 [1,1,0,0,0,0|1,0,1]=4 4118 B7R0.3 CCC(O)COC=O Amb24642387 [1,1,0,0,0,0|1,0,0]=3 4119 B7R0.3 CCC(O)C\C=C\Br Amb25374957 [1,1,0,0,0,0|2,0,0]=4 4120 B7R0.3 CCC(O)C\C=C\Cl Amb24563293 [1,1,0,0,0,0|2,0,0]=4 4121 B7R0.3 CCC(O)OCC=C Amb22230223 [1,1,0,0,0,0|2,0,0]=4 4122 B7R0.3 CCC(O)OCCO Amb24407420 [1,1,0,0,0,0|1,0,1]=4 4123 B7R0.3 CCC(S)CCCO Amb24534037 [1,1,0,0,0,0|1,0,1]=4 4124 B7R0.3 CCC(\C=C\C=O)O Amb16233610 [1,1,0,0,0,0|1,0,1]=4 4125 B7R0.3 CCCCC(CC)C Amb10071971 [1,1,0,0,0,0|1,0,1]=4 4126 B7R0.3 CCN(C)CCON Amb24545475 [1,1,0,0,0,0|1,0,1]=4 4127 B7R0.3 CCN(C)C\C=C\Cl Amb25091752 [1,1,0,0,0,0|2,0,0]=4 4128 B7R0.3 CC[C@@H](C)CCCBr Amb24740782 [1,1,0,0,0,0|1,0,1]=4 4129 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,1]=3 4130 B7R0.3 CC[C@@H](C)NCC#C Amb25126083 [1,1,0,0,0,0|1,0,1]=4 4131 B7R0.3 CC[C@@H](O)\C=C\C=O Amb24678734 [1,1,0,0,0,0|1,0,1]=4 4132 B7R0.3 CC[C@H](C)C#CC=O Amb25714235 [1,1,0,0,0,0|0,0,1]=3 4133 B7R0.3 CC[C@H](C)CCC=O Amb25102725 [1,1,0,0,0,0|0,0,0]=2 4134 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,1]=3 4135 B7R0.3 CC[C@H](C)CNC=O Amb24481319 [1,1,0,0,0,0|0,0,0]=2 4136 B7R0.3 CC[C@H](C)COCCl Amb24560924 [1,1,0,0,0,0|1,0,1]=4 4137 B7R0.3 CC[C@H](C)NCC#C Amb25727236 [1,1,0,0,0,0|1,0,1]=4 4138 B7R0.3 CC[C@H](C)\C=C\CO Amb25142932 [1,1,0,0,0,0|0,0,1]=3 4139 B7R0.3 CC[C@H](O)C\C=C/Cl Amb25304882 [1,1,0,0,0,0|2,0,0]=4 4140 B7R0.3 CC[C@H](O)\C=C\CO Amb25185222 [1,1,0,0,0,0|1,0,1]=4 4141 B7R0.3 CC\C(\C)=C/CC=O Amb24657093 [1,1,0,0,0,0|0,0,1]=3 4142 B7R0.3 CC\C(\C)=C/CCO Amb25264354 [1,1,0,0,0,0|0,0,2]=4 4143 B7R0.3 CC\C(\C)=C\CC=C Amb24694420 [1,1,0,0,0,0|1,0,1]=4 4144 B7R0.3 CNC(C)CCC=C Amb18641747 [1,1,0,0,0,0|2,0,0]=4 4145 B7R0.3 COC(C)CN=C=O Amb25262746 [1,1,0,0,0,0|1,0,1]=4 4146 B7R0.3 COC(C)CNC=O Amb25127774 [1,1,0,0,0,0|1,0,0]=3 4147 B7R0.3 COC(C)OCCO Amb25823344 [1,1,0,0,0,0|1,0,1]=4 4148 B7R0.3 COC(C)\C=C/C=O Amb25770506 [1,1,0,0,0,0|1,0,1]=4 4149 B7R0.3 COC(C)\C=C\CO Amb25788144 [1,1,0,0,0,0|1,0,1]=4 4150 B7R0.3 COCCC(C)OC Amb24060657 [1,1,0,0,0,0|1,0,1]=4 4151 B7R0.3 COCCC(NC)C Amb17569918 [1,1,0,0,0,0|1,0,1]=4 4152 B7R0.3 COCC[C@@H](C)CO Amb24412889 [1,1,0,0,0,0|1,0,1]=4 4153 B7R0.3 COCC[C@H](C)CO Amb25333737 [1,1,0,0,0,0|1,0,1]=4 4154 B7R0.3 CO[C@@H](C)CCCO Amb25306514 [1,1,0,0,0,0|1,0,1]=4 4155 B7R0.3 CO[C@@H](C)OCCO Amb24386800 [1,1,0,0,0,0|1,0,1]=4 4156 B7R0.3 CO[C@@H](C)\C=C\C=O Amb25043129 [1,1,0,0,0,0|1,0,1]=4 4157 B7R0.3 CO[C@@H](C)\C=C\CO Amb24474945 [1,1,0,0,0,0|1,0,1]=4 4158 B7R0.3 CO\C(\C)=C\CC=O Amb25365197 [1,1,0,0,0,0|1,0,1]=4 4159 B7R0.3 CSC(C)CNC=O Amb24741113 [1,1,0,0,0,0|1,0,0]=3 4160 B7R0.3 C[C@@H](CCC=O)C=C Amb25025116 [1,1,0,0,0,0|0,0,2]=4 4161 B7R0.3 C[C@@H](CCCO)CO Amb24475366 [1,1,0,0,0,0|1,0,1]=4 4162 B7R0.3 C[C@@H](CN)NCCO Amb25099589 [1,1,0,0,0,0|1,0,1]=4 4163 B7R0.3 C[C@@H](CO)CCC=C Amb25700125 [1,1,0,0,0,0|2,0,0]=4 4164 B7R0.3 C[C@@H](CO)CCC=O Amb24602985 [1,1,0,0,0,0|1,0,0]=3 4165 B7R0.3 C[C@@H](CO)CNC=O Amb25180638 [1,1,0,0,0,0|1,0,0]=3 4166 B7R0.3 C[C@@H](CO)OCC=C Amb25228448 [1,1,0,0,0,0|2,0,0]=4 4167 B7R0.3 C[C@H](CCC=O)C=C Amb25810817 [1,1,0,0,0,0|0,0,2]=4 4168 B7R0.3 C[C@H](CCC=O)C=O Amb24707164 [1,1,0,0,0,0|1,0,1]=4 4169 B7R0.3 C[C@H](CN)CCCO Amb24426785 [1,1,0,0,0,0|1,0,1]=4 4170 B7R0.3 C\C(\CC)=C\NC=O Amb24392941 [1,1,0,0,0,0|0,0,2]=4 4171 B7R0.3 C\C=C(/C)\CCC=O Amb18641710 [1,1,0,0,0,0|0,0,2]=4 4172 B7R0.3 C\C=C(\C)/CCC=O Amb24425599 [1,1,0,0,0,0|0,0,2]=4 4173 B7R0.3 C\C=C\CC(Cl)CC Amb24519441 [1,1,0,0,0,0|2,0,0]=4 4174 B7R0.3 C\C=C\CC(O)CC Amb25781191 [1,1,0,0,0,0|2,0,0]=4 4175 B7R0.3 C\C=C\CN(C)CC Amb24351854 [1,1,0,0,0,0|2,0,0]=4 4176 B7R0.3 ClCCNC(CC)C Amb17334146 [1,1,0,0,0,0|1,0,1]=4 4177 B7R0.3 NCCCC(CC)C Amb17569898 [1,1,0,0,0,0|1,0,1]=4 4178 B7R0.3 O=COCC(Cl)CCl Amb24481388 [1,1,0,0,0,0|2,0,0]=4 4179 B7R0.3 O=COCC(Cl)CF Amb25725025 [1,1,0,0,0,0|2,0,0]=4 4180 B7R0.3 OC(CBr)CCC=O Amb24559224 [1,1,0,0,0,0|2,0,0]=4 4181 B7R0.3 OC(CCl)CNC=O Amb25137565 [1,1,0,0,0,0|2,0,0]=4 4182 B7R0.3 OC(CCl)COC=O Amb25315901 [1,1,0,0,0,0|2,0,0]=4 4183 B7R0.3 OC(CS)SCC=O Amb24574024 [1,1,0,0,0,0|2,0,0]=4 4184 B7R0.3 OCC(O)CCC=O Amb24669095 [1,1,0,0,0,0|2,0,0]=4 4185 B7R0.3 OCC(O)COC=O Amb25787203 [1,1,0,0,0,0|2,0,0]=4 4186 B7R0.3 OCC(O)OCC=O Amb25046498 [1,1,0,0,0,0|2,0,0]=4 4187 B7R0.3 OCCCC(CC)O Amb17593216 [1,1,0,0,0,0|1,0,1]=4 4188 B7R0.3 OCCCC(CN)C Amb17569906 [1,1,0,0,0,0|1,0,1]=4 4189 B7R0.3 OC[C@@H](O)CCC=O Amb24482301 [1,1,0,0,0,0|2,0,0]=4 4190 B7R0.3 OC[C@H](O)CCC=O Amb25123219 [1,1,0,0,0,0|2,0,0]=4 4191 B7R0.3 OC[C@H](O)COC=O Amb25831941 [1,1,0,0,0,0|2,0,0]=4 4192 B7R0.3 O[C@@H](CBr)CCC=O Amb24390114 [1,1,0,0,0,0|2,0,0]=4 4193 B7R0.5 CC(=C)C(O)CC=O Amb24481571 [1,1,0,0,0,0|1,0,1]=4 4194 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 4195 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [1,1,0,0,0,0|1,0,1]=4 4196 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,1,0,0,0,0|0,0,2]=4 4197 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|1,0,1]=4 4198 B7R0.5 CC(C)C(C)=CC=O Amb24716010 [1,1,0,0,0,0|0,0,2]=4 4199 B7R0.5 CC(C)C(C)CC=C Amb22229588 [1,1,0,0,0,0|1,0,0]=3 4200 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|0,0,0]=2 4201 B7R0.5 CC(C)C(C)CCBr Amb24425543 [1,1,0,0,0,0|1,0,1]=4 4202 B7R0.5 CC(C)C(C)CCCl Amb25315867 [1,1,0,0,0,0|1,0,1]=4 4203 B7R0.5 CC(C)C(C)CCN Amb18293552 [1,1,0,0,0,0|1,0,1]=4 4204 B7R0.5 CC(C)C(C)CNC Amb18523788 [1,1,0,0,0,0|2,0,0]=4 4205 B7R0.5 CC(C)C(C)CNO Amb24747759 [1,1,0,0,0,0|1,0,0]=3 4206 B7R0.5 CC(C)C(C)N=C=O Amb25235166 [1,1,0,0,0,0|1,0,1]=4 4207 B7R0.5 CC(C)C(C)NC=O Amb24631907 [1,1,0,0,0,0|1,0,0]=3 4208 B7R0.5 CC(C)C(C)OC=C Amb24483239 [1,1,0,0,0,0|2,0,0]=4 4209 B7R0.5 CC(C)C(Cl)CC=C Amb24624776 [1,1,0,0,0,0|2,0,0]=4 4210 B7R0.5 CC(C)C(Cl)CCO Amb25108657 [1,1,0,0,0,0|1,0,1]=4 4211 B7R0.5 CC(C)C(Cl)OC=O Amb24533537 [1,1,0,0,0,0|2,0,0]=4 4212 B7R0.5 CC(C)C(N)CC=C Amb18292096 [1,1,0,0,0,0|2,0,0]=4 4213 B7R0.5 CC(C)C(N)NC=O Amb25804048 [1,1,0,0,0,0|2,0,0]=4 4214 B7R0.5 CC(C)C(O)CC=C Amb22052662 [1,1,0,0,0,0|2,0,0]=4 4215 B7R0.5 CC(C)C(O)CC=O Amb24584440 [1,1,0,0,0,0|1,0,0]=3 4216 B7R0.5 CC(C)C(S)CCO Amb24752250 [1,1,0,0,0,0|1,0,1]=4 4217 B7R0.5 CC(C)N(C)CC=O Amb24372300 [1,1,0,0,0,0|1,0,0]=3 4218 B7R0.5 CC(C)[C@@H](C)N=C=O Amb22045305 [1,1,0,0,0,0|1,0,1]=4 4219 B7R0.5 CC(C)[C@@H](N)CC=C Amb22831776 [1,1,0,0,0,0|2,0,0]=4 4220 B7R0.5 CC(C)[C@@H](O)CC=C Amb25203918 [1,1,0,0,0,0|2,0,0]=4 4221 B7R0.5 CC(C)[C@@H](O)CCO Amb25136289 [1,1,0,0,0,0|1,0,1]=4 4222 B7R0.5 CC(C)[C@@H](S)CCO Amb24576998 [1,1,0,0,0,0|1,0,1]=4 4223 B7R0.5 CC(C)[C@H](C)CC=O Amb25253560 [1,1,0,0,0,0|0,0,0]=2 4224 B7R0.5 CC(C)[C@H](C)N=C=O Amb22053850 [1,1,0,0,0,0|1,0,1]=4 4225 B7R0.5 CC(C)[C@H](O)CC=C Amb25730329 [1,1,0,0,0,0|2,0,0]=4 4226 B7R0.5 CC(C)[C@H](O)CC=O Amb24481570 [1,1,0,0,0,0|1,0,0]=3 4227 B7R0.5 CC(C)[C@H](O)CCO Amb25169342 [1,1,0,0,0,0|1,0,1]=4 4228 B7R0.5 CC(C)\C(\C)=C\C=O Amb18641697 [1,1,0,0,0,0|0,0,2]=4 4229 B7R0.5 CC(CC#C)C(C)N Amb24483217 [1,1,0,0,0,0|1,0,1]=4 4230 B7R0.5 CC(CC#C)C(C)O Amb25821661 [1,1,0,0,0,0|1,0,1]=4 4231 B7R0.5 CC(CC#N)C(C)O Amb25740670 [1,1,0,0,0,0|1,0,1]=4 4232 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [1,1,0,0,0,0|1,0,1]=4 4233 B7R0.5 CC(CC=C)C(C)Br Amb25225842 [1,1,0,0,0,0|1,0,0]=3 4234 B7R0.5 CC(CC=C)C(C)Cl Amb24483218 [1,1,0,0,0,0|1,0,0]=3 4235 B7R0.5 CC(CC=C)C(C)N Amb25727321 [1,1,0,0,0,0|1,0,0]=3 4236 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [1,1,0,0,0,0|0,0,1]=3 4237 B7R0.5 CC(CC=O)N(C)C Amb18203067 [1,1,0,0,0,0|1,0,0]=3 4238 B7R0.5 CC(CCO)C(C)N Amb23555790 [1,1,0,0,0,0|0,0,1]=3 4239 B7R0.5 CC(CNC)C(C)O Amb25809434 [1,1,0,0,0,0|2,0,0]=4 4240 B7R0.5 CC(COC)C(C)O Amb24746662 [1,1,0,0,0,0|2,0,0]=4 4241 B7R0.5 CC(CSC)C(C)N Amb25762170 [1,1,0,0,0,0|2,0,0]=4 4242 B7R0.5 CC(Cl)C(C)CCO Amb24563830 [1,1,0,0,0,0|0,0,1]=3 4243 B7R0.5 CC(N)C(C)CCN Amb18641913 [1,1,0,0,0,0|1,0,1]=4 4244 B7R0.5 CC(N)C(C)CON Amb25339366 [1,1,0,0,0,0|2,0,0]=4 4245 B7R0.5 CC(N)C(O)CC=C Amb18124257 [1,1,0,0,0,0|2,0,0]=4 4246 B7R0.5 CC(NC=O)C(C)=O Amb23442778 [1,1,0,0,0,0|1,0,1]=4 4247 B7R0.5 CC(NC=O)C(C)O Amb25347778 [1,1,0,0,0,0|1,0,0]=3 4248 B7R0.5 CC(O)C(C)CCN Amb18202662 [1,1,0,0,0,0|1,0,1]=4 4249 B7R0.5 CC(O)C(Cl)CC=C Amb25109284 [1,1,0,0,0,0|2,0,0]=4 4250 B7R0.5 CC(O)C(O)CC=C Amb24734248 [1,1,0,0,0,0|2,0,0]=4 4251 B7R0.5 CC(O)C(O)CC=O Amb25745503 [1,1,0,0,0,0|1,0,0]=3 4252 B7R0.5 CC(O)C(O)CCO Amb25851421 [1,1,0,0,0,0|1,0,1]=4 4253 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [1,1,0,0,0,0|0,0,1]=3 4254 B7R0.5 CC(O)[C@@H](N)CC=C Amb24367846 [1,1,0,0,0,0|2,0,0]=4 4255 B7R0.5 CC(O)[C@H](N)CC=C Amb25336245 [1,1,0,0,0,0|2,0,0]=4 4256 B7R0.5 CC(SC=C)C(C)O Amb25676605 [1,1,0,0,0,0|2,0,0]=4 4257 B7R0.5 CC(\C=C\Cl)C(C)O Amb25101501 [1,1,0,0,0,0|1,0,1]=4 4258 B7R0.5 CCCC(C)C(C)Br Amb18184253 [1,1,0,0,0,0|1,0,1]=4 4259 B7R0.5 CCCC(C)C(C)Cl Amb25074279 [1,1,0,0,0,0|1,0,1]=4 4260 B7R0.5 CCCC(C)C(C)N Amb18289572 [1,1,0,0,0,0|1,0,1]=4 4261 B7R0.5 CCC[C@@H](C)[C@@H](C)N Amb25843225 [1,1,0,0,0,0|1,0,1]=4 4262 B7R0.5 CCC[C@@H](C)[C@H](C)N Amb24392737 [1,1,0,0,0,0|1,0,1]=4 4263 B7R0.5 CCC[C@H](C)C(C)O Amb25662135 [1,1,0,0,0,0|1,0,1]=4 4264 B7R0.5 CCC[C@H](C)[C@H](C)N Amb24460677 [1,1,0,0,0,0|1,0,1]=4 4265 B7R0.5 C[C@@H](CC#N)[C@@H](C)O Amb25792335 [1,1,0,0,0,0|1,0,1]=4 4266 B7R0.5 C[C@@H](CC#N)[C@H](C)O Amb24748439 [1,1,0,0,0,0|1,0,1]=4 4267 B7R0.5 C[C@@H](CC=O)C(Cl)Cl Amb25321996 [1,1,0,0,0,0|1,0,0]=3 4268 B7R0.5 C[C@@H](N)C(O)CC=C Amb25367750 [1,1,0,0,0,0|2,0,0]=4 4269 B7R0.5 C[C@@H](O)C(N)CC=C Amb24332662 [1,1,0,0,0,0|2,0,0]=4 4270 B7R0.5 C[C@@H](O)C(O)CC=C Amb25344994 [1,1,0,0,0,0|2,0,0]=4 4271 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [1,1,0,0,0,0|0,0,1]=3 4272 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [1,1,0,0,0,0|0,0,1]=3 4273 B7R0.5 C[C@@H](O)[C@H](F)CC=C Amb24420825 [1,1,0,0,0,0|2,0,0]=4 4274 B7R0.5 C[C@@H](O)[C@H](O)CC=C Amb25106054 [1,1,0,0,0,0|2,0,0]=4 4275 B7R0.5 C[C@@H](OC=O)[C@H](C)Br Amb25701559 [1,1,0,0,0,0|1,0,0]=3 4276 B7R0.5 C[C@@H](\C=C/Cl)[C@@H](C)O Amb24483187 [1,1,0,0,0,0|1,0,1]=4 4277 B7R0.5 C[C@H](CC#N)C(C)Br Amb24333907 [1,1,0,0,0,0|1,0,1]=4 4278 B7R0.5 C[C@H](CC#N)[C@@H](C)O Amb24675390 [1,1,0,0,0,0|1,0,1]=4 4279 B7R0.5 C[C@H](CC#N)[C@H](C)O Amb24733200 [1,1,0,0,0,0|1,0,1]=4 4280 B7R0.5 C[C@H](CC=C)[C@@H](C)O Amb25072004 [1,1,0,0,0,0|1,0,0]=3 4281 B7R0.5 C[C@H](CC=C)[C@H](C)O Amb24717463 [1,1,0,0,0,0|1,0,0]=3 4282 B7R0.5 C[C@H](CC=O)C(Cl)Cl Amb25363179 [1,1,0,0,0,0|1,0,0]=3 4283 B7R0.5 C[C@H](COC)[C@H](C)Cl Amb25672086 [1,1,0,0,0,0|2,0,0]=4 4284 B7R0.5 C[C@H](O)[C@@H](N)CC=C Amb25264318 [1,1,0,0,0,0|2,0,0]=4 4285 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [1,1,0,0,0,0|0,0,1]=3 4286 B7R0.5 C[C@H](O)[C@H](N)CC=C Amb24454742 [1,1,0,0,0,0|2,0,0]=4 4287 B7R0.5 C[C@H](OC=O)[C@H](C)Br Amb25061373 [1,1,0,0,0,0|1,0,0]=3 4288 B7R0.5 C[C@H](\C=C/Cl)[C@@H](C)O Amb24526763 [1,1,0,0,0,0|1,0,1]=4 4289 B7R0.5 C[C@H](\C=C/Cl)[C@H](C)O Amb25331248 [1,1,0,0,0,0|1,0,1]=4 4290 B7R0.5 C\C=C\[C@@H](C)[C@H](C)O Amb25056250 [1,1,0,0,0,0|1,0,1]=4 4291 B7R0.5 O=CCN(C(=O)C)C Amb17080668 [1,1,0,0,0,0|1,0,1]=4 4292 B7R0.5 OCCC(C(C)C)N Amb1993950 [1,1,0,0,0,0|1,0,1]=4 4293 B7R0.7 C=CCC(O)CCO Amb24379908 [1,1,0,0,0,0|2,0,0]=4 4294 B7R0.7 C=CC[C@@H](O)CCBr Amb25347848 [1,1,0,0,0,0|2,0,0]=4 4295 B7R0.7 C=CC[C@@H](O)CCO Amb25762096 [1,1,0,0,0,0|2,0,0]=4 4296 B7R0.7 C=CC[C@H](N)CCO Amb25138355 [1,1,0,0,0,0|2,0,0]=4 4297 B7R0.7 C=CC[C@H](O)CCO Amb25219225 [1,1,0,0,0,0|2,0,0]=4 4298 B7R0.7 CC(=CC=O)SCC Amb24512971 [1,1,0,0,0,0|0,0,2]=4 4299 B7R0.7 CC(CC#C)NC=O Amb24573924 [1,1,0,0,0,0|1,0,1]=4 4300 B7R0.7 CC(CC#N)NC=O Amb25830634 [1,1,0,0,0,0|1,0,1]=4 4301 B7R0.7 CC(CC=O)C=C=C Amb25075623 [1,1,0,0,0,0|0,0,2]=4 4302 B7R0.7 CC(CC=O)CC#C Amb25173462 [1,1,0,0,0,0|0,0,1]=3 4303 B7R0.7 CC(CC=O)N=C=S Amb24711439 [1,1,0,0,0,0|1,0,1]=4 4304 B7R0.7 CC(CC=O)N=CS Amb24359143 [1,1,0,0,0,0|1,0,1]=4 4305 B7R0.7 CC(CC=O)N=[N+]=[N-] Amb25780093 [1,1,0,0,0,0|2,0,0]=4 4306 B7R0.7 CC(CC=O)OC=O Amb25319337 [1,1,0,0,0,0|1,0,1]=4 4307 B7R0.7 CC(CC=O)\C=C\Cl Amb24481505 [1,1,0,0,0,0|0,0,2]=4 4308 B7R0.7 CC(CCBr)CC=C Amb25211241 [1,1,0,0,0,0|1,0,0]=3 4309 B7R0.7 CC(CCC)CCC Amb22229829 [1,1,0,0,0,0|1,0,1]=4 4310 B7R0.7 CC(CCI)CCI Amb24483140 [1,1,0,0,0,0|1,0,1]=4 4311 B7R0.7 CC(CCN)CCCl Amb25024312 [1,1,0,0,0,0|1,0,1]=4 4312 B7R0.7 CC(CCN)CCN Amb25138224 [1,1,0,0,0,0|1,0,1]=4 4313 B7R0.7 CC(CCO)CCBr Amb25108054 [1,1,0,0,0,0|0,0,1]=3 4314 B7R0.7 CC(CCO)CCCl Amb24481342 [1,1,0,0,0,0|0,0,1]=3 4315 B7R0.7 CC(CCO)CCI Amb25262818 [1,1,0,0,0,0|0,0,1]=3 4316 B7R0.7 CC(CCO)CCO Amb17939001 [1,1,0,0,0,0|0,0,1]=3 4317 B7R0.7 CC(NCC)CC#N Amb17334053 [1,1,0,0,0,0|1,0,1]=4 4318 B7R0.7 CC=CC(C)CC=C Amb22229833 [1,1,0,0,0,0|1,0,1]=4 4319 B7R0.7 CCCC(Br)CC=C Amb24483087 [1,1,0,0,0,0|2,0,0]=4 4320 B7R0.7 CCCC(C)CC=O Amb18641815 [1,1,0,0,0,0|0,0,0]=2 4321 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,0]=3 4322 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,1]=4 4323 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,1]=4 4324 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,1]=3 4325 B7R0.7 CCCC(C)C[Mg]Cl Amb22897342 [1,1,0,0,0,0|2,0,0]=4 4326 B7R0.7 CCCC(C)C[Zn]Cl Amb22897377 [1,1,0,0,0,0|2,0,0]=4 4327 B7R0.7 CCCC(C)N=C=O Amb21961819 [1,1,0,0,0,0|1,0,1]=4 4328 B7R0.7 CCCC(C)OC=C Amb25069569 [1,1,0,0,0,0|2,0,0]=4 4329 B7R0.7 CCCC(C)\C=N\O Amb25335725 [1,1,0,0,0,0|1,0,1]=4 4330 B7R0.7 CCCC(N)CC=C Amb19015526 [1,1,0,0,0,0|2,0,0]=4 4331 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|1,0,1]=4 4332 B7R0.7 CCCC(O)CC=O Amb18641890 [1,1,0,0,0,0|1,0,0]=3 4333 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|1,0,1]=4 4334 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|1,0,0]=3 4335 B7R0.7 CCCN(C)CC=O Amb25820883 [1,1,0,0,0,0|1,0,0]=3 4336 B7R0.7 CCCS(=O)CC=O Amb24483295 [1,1,0,0,0,0|2,0,0]=4 4337 B7R0.7 CCC[C@@H](C)CCO Amb24351627 [1,1,0,0,0,0|0,0,1]=3 4338 B7R0.7 CCC[C@@H](N)CC=C Amb25324586 [1,1,0,0,0,0|2,0,0]=4 4339 B7R0.7 CCC[C@@H](N)CCO Amb22745145 [1,1,0,0,0,0|1,0,1]=4 4340 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|1,0,1]=4 4341 B7R0.7 CCC[C@@H](O)CC=O Amb25290213 [1,1,0,0,0,0|1,0,0]=3 4342 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|1,0,1]=4 4343 B7R0.7 CCC[C@@H](S)CCO Amb25676566 [1,1,0,0,0,0|1,0,1]=4 4344 B7R0.7 CCC[C@H](C)CC=O Amb24696396 [1,1,0,0,0,0|0,0,0]=2 4345 B7R0.7 CCC[C@H](C)CCCl Amb24481438 [1,1,0,0,0,0|1,0,1]=4 4346 B7R0.7 CCC[C@H](C)CCN Amb25836227 [1,1,0,0,0,0|1,0,1]=4 4347 B7R0.7 CCC[C@H](O)CCO Amb25058562 [1,1,0,0,0,0|1,0,1]=4 4348 B7R0.7 CCC\C(\C)=C/C=O Amb25039965 [1,1,0,0,0,0|0,0,2]=4 4349 B7R0.7 CCNC(C)CC#C Amb18987206 [1,1,0,0,0,0|1,0,1]=4 4350 B7R0.7 CCNC(C)CC=C Amb19015834 [1,1,0,0,0,0|1,0,0]=3 4351 B7R0.7 CCNC(C)CCBr Amb24694482 [1,1,0,0,0,0|1,0,1]=4 4352 B7R0.7 CCNC(C)CCC Amb22586730 [1,1,0,0,0,0|1,0,1]=4 4353 B7R0.7 CCNC(C)CCCl Amb25046377 [1,1,0,0,0,0|1,0,1]=4 4354 B7R0.7 CCNC(C)CCN Amb19030961 [1,1,0,0,0,0|1,0,1]=4 4355 B7R0.7 CCNC(C)CSC Amb18313762 [1,1,0,0,0,0|2,0,0]=4 4356 B7R0.7 CCN[C@@H](C)CCO Amb24333122 [1,1,0,0,0,0|0,0,1]=3 4357 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|0,0,0]=2 4358 B7R0.7 CCOC(C)CCC Amb22733741 [1,1,0,0,0,0|1,0,1]=4 4359 B7R0.7 CCOC(C)CCCl Amb24472887 [1,1,0,0,0,0|1,0,1]=4 4360 B7R0.7 CCOC(C)CNN Amb24436336 [1,1,0,0,0,0|2,0,0]=4 4361 B7R0.7 CCO[C@@H](C)CCO Amb24619159 [1,1,0,0,0,0|0,0,1]=3 4362 B7R0.7 CCO[C@H](C)CCO Amb25065482 [1,1,0,0,0,0|0,0,1]=3 4363 B7R0.7 CCSC(C)CC=O Amb22232285 [1,1,0,0,0,0|0,0,0]=2 4364 B7R0.7 CCSC(C)CCN Amb18306010 [1,1,0,0,0,0|1,0,1]=4 4365 B7R0.7 CCSC(C)CNC Amb19025498 [1,1,0,0,0,0|2,0,0]=4 4366 B7R0.7 CCSC(C)COC Amb25805617 [1,1,0,0,0,0|2,0,0]=4 4367 B7R0.7 CCSC(C)N=C=O Amb24376698 [1,1,0,0,0,0|1,0,1]=4 4368 B7R0.7 CC\C=C(\C)/CC=C Amb25238384 [1,1,0,0,0,0|1,0,1]=4 4369 B7R0.7 CN(CC=O)CC#C Amb24456583 [1,1,0,0,0,0|1,0,1]=4 4370 B7R0.7 CN(CC=O)CC=O Amb25335558 [1,1,0,0,0,0|1,0,1]=4 4371 B7R0.7 CN(CCBr)CC=C Amb25349445 [1,1,0,0,0,0|2,0,0]=4 4372 B7R0.7 CN(CCI)CC=C Amb25353953 [1,1,0,0,0,0|2,0,0]=4 4373 B7R0.7 CN(CCO)CCBr Amb18179238 [1,1,0,0,0,0|1,0,1]=4 4374 B7R0.7 CN(CCO)CCCl Amb24101948 [1,1,0,0,0,0|1,0,1]=4 4375 B7R0.7 CNCC(C)CC#C Amb25024313 [1,1,0,0,0,0|1,0,1]=4 4376 B7R0.7 CNCC(C)CC=C Amb24699091 [1,1,0,0,0,0|1,0,0]=3 4377 B7R0.7 CNCC(C)CCCl Amb25359085 [1,1,0,0,0,0|1,0,1]=4 4378 B7R0.7 CNCC(C)CSC Amb24464854 [1,1,0,0,0,0|2,0,0]=4 4379 B7R0.7 CNCC(C)NCC Amb19022873 [1,1,0,0,0,0|2,0,0]=4 4380 B7R0.7 CNCC(CCN)C Amb17334067 [1,1,0,0,0,0|1,0,1]=4 4381 B7R0.7 CNCC(CCO)C Amb17569901 [1,1,0,0,0,0|0,0,1]=3 4382 B7R0.7 CNCC(COC)C Amb17569917 [1,1,0,0,0,0|2,0,0]=4 4383 B7R0.7 CNCC(N)CC=C Amb25685521 [1,1,0,0,0,0|2,0,0]=4 4384 B7R0.7 CNCC(O)CC=C Amb24471234 [1,1,0,0,0,0|2,0,0]=4 4385 B7R0.7 CNCC(OCC)C Amb10608191 [1,1,0,0,0,0|2,0,0]=4 4386 B7R0.7 COCC(Br)CCO Amb25286452 [1,1,0,0,0,0|1,0,1]=4 4387 B7R0.7 COCC(C)CC=C Amb25662892 [1,1,0,0,0,0|1,0,0]=3 4388 B7R0.7 COCC(C)CC=O Amb24761492 [1,1,0,0,0,0|0,0,0]=2 4389 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|0,0,1]=3 4390 B7R0.7 COCC(C)N=C=O Amb23598696 [1,1,0,0,0,0|1,0,1]=4 4391 B7R0.7 COCC(C)OC=C Amb24556890 [1,1,0,0,0,0|2,0,0]=4 4392 B7R0.7 COCC(CCN)C Amb17569914 [1,1,0,0,0,0|1,0,1]=4 4393 B7R0.7 COCC(N)CC=C Amb19018008 [1,1,0,0,0,0|2,0,0]=4 4394 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|1,0,1]=4 4395 B7R0.7 COCC(O)CC=C Amb25222392 [1,1,0,0,0,0|2,0,0]=4 4396 B7R0.7 COCC(O)CC=O Amb25696549 [1,1,0,0,0,0|1,0,0]=3 4397 B7R0.7 COCC(O)CCO Amb23512858 [1,1,0,0,0,0|1,0,1]=4 4398 B7R0.7 COC[C@@H](O)CCO Amb25086103 [1,1,0,0,0,0|1,0,1]=4 4399 B7R0.7 CSCC(C)N=C=O Amb24374153 [1,1,0,0,0,0|1,0,1]=4 4400 B7R0.7 CSCC(C)NC=O Amb25138963 [1,1,0,0,0,0|1,0,0]=3 4401 B7R0.7 CSCC(N)CC=C Amb18523850 [1,1,0,0,0,0|2,0,0]=4 4402 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|1,0,1]=4 4403 B7R0.7 C[C@@H](CC=O)CC#C Amb24419911 [1,1,0,0,0,0|0,0,1]=3 4404 B7R0.7 C[C@@H](CC=O)OC=O Amb25678564 [1,1,0,0,0,0|1,0,1]=4 4405 B7R0.7 C[C@@H](CCO)CC#C Amb25788479 [1,1,0,0,0,0|0,0,2]=4 4406 B7R0.7 C[C@@H](CCO)CC=C Amb25332119 [1,1,0,0,0,0|1,0,0]=3 4407 B7R0.7 C[C@@H](CCO)CCBr Amb24662335 [1,1,0,0,0,0|0,0,1]=3 4408 B7R0.7 C[C@H](CCO)CC=C Amb24575596 [1,1,0,0,0,0|1,0,0]=3 4409 B7R0.7 C\C(=C/C=O)\OCC Amb24653643 [1,1,0,0,0,0|0,0,2]=4 4410 B7R0.7 C\C(=C\C=O)\SCC Amb18642814 [1,1,0,0,0,0|0,0,2]=4 4411 B7R0.7 C\C=C/C(C)CCC Amb22359470 [1,1,0,0,0,0|1,0,1]=4 4412 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [1,1,0,0,0,0|0,0,1]=3 4413 B7R0.7 C\C=C\C(C)CCBr Amb25829354 [1,1,0,0,0,0|1,0,1]=4 4414 B7R0.7 C\C=C\C(C)CCN Amb25313440 [1,1,0,0,0,0|1,0,1]=4 4415 B7R0.7 ClCCN(CC=C)C Amb17334140 [1,1,0,0,0,0|2,0,0]=4 4416 B7R0.7 NC(CC=O)CC=O Amb25349657 [1,1,0,0,0,0|1,0,1]=4 4417 B7R0.7 NC(CCO)CCO Amb22491262 [1,1,0,0,0,0|1,0,1]=4 4418 B7R0.7 NC(CCO)CCO Amb25324048 [1,1,0,0,0,0|1,0,1]=4 4419 B7R0.7 NCCC(CCO)C Amb17569905 [1,1,0,0,0,0|0,0,1]=3 4420 B7R0.7 NCCN(CC=C)C Amb17334062 [1,1,0,0,0,0|2,0,0]=4 4421 B7R0.7 NCCN(CCO)C Amb10608118 [1,1,0,0,0,0|1,0,1]=4 4422 B7R0.7 O=CCC(CC=O)C Amb17593183 [1,1,0,0,0,0|0,0,1]=3 4423 B7R0.7 OC(CC=O)CC=O Amb18641864 [1,1,0,0,0,0|1,0,1]=4 4424 B7R0.7 OCCC(CCO)O Amb17593226 [1,1,0,0,0,0|1,0,1]=4 4425 B7R0.7 OCCN(CC=C)C Amb10570005 [1,1,0,0,0,0|2,0,0]=4 4426 B7R0.10 CC(C=C)[C@H](O)CC Amb24506540 [1,1,0,0,0,0|2,0,0]=4 4427 B7R0.10 CC(C=O)C(C)C=O Amb18641795 [1,1,0,0,0,0|1,0,1]=4 4428 B7R0.10 CC(C=O)C(S)CC Amb22229341 [1,1,0,0,0,0|1,0,0]=3 4429 B7R0.10 CC(C=O)[C@H](O)CC Amb25827452 [1,1,0,0,0,0|1,0,0]=3 4430 B7R0.10 CC(CC)=C(F)C=O Amb24621033 [1,1,0,0,0,0|0,0,2]=4 4431 B7R0.10 CC(CC)C(Br)CC Amb24406383 [1,1,0,0,0,0|1,0,1]=4 4432 B7R0.10 CC(CC)C(Br)CN Amb24743381 [1,1,0,0,0,0|1,0,1]=4 4433 B7R0.10 CC(CC)C(C)CC Amb22047817 [1,1,0,0,0,0|1,0,1]=4 4434 B7R0.10 CC(CC)C(Cl)C=O Amb25274320 [1,1,0,0,0,0|0,0,0]=2 4435 B7R0.10 CC(CC)C(Cl)CO Amb25337095 [1,1,0,0,0,0|0,0,1]=3 4436 B7R0.10 CC(CC)C(F)C=O Amb24334085 [1,1,0,0,0,0|0,0,0]=2 4437 B7R0.10 CC(CC)C(F)CO Amb25044467 [1,1,0,0,0,0|0,0,1]=3 4438 B7R0.10 CC(CC)C(N)C#N Amb24116647 [1,1,0,0,0,0|1,0,1]=4 4439 B7R0.10 CC(CC)C(N)CC Amb18202770 [1,1,0,0,0,0|1,0,1]=4 4440 B7R0.10 CC(CC)C(N)CF Amb25335528 [1,1,0,0,0,0|1,0,1]=4 4441 B7R0.10 CC(CC)C(N)CO Amb19267092 [1,1,0,0,0,0|0,0,1]=3 4442 B7R0.10 CC(CC)C(O)C#N Amb24116646 [1,1,0,0,0,0|1,0,1]=4 4443 B7R0.10 CC(CC)C(O)C=C Amb25139404 [1,1,0,0,0,0|1,0,0]=3 4444 B7R0.10 CC(CC)C(O)CC Amb22229844 [1,1,0,0,0,0|1,0,1]=4 4445 B7R0.10 CC(CC)C(O)CF Amb24529323 [1,1,0,0,0,0|1,0,1]=4 4446 B7R0.10 CC(CC)C(O)CN Amb18291293 [1,1,0,0,0,0|1,0,1]=4 4447 B7R0.10 CC(CC)C(O)CO Amb24122822 [1,1,0,0,0,0|0,0,1]=3 4448 B7R0.10 CC(CC)C(O)OC Amb25688803 [1,1,0,0,0,0|2,0,0]=4 4449 B7R0.10 CC(CC)[C@@H](N)CO Amb18015117 [1,1,0,0,0,0|0,0,1]=3 4450 B7R0.10 CC(CC)[C@@H](N)CO Amb22800764 [1,1,0,0,0,0|0,0,1]=3 4451 B7R0.10 CC(CC)[C@@H](O)C#N Amb24334500 [1,1,0,0,0,0|1,0,1]=4 4452 B7R0.10 CC(CC)[C@H](N)CN Amb24466085 [1,1,0,0,0,0|1,0,1]=4 4453 B7R0.10 CC(CC)[C@H](O)CC Amb25052801 [1,1,0,0,0,0|1,0,1]=4 4454 B7R0.10 CC(CC)[C@H](O)CO Amb25331134 [1,1,0,0,0,0|0,0,1]=3 4455 B7R0.10 CC(CCl)N(C)C=O Amb25267370 [1,1,0,0,0,0|2,0,0]=4 4456 B7R0.10 CC(CN)C(O)C=C Amb25285273 [1,1,0,0,0,0|2,0,0]=4 4457 B7R0.10 CC(CN)C(O)CO Amb25843290 [1,1,0,0,0,0|1,0,1]=4 4458 B7R0.10 CC(CO)C(N)C=C Amb24482467 [1,1,0,0,0,0|2,0,0]=4 4459 B7R0.10 CC(CO)C(O)CC Amb24461954 [1,1,0,0,0,0|1,0,1]=4 4460 B7R0.10 CC(CO)C(S)CC Amb19515875 [1,1,0,0,0,0|1,0,1]=4 4461 B7R0.10 CC(CO)N(C)C=O Amb25803142 [1,1,0,0,0,0|2,0,0]=4 4462 B7R0.10 CC(N=O)C(C)CCl Amb25203978 [1,1,0,0,0,0|2,0,0]=4 4463 B7R0.10 CC(NC)C(C)CO Amb25278153 [1,1,0,0,0,0|1,0,1]=4 4464 B7R0.10 CC(NC)C(O)C=C Amb24680268 [1,1,0,0,0,0|2,0,0]=4 4465 B7R0.10 CC(NO)C(O)CC Amb25859360 [1,1,0,0,0,0|2,0,0]=4 4466 B7R0.10 CC(OC)C(C)C=O Amb18641882 [1,1,0,0,0,0|1,0,0]=3 4467 B7R0.10 CC(OC)C(N)CO Amb24693968 [1,1,0,0,0,0|1,0,1]=4 4468 B7R0.10 CC(OC)C(O)C=C Amb25077372 [1,1,0,0,0,0|2,0,0]=4 4469 B7R0.10 CC(OC)C(O)CO Amb25769768 [1,1,0,0,0,0|1,0,1]=4 4470 B7R0.10 CC(SC)C(C)C=O Amb24706814 [1,1,0,0,0,0|1,0,0]=3 4471 B7R0.10 CC(SC)C(C)CO Amb24529334 [1,1,0,0,0,0|1,0,1]=4 4472 B7R0.10 CCC(=C)C(C)C=O Amb18641703 [1,1,0,0,0,0|0,0,2]=4 4473 B7R0.10 CCC(=O)C(C)C=O Amb18641776 [1,1,0,0,0,0|1,0,1]=4 4474 B7R0.10 CCC(C(C=O)C)O Amb17593201 [1,1,0,0,0,0|1,0,0]=3 4475 B7R0.10 CCC(C)C(=C)C=O Amb18641701 [1,1,0,0,0,0|0,0,1]=3 4476 B7R0.10 CCC(C)C(=O)C=O Amb24481549 [1,1,0,0,0,0|0,0,1]=3 4477 B7R0.10 CCC(C)C(=O)CO Amb24680373 [1,1,0,0,0,0|0,0,2]=4 4478 B7R0.10 CCC(C)C(C)=CC Amb22229004 [1,1,0,0,0,0|1,0,1]=4 4479 B7R0.10 CCC(C)C(C)C=C Amb22229051 [1,1,0,0,0,0|1,0,0]=3 4480 B7R0.10 CCC(C)C(C)C=O Amb18641810 [1,1,0,0,0,0|0,0,0]=2 4481 B7R0.10 CCC(C)C(C)CN Amb18969884 [1,1,0,0,0,0|1,0,1]=4 4482 B7R0.10 CCC(C)C(C)NN Amb24618021 [1,1,0,0,0,0|2,0,0]=4 4483 B7R0.10 CCC(C)C(C)NO Amb25237205 [1,1,0,0,0,0|1,0,0]=3 4484 B7R0.10 CCC(C)C(C)ON Amb24741152 [1,1,0,0,0,0|2,0,0]=4 4485 B7R0.10 CCC(C)C(Cl)=CCl Amb24627071 [1,1,0,0,0,0|1,0,1]=4 4486 B7R0.10 CCC(C)\C(\N)=N\O Amb19516921 [1,1,0,0,0,0|1,0,1]=4 4487 B7R0.10 CCC(C)\C(\N)=N\O Amb22586630 [1,1,0,0,0,0|1,0,1]=4 4488 B7R0.10 CCC(Cl)C(O)C=C Amb24738470 [1,1,0,0,0,0|2,0,0]=4 4489 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [1,1,0,0,0,0|1,0,1]=4 4490 B7R0.10 CCC(O)C(O)CO Amb24642404 [1,1,0,0,0,0|1,0,1]=4 4491 B7R0.10 CCC(O)[C@H](O)CO Amb24352310 [1,1,0,0,0,0|1,0,1]=4 4492 B7R0.10 CCC([C@@H](C#N)N)C Amb17399795 [1,1,0,0,0,0|1,0,1]=4 4493 B7R0.10 CCN(C)C(C)C=C Amb25792288 [1,1,0,0,0,0|2,0,0]=4 4494 B7R0.10 CCN(C)[C@H](C)CO Amb24393689 [1,1,0,0,0,0|1,0,1]=4 4495 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb17678825 [1,1,0,0,0,0|0,0,1]=3 4496 B7R0.10 CC[C@@H](C)[C@H](C)C=O Amb25062588 [1,1,0,0,0,0|0,0,0]=2 4497 B7R0.10 CC[C@@H](O)[C@@H](Cl)C=C Amb24693772 [1,1,0,0,0,0|2,0,0]=4 4498 B7R0.10 CC[C@@H](O)[C@@H](N)CO Amb25131931 [1,1,0,0,0,0|1,0,1]=4 4499 B7R0.10 CC[C@@H](O)[C@@H](O)C=C Amb25141223 [1,1,0,0,0,0|2,0,0]=4 4500 B7R0.10 CC[C@@H](O)[C@@H](O)CO Amb24354362 [1,1,0,0,0,0|1,0,1]=4 4501 B7R0.10 CC[C@H](Br)[C@H](Cl)CO Amb24640283 [1,1,0,0,0,0|1,0,1]=4 4502 B7R0.10 CC[C@H](C)C(=C)CO Amb25270604 [1,1,0,0,0,0|0,0,2]=4 4503 B7R0.10 CC[C@H](C)C(=O)C=C Amb25052297 [1,1,0,0,0,0|1,0,1]=4 4504 B7R0.10 CC[C@H](F)[C@H](N)CO Amb25197755 [1,1,0,0,0,0|1,0,1]=4 4505 B7R0.10 CC[C@H](O)[C@@H](N)CO Amb25722027 [1,1,0,0,0,0|1,0,1]=4 4506 B7R0.10 CC[C@H](O)[C@@H](O)C=C Amb25092001 [1,1,0,0,0,0|2,0,0]=4 4507 B7R0.10 CC[C@H](O)[C@@H](O)CO Amb25024752 [1,1,0,0,0,0|1,0,1]=4 4508 B7R0.10 CC[C@H](O)[C@H](N)C=C Amb25259236 [1,1,0,0,0,0|2,0,0]=4 4509 B7R0.10 CC[C@H](O)[C@H](O)C=C Amb24588296 [1,1,0,0,0,0|2,0,0]=4 4510 B7R0.10 CC\C(\C)=C(\C)/C=O Amb24602986 [1,1,0,0,0,0|0,0,2]=4 4511 B7R0.10 C[C@@H](C=C)[C@H](C)CO Amb24733215 [1,1,0,0,0,0|2,0,0]=4 4512 B7R0.10 C[C@@H](C=O)[C@@H](C)C=O Amb25827162 [1,1,0,0,0,0|1,0,1]=4 4513 B7R0.10 C[C@@H](C=O)[C@H](O)CC Amb25223087 [1,1,0,0,0,0|1,0,0]=3 4514 B7R0.10 C[C@@H](CC)C(Br)C#N Amb25101679 [1,1,0,0,0,0|1,0,1]=4 4515 B7R0.10 C[C@@H](CC)C(N)C#N Amb25045120 [1,1,0,0,0,0|1,0,1]=4 4516 B7R0.10 C[C@@H](CC)C(N)CC Amb25117978 [1,1,0,0,0,0|1,0,1]=4 4517 B7R0.10 C[C@@H](CC)C(O)CC Amb24448338 [1,1,0,0,0,0|1,0,1]=4 4518 B7R0.10 C[C@@H](CC)C(O)CO Amb24579493 [1,1,0,0,0,0|0,0,1]=3 4519 B7R0.10 C[C@@H](CC)[C@@H](Br)CN Amb25708350 [1,1,0,0,0,0|1,0,1]=4 4520 B7R0.10 C[C@@H](CC)[C@H](Br)C#N Amb24482984 [1,1,0,0,0,0|1,0,1]=4 4521 B7R0.10 C[C@@H](CC)[C@H](Cl)C=O Amb24533977 [1,1,0,0,0,0|0,0,0]=2 4522 B7R0.10 C[C@@H](CC)[C@H](N)CBr Amb24664471 [1,1,0,0,0,0|1,0,1]=4 4523 B7R0.10 C[C@@H](CC)[C@H](N)CC Amb25808852 [1,1,0,0,0,0|1,0,1]=4 4524 B7R0.10 C[C@@H](CC)[C@H](N)CN Amb25357115 [1,1,0,0,0,0|1,0,1]=4 4525 B7R0.10 C[C@@H](CC)[C@H](O)CO Amb25189052 [1,1,0,0,0,0|0,0,1]=3 4526 B7R0.10 C[C@@H](CO)[C@@H](S)CC Amb24462041 [1,1,0,0,0,0|1,0,1]=4 4527 B7R0.10 C[C@@H](CO)[C@H](C)CBr Amb24483094 [1,1,0,0,0,0|1,0,1]=4 4528 B7R0.10 C[C@@H](CO)[C@H](O)CC Amb24361979 [1,1,0,0,0,0|1,0,1]=4 4529 B7R0.10 C[C@@H](CO)[C@H](S)CC Amb24620866 [1,1,0,0,0,0|1,0,1]=4 4530 B7R0.10 C[C@@H](OC)[C@@H](C)C=O Amb25372033 [1,1,0,0,0,0|1,0,0]=3 4531 B7R0.10 C[C@@H](OC)[C@H](N)CO Amb25221786 [1,1,0,0,0,0|1,0,1]=4 4532 B7R0.10 C[C@H](C=O)C(O)CC Amb25294541 [1,1,0,0,0,0|1,0,0]=3 4533 B7R0.10 C[C@H](C=O)[C@@H](C)C=O Amb25827161 [1,1,0,0,0,0|1,0,1]=4 4534 B7R0.10 C[C@H](C=O)[C@@H](C)CO Amb24418439 [1,1,0,0,0,0|1,0,0]=3 4535 B7R0.10 C[C@H](C=O)[C@@H](O)C=O Amb24502787 [1,1,0,0,0,0|1,0,1]=4 4536 B7R0.10 C[C@H](C=O)[C@H](C)C=O Amb24482506 [1,1,0,0,0,0|1,0,1]=4 4537 B7R0.10 C[C@H](C=O)[C@H](O)CC Amb25780605 [1,1,0,0,0,0|1,0,0]=3 4538 B7R0.10 C[C@H](CC)C(O)CC Amb25763922 [1,1,0,0,0,0|1,0,1]=4 4539 B7R0.10 C[C@H](CC)[C@@H](N)C#C Amb25062924 [1,1,0,0,0,0|1,0,1]=4 4540 B7R0.10 C[C@H](CC)[C@@H](N)C=O Amb24731395 [1,1,0,0,0,0|0,0,0]=2 4541 B7R0.10 C[C@H](CC)[C@@H](O)CO Amb24363829 [1,1,0,0,0,0|0,0,1]=3 4542 B7R0.10 C[C@H](CC)[C@H](N)CO Amb25081749 [1,1,0,0,0,0|0,0,1]=3 4543 B7R0.10 C[C@H](CO)[C@@H](O)C=C Amb25801976 [1,1,0,0,0,0|2,0,0]=4 4544 B7R0.10 C[C@H](CO)[C@H](O)CC Amb24398245 [1,1,0,0,0,0|1,0,1]=4 4545 B7R0.10 C[C@H](CO)[C@H](O)CO Amb25357327 [1,1,0,0,0,0|1,0,1]=4 4546 B7R0.10 C[C@H](OC)[C@@H](C)C=O Amb24741787 [1,1,0,0,0,0|1,0,0]=3 4547 B7R0.10 C[C@H](OC)[C@H](C)C=O Amb24759162 [1,1,0,0,0,0|1,0,0]=3 4548 B7R0.10 OC(CCl)C(Cl)C=O Amb24575269 [1,1,0,0,0,0|2,0,0]=4 4549 B7R0.10 OCC(C(CO)C)C Amb17593215 [1,1,0,0,0,0|1,0,1]=4 4550 B7R0.10 OCC(N(CC)C)C Amb10608083 [1,1,0,0,0,0|1,0,1]=4 4551 B7R0.10 OCC(O)[C@H](O)C=O Amb25733091 [1,1,0,0,0,0|2,0,0]=4 4552 B7R0.10 OC[C@@H](O)C(O)C=O Amb24481538 [1,1,0,0,0,0|2,0,0]=4 4553 B7R0.10 OC[C@@H](O)[C@H](O)C=O Amb22746428 [1,1,0,0,0,0|2,0,0]=4 4554 B7R0.10 OC[C@H](O)[C@@H](O)C=O Amb24481533 [1,1,0,0,0,0|2,0,0]=4 4555 B7R0.10 OC[C@H](O)[C@H](O)C=O Amb25839823 [1,1,0,0,0,0|2,0,0]=4 4556 B7R0.11 CC(C)(CBr)CC=C Amb25853098 [1,1,0,0,0,0|2,0,0]=4 4557 B7R0.11 CC(C)(CC=O)C#C Amb25685970 [1,1,0,0,0,0|0,0,2]=4 4558 B7R0.11 CC(C)(CC=O)C=O Amb24693401 [1,1,0,0,0,0|1,0,1]=4 4559 B7R0.11 CC(C)(CCl)CC=C Amb24630347 [1,1,0,0,0,0|2,0,0]=4 4560 B7R0.11 CC(C)(CCl)OC=O Amb24481457 [1,1,0,0,0,0|2,0,0]=4 4561 B7R0.11 CC(C)(CN)CC=C Amb18641743 [1,1,0,0,0,0|2,0,0]=4 4562 B7R0.11 CC(C)(CNO)CO Amb25786898 [1,1,0,0,0,0|2,0,0]=4 4563 B7R0.11 CC(C)(CO)CC=C Amb21858875 [1,1,0,0,0,0|2,0,0]=4 4564 B7R0.11 CC(C)(CO)CC=O Amb24481534 [1,1,0,0,0,0|1,0,0]=3 4565 B7R0.11 CC(F)(CBr)CCO Amb24422557 [1,1,0,0,0,0|1,0,1]=4 4566 B7R0.11 CC(N)(CCO)CO Amb18124265 [1,1,0,0,0,0|1,0,1]=4 4567 B7R0.11 CC(N)(CI)CCO Amb24744706 [1,1,0,0,0,0|1,0,1]=4 4568 B7R0.11 CC(O)(CC=C)CO Amb24332903 [1,1,0,0,0,0|2,0,0]=4 4569 B7R0.11 CC(O)(CC=O)C#C Amb25347710 [1,1,0,0,0,0|0,0,2]=4 4570 B7R0.11 CC(O)(CC=O)C=C Amb18641784 [1,1,0,0,0,0|0,0,2]=4 4571 B7R0.11 CC(O)(CCO)CO Amb24082585 [1,1,0,0,0,0|1,0,1]=4 4572 B7R0.11 CC(O)(CCl)CC=C Amb25073777 [1,1,0,0,0,0|2,0,0]=4 4573 B7R0.11 CC(O)(CN)CC=C Amb24483166 [1,1,0,0,0,0|2,0,0]=4 4574 B7R0.11 CCC(C)(C)CC=C Amb17674170 [1,1,0,0,0,0|1,0,0]=3 4575 B7R0.11 CCC(C)(C)CCBr Amb22227894 [1,1,0,0,0,0|1,0,1]=4 4576 B7R0.11 CCC(C)(C)CCCl Amb19375535 [1,1,0,0,0,0|1,0,1]=4 4577 B7R0.11 CCC(C)(C)CNC Amb18994910 [1,1,0,0,0,0|2,0,0]=4 4578 B7R0.11 CCC(C)(C)CNN Amb25770702 [1,1,0,0,0,0|2,0,0]=4 4579 B7R0.11 CCC(C)(C)N=C=O Amb18963206 [1,1,0,0,0,0|1,0,1]=4 4580 B7R0.11 CCC(C)(C)OC=C Amb22363175 [1,1,0,0,0,0|2,0,0]=4 4581 B7R0.11 CCC(C)(C)ON=O Amb25287666 [1,1,0,0,0,0|2,0,0]=4 4582 B7R0.11 CCC(C)(Cl)CCC Amb22052661 [1,1,0,0,0,0|1,0,1]=4 4583 B7R0.11 CCC(C)(Cl)CCCl Amb25790761 [1,1,0,0,0,0|1,0,1]=4 4584 B7R0.11 CCC(C)(F)CCO Amb24407411 [1,1,0,0,0,0|0,0,1]=3 4585 B7R0.11 CCC(C)(N)CC=C Amb25849362 [1,1,0,0,0,0|1,0,0]=3 4586 B7R0.11 CCC(C)(N)CCO Amb20669289 [1,1,0,0,0,0|0,0,1]=3 4587 B7R0.11 CCC(C)(N)COC Amb18299243 [1,1,0,0,0,0|2,0,0]=4 4588 B7R0.11 CCC(C)(O)CC#C Amb20622996 [1,1,0,0,0,0|1,0,1]=4 4589 B7R0.11 CCC(C)(O)CC#N Amb18641737 [1,1,0,0,0,0|1,0,1]=4 4590 B7R0.11 CCC(C)(O)CCCl Amb25288628 [1,1,0,0,0,0|1,0,1]=4 4591 B7R0.11 CCC(C)(O)CCN Amb18202655 [1,1,0,0,0,0|1,0,1]=4 4592 B7R0.11 CCC(C)(O)CCO Amb25204241 [1,1,0,0,0,0|0,0,1]=3 4593 B7R0.11 CCC(C)(O)CNC Amb18997470 [1,1,0,0,0,0|2,0,0]=4 4594 B7R0.11 CCC(C)(O)CNN Amb25316022 [1,1,0,0,0,0|2,0,0]=4 4595 B7R0.11 CCC(CC=O)(C)C Amb10572829 [1,1,0,0,0,0|0,0,0]=2 4596 B7R0.11 CCC(O)(O)CC=O Amb25733093 [1,1,0,0,0,0|1,0,0]=3 4597 B7R0.11 CCC(\C=N\O)(C)C Amb1014229 [1,1,0,0,0,0|1,0,1]=4 4598 B7R0.11 CCS(=O)(=O)CC=O Amb23452894 [1,1,0,0,0,0|2,0,0]=4 4599 B7R0.11 CC[C@@](C)(N)CC#N Amb24751530 [1,1,0,0,0,0|1,0,1]=4 4600 B7R0.11 CC[C@](C)(O)CCO Amb25080405 [1,1,0,0,0,0|0,0,1]=3 4601 B7R0.11 CC[Si](C)(C)CCO Amb24340086 [1,1,0,0,0,0|0,1,1]=4 4602 B7R0.11 CNC(C)(C)CC=C Amb24671254 [1,1,0,0,0,0|2,0,0]=4 4603 B7R0.11 CNC(C)(C)CNO Amb25260751 [1,1,0,0,0,0|2,0,0]=4 4604 B7R0.11 COC(C)(C)CC=O Amb25715607 [1,1,0,0,0,0|1,0,0]=3 4605 B7R0.11 CSC(C)(C)CCO Amb25227703 [1,1,0,0,0,0|1,0,1]=4 4606 B7R0.11 C[C@@](N)(CO)CC=C Amb25121415 [1,1,0,0,0,0|2,0,0]=4 4607 B7R0.11 C[C@](N)(CO)CC=C Amb25162792 [1,1,0,0,0,0|2,0,0]=4 4608 B7R0.11 C[C@](O)(CC=C)CO Amb25346292 [1,1,0,0,0,0|2,0,0]=4 4609 B7R0.11 C\C=C\C(C)(C)CC Amb25216797 [1,1,0,0,0,0|1,0,1]=4 4610 B7R0.11 O=CCC(C#N)(C)C Amb10071050 [1,1,0,0,0,0|1,0,1]=4 4611 B7R0.11 O=CCC(C=C)(C)C Amb17593166 [1,1,0,0,0,0|0,0,2]=4 4612 B7R0.11 OCCC(CC)(C)C Amb10572828 [1,1,0,0,0,0|0,0,1]=3 4613 B7R0.11 OCCC(CN)(C)C Amb17569910 [1,1,0,0,0,0|1,0,1]=4 4614 B7R0.11 OCCC(NC)(C)C Amb17569911 [1,1,0,0,0,0|1,0,1]=4 4615 B7R0.12 C=CCC(CN)CO Amb18641843 [1,1,0,0,0,0|2,0,0]=4 4616 B7R0.12 C=CCC(CO)CCl Amb24481442 [1,1,0,0,0,0|2,0,0]=4 4617 B7R0.12 C=CCC(CO)CO Amb24450577 [1,1,0,0,0,0|2,0,0]=4 4618 B7R0.12 CCB(CC=C)CC Amb25745568 [1,1,0,0,0,0|2,0,0]=4 4619 B7R0.12 CCC(C#C)NC=O Amb24688371 [1,1,0,0,0,0|1,0,1]=4 4620 B7R0.12 CCC(CBr)CCC Amb24710188 [1,1,0,0,0,0|1,0,1]=4 4621 B7R0.12 CCC(CBr)COC Amb25689729 [1,1,0,0,0,0|2,0,0]=4 4622 B7R0.12 CCC(CBr)CSC Amb24589237 [1,1,0,0,0,0|2,0,0]=4 4623 B7R0.12 CCC(CBr)N=C=O Amb25708487 [1,1,0,0,0,0|1,0,1]=4 4624 B7R0.12 CCC(CC#C)NC Amb18295847 [1,1,0,0,0,0|1,0,1]=4 4625 B7R0.12 CCC(CC#N)SC Amb25761872 [1,1,0,0,0,0|1,0,1]=4 4626 B7R0.12 CCC(CC)=CC=O Amb18641714 [1,1,0,0,0,0|0,0,2]=4 4627 B7R0.12 CCC(CC)C=NO Amb25090286 [1,1,0,0,0,0|1,0,1]=4 4628 B7R0.12 CCC(CC)NC=O Amb25293037 [1,1,0,0,0,0|1,0,0]=3 4629 B7R0.12 CCC(CC)\C=C/Cl Amb24467740 [1,1,0,0,0,0|1,0,1]=4 4630 B7R0.12 CCC(CC=C)C=O Amb18641708 [1,1,0,0,0,0|1,0,1]=4 4631 B7R0.12 CCC(CC=C)CC Amb25358315 [1,1,0,0,0,0|1,0,0]=3 4632 B7R0.12 CCC(CC=C)NC Amb19015833 [1,1,0,0,0,0|1,0,0]=3 4633 B7R0.12 CCC(CC=O)=C=C Amb24483036 [1,1,0,0,0,0|0,0,2]=4 4634 B7R0.12 CCC(CC=O)C=C Amb24483045 [1,1,0,0,0,0|0,0,1]=3 4635 B7R0.12 CCC(CC=O)C=O Amb18641787 [1,1,0,0,0,0|0,0,1]=3 4636 B7R0.12 CCC(CC=O)CC Amb20669521 [1,1,0,0,0,0|0,0,0]=2 4637 B7R0.12 CCC(CC=O)OC Amb25282646 [1,1,0,0,0,0|0,0,0]=2 4638 B7R0.12 CCC(CCBr)CC Amb22641829 [1,1,0,0,0,0|1,0,1]=4 4639 B7R0.12 CCC(CCC)NC Amb19033502 [1,1,0,0,0,0|1,0,1]=4 4640 B7R0.12 CCC(CCCl)CC Amb24388955 [1,1,0,0,0,0|1,0,1]=4 4641 B7R0.12 CCC(CCCl)OC Amb24393345 [1,1,0,0,0,0|1,0,1]=4 4642 B7R0.12 CCC(CCN)CN Amb25189025 [1,1,0,0,0,0|1,0,1]=4 4643 B7R0.12 CCC(CCN)SC Amb19008600 [1,1,0,0,0,0|1,0,1]=4 4644 B7R0.12 CCC(CCO)=CC Amb24617725 [1,1,0,0,0,0|0,0,2]=4 4645 B7R0.12 CCC(CCO)CO Amb25069540 [1,1,0,0,0,0|0,0,1]=3 4646 B7R0.12 CCC(CCO)SC Amb25106045 [1,1,0,0,0,0|0,0,1]=3 4647 B7R0.12 CCC(CCl)CC#C Amb24578612 [1,1,0,0,0,0|1,0,1]=4 4648 B7R0.12 CCC(CCl)COC Amb24712697 [1,1,0,0,0,0|2,0,0]=4 4649 B7R0.12 CCC(CF)CCO Amb25043718 [1,1,0,0,0,0|0,0,1]=3 4650 B7R0.12 CCC(CN)CC=C Amb18641746 [1,1,0,0,0,0|1,0,0]=3 4651 B7R0.12 CCC(CN)CCBr Amb25054118 [1,1,0,0,0,0|1,0,1]=4 4652 B7R0.12 CCC(CN)CCC Amb18523838 [1,1,0,0,0,0|1,0,1]=4 4653 B7R0.12 CCC(CN)CCO Amb20622423 [1,1,0,0,0,0|0,0,1]=3 4654 B7R0.12 CCC(CN)CNC Amb24726946 [1,1,0,0,0,0|2,0,0]=4 4655 B7R0.12 CCC(CN)COC Amb24120384 [1,1,0,0,0,0|2,0,0]=4 4656 B7R0.12 CCC(CNC)NC Amb24376508 [1,1,0,0,0,0|2,0,0]=4 4657 B7R0.12 CCC(CNC)OC Amb19023048 [1,1,0,0,0,0|2,0,0]=4 4658 B7R0.12 CCC(CNO)CC Amb24612926 [1,1,0,0,0,0|1,0,0]=3 4659 B7R0.12 CCC(CO)CC#C Amb25058559 [1,1,0,0,0,0|1,0,1]=4 4660 B7R0.12 CCC(CO)CC#N Amb18641732 [1,1,0,0,0,0|1,0,1]=4 4661 B7R0.12 CCC(CO)N=C=O Amb25737384 [1,1,0,0,0,0|1,0,1]=4 4662 B7R0.12 CCC(COC)NC Amb18311285 [1,1,0,0,0,0|2,0,0]=4 4663 B7R0.12 CCC(CS)CSC Amb25719591 [1,1,0,0,0,0|2,0,0]=4 4664 B7R0.12 CCC(CSC)NC Amb19032081 [1,1,0,0,0,0|2,0,0]=4 4665 B7R0.12 CCC(C[Mg]Br)CC Amb22000561 [1,1,0,0,0,0|2,0,0]=4 4666 B7R0.12 CCC(C[Zn]Br)CC Amb22000420 [1,1,0,0,0,0|2,0,0]=4 4667 B7R0.12 CCN(CC=C)CC Amb17933922 [1,1,0,0,0,0|2,0,0]=4 4668 B7R0.12 CCN(CC=O)CC Amb24612738 [1,1,0,0,0,0|1,0,0]=3 4669 B7R0.12 CCN(CC=O)N=O Amb25185264 [1,1,0,0,0,0|2,0,0]=4 4670 B7R0.12 CCN(CCO)OC Amb25236363 [1,1,0,0,0,0|1,0,1]=4 4671 B7R0.12 CC[C@@H](CC=O)OC Amb25767800 [1,1,0,0,0,0|0,0,0]=2 4672 B7R0.12 CC[C@@H](CO)NC=O Amb24392485 [1,1,0,0,0,0|1,0,0]=3 4673 B7R0.12 CC[C@H](CC=O)OC Amb24662279 [1,1,0,0,0,0|0,0,0]=2 4674 B7R0.12 CC[C@H](CCO)OC Amb24554881 [1,1,0,0,0,0|0,0,1]=3 4675 B7R0.12 CC[C@H](CN)COC Amb25075309 [1,1,0,0,0,0|2,0,0]=4 4676 B7R0.12 CC[C@H](CO)CCC Amb25239995 [1,1,0,0,0,0|1,0,1]=4 4677 B7R0.12 CC[C@H](CO)COC Amb25207907 [1,1,0,0,0,0|2,0,0]=4 4678 B7R0.12 CC[C@H](CO)N=C=O Amb25064467 [1,1,0,0,0,0|1,0,1]=4 4679 B7R0.12 CNCC(CC)CC Amb1119574 [1,1,0,0,0,0|2,0,0]=4 4680 B7R0.12 CN[C@H](CCO)CO Amb24402324 [1,1,0,0,0,0|1,0,1]=4 4681 B7R0.12 CN[C@H](CO)CC=C Amb25330737 [1,1,0,0,0,0|2,0,0]=4 4682 B7R0.12 COC(CC=O)C=C Amb18641792 [1,1,0,0,0,0|0,0,2]=4 4683 B7R0.12 COC(CC=O)C=O Amb25247032 [1,1,0,0,0,0|1,0,1]=4 4684 B7R0.12 COC(CCO)OC Amb25357764 [1,1,0,0,0,0|1,0,1]=4 4685 B7R0.12 CO[C@@H](CCO)CO Amb24544061 [1,1,0,0,0,0|1,0,1]=4 4686 B7R0.12 CSC(CCO)SC Amb24752117 [1,1,0,0,0,0|1,0,1]=4 4687 B7R0.12 CS\C(\CC)=C/C=O Amb18642818 [1,1,0,0,0,0|0,0,2]=4 4688 B7R0.12 C\C=C/[C@@H](CC)NC Amb25327916 [1,1,0,0,0,0|1,0,1]=4 4689 B7R0.12 C\C=C\C(CC)CC Amb22730434 [1,1,0,0,0,0|1,0,1]=4 4690 B7R0.12 NCC(CCO)CO Amb24658240 [1,1,0,0,0,0|1,0,1]=4 4691 B7R0.12 O=CCC(CF)CF Amb24518773 [1,1,0,0,0,0|1,0,0]=3 4692 B7R0.12 OCC(CC=O)CO Amb24483029 [1,1,0,0,0,0|1,0,0]=3 4693 B7R0.12 OCC(CCl)OC=O Amb24425487 [1,1,0,0,0,0|2,0,0]=4 4694 B7R0.12 OCCC(CC)CC Amb17593204 [1,1,0,0,0,0|0,0,1]=3 4695 B7R0.12 OCCN(CC)CC Amb10807428 [1,1,0,0,0,0|1,0,1]=4 4696 B7R0.12 OC[C@H](CS)NC=O Amb24674158 [1,1,0,0,0,0|2,0,0]=4 4697 B7R0.9 CC(=C)CC(C)(C)O Amb22052674 [1,1,0,0,0,0|2,0,0]=4 4698 B7R0.9 CC(=O)CC(C)(C)F Amb25758912 [1,1,0,0,0,0|1,0,0]=3 4699 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [1,1,0,0,0,0|2,0,0]=4 4700 B7R0.9 CC(=O)CC(C)(S)S Amb25767704 [1,1,0,0,0,0|2,0,0]=4 4701 B7R0.9 CC(=O)CC(S)(C)C Amb17593394 [1,1,0,0,0,0|1,0,0]=3 4702 B7R0.9 CC(=O)CP(C)(C)=O Amb25370726 [1,1,0,0,0,0|2,0,0]=4 4703 B7R0.9 CC(=O)C[Si](C)(C)C Amb24411725 [1,1,0,0,0,0|1,1,0]=4 4704 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [1,1,0,0,0,0|2,0,0]=4 4705 B7R0.9 CC(C)(C)CC(N)=N Amb25336905 [1,1,0,0,0,0|2,0,0]=4 4706 B7R0.9 CC(C)(C)CS(O)=O Amb24614665 [1,1,0,0,0,0|1,0,0]=3 4707 B7R0.9 CC(C)(C)NC(=O)Cl Amb25770497 [1,1,0,0,0,0|2,0,0]=4 4708 B7R0.9 CC(C)(C)NC(=O)F Amb25350572 [1,1,0,0,0,0|2,0,0]=4 4709 B7R0.9 CC(C)(C)OC(=O)F Amb25241785 [1,1,0,0,0,0|2,0,0]=4 4710 B7R0.9 CC(C)(C)OC([O-])=O Amb22731240 [1,1,0,0,0,0|1,0,1]=4 4711 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [1,1,0,0,0,0|2,0,0]=4 4712 B7R0.9 CC(C)(C)SC(N)=O Amb25365837 [1,1,0,0,0,0|2,0,0]=4 4713 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [1,1,0,0,0,0|1,0,0]=3 4714 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [1,1,0,0,0,0|1,0,0]=3 4715 B7R0.9 CC(C)(N)CC(O)=O Amb19267108 [1,1,0,0,0,0|0,0,0]=2 4716 B7R0.9 CC(C)(O)CC(N)=S Amb24711517 [1,1,0,0,0,0|1,1,0]=4 4717 B7R0.9 CC(C)(O)CC(O)O Amb25115429 [1,1,0,0,0,0|0,0,2]=4 4718 B7R0.9 CC(C)(O)CC([O-])=O Amb17678748 [1,1,0,0,0,0|0,0,1]=3 4719 B7R0.9 CC(C)(O)CC([O-])=O Amb22729769 [1,1,0,0,0,0|0,0,1]=3 4720 B7R0.9 CC(C)CS(=O)(=O)Br Amb23555503 [1,1,0,0,0,0|1,0,1]=4 4721 B7R0.9 CC(C)CS(=O)(=O)F Amb19893332 [1,1,0,0,0,0|1,0,1]=4 4722 B7R0.9 CC(C)CS(C)(=O)=O Amb25106217 [1,1,0,0,0,0|1,0,1]=4 4723 B7R0.9 CC(C)CS([O-])(=O)=O Amb24423773 [1,1,0,0,0,0|1,0,1]=4 4724 B7R0.9 CC(C)OP(O)(O)=O Amb22493772 [1,1,0,0,0,0|2,0,0]=4 4725 B7R0.9 CC(CS(=O)(=O)N)C Amb13951979 [1,1,0,0,0,0|1,0,1]=4 4726 B7R0.9 CC(CS(=O)(=O)O)O Amb17593541 [1,1,0,0,0,0|2,0,0]=4 4727 B7R0.9 CC(Cl)CP(O)(O)=O Amb25169519 [1,1,0,0,0,0|2,0,0]=4 4728 B7R0.9 CC(N)CP(C)(O)=O Amb24482995 [1,1,0,0,0,0|2,0,0]=4 4729 B7R0.9 CC(O)CC(C)(C)Br Amb25842064 [1,1,0,0,0,0|1,0,1]=4 4730 B7R0.9 CC(O)CC(C)(C)C Amb22337936 [1,1,0,0,0,0|1,0,1]=4 4731 B7R0.9 CC(O)CC(C)(C)Cl Amb25234407 [1,1,0,0,0,0|1,0,1]=4 4732 B7R0.9 CC(O)CC(C)(C)S Amb22047633 [1,1,0,0,0,0|1,0,1]=4 4733 B7R0.9 CC(OP(=O)(O)C)C Amb10842159 [1,1,0,0,0,0|2,0,0]=4 4734 B7R0.9 CC(S)CS(O)(=O)=O Amb24543740 [1,1,0,0,0,0|2,0,0]=4 4735 B7R0.9 CN(C)(C)CC(O)=O Amb22343422 [1,1,0,0,0,0|1,0,0]=3 4736 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [1,1,0,0,0,0|1,0,0]=3 4737 B7R0.9 CS(C)(Br)CC(O)=O Amb25829058 [1,1,0,0,0,0|1,0,0]=3 4738 B7R0.9 C[As+](C)(C)CC([O-])=O Amb22347917 [1,1,0,0,0,0|1,0,1]=4 4739 B7R0.9 C[C@@H](N)CP(C)(O)=O Amb24460368 [1,1,0,0,0,0|2,0,0]=4 4740 B7R0.9 C[C@@H](N)CP(O)(O)=O Amb25338674 [1,1,0,0,0,0|2,0,0]=4 4741 B7R0.9 C[C@@H](N)CS(O)(=O)=O Amb24670475 [1,1,0,0,0,0|2,0,0]=4 4742 B7R0.9 C[C@@H](O)CC(C)(C)C Amb24544035 [1,1,0,0,0,0|1,0,1]=4 4743 B7R0.9 C[C@@H](O)CC(C)(C)S Amb25333750 [1,1,0,0,0,0|1,0,1]=4 4744 B7R0.9 C[C@@H](O)CP(O)(O)=O Amb24334038 [1,1,0,0,0,0|2,0,0]=4 4745 B7R0.9 C[C@H](CC(O)(C)C)O Amb10606102 [1,1,0,0,0,0|1,0,1]=4 4746 B7R0.9 C[C@H](N)CS(O)(=O)=O Amb25760668 [1,1,0,0,0,0|2,0,0]=4 4747 B7R0.9 C[C@H](O)CC(C)(C)C Amb24672407 [1,1,0,0,0,0|1,0,1]=4 4748 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [1,1,0,0,0,0|1,0,1]=4 4749 B7R0.9 C[C@H](O)CC(C)(C)S Amb24457778 [1,1,0,0,0,0|1,0,1]=4 4750 B7R0.9 C[C@H](O)CP(O)(O)=O Amb25715996 [1,1,0,0,0,0|2,0,0]=4 4751 B7R0.9 C[N+](C)(C)CC(O)=O Amb22734051 [1,1,0,0,0,0|1,0,0]=3 4752 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22002454 [1,1,0,0,0,0|1,0,1]=4 4753 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22167465 [1,1,0,0,0,0|1,0,1]=4 4754 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22584414 [1,1,0,0,0,0|1,0,1]=4 4755 B7R0.9 C[N+](C)(N)CC(N)=O Amb25361686 [1,1,0,0,0,0|2,0,0]=4 4756 B7R0.9 C[P+](C)(C)CC(O)=O Amb24753800 [1,1,0,0,0,0|1,0,0]=3 4757 B7R0.9 C[Si](C)(C)CC(N)=O Amb24574114 [1,1,0,0,0,0|1,1,0]=4 4758 B7R0.9 C[Si](C)(C)CC(O)=O Amb19894126 [1,1,0,0,0,0|0,1,0]=3 4759 B7R0.9 NC(=O)OC(C)(C)C Amb2236390 [1,1,0,0,0,0|2,0,0]=4 4760 B7R0.9 OB(CC(C)(C)C)O Amb13890355 [1,1,0,0,0,0|1,0,1]=4 4761 B7R0.9 OC(=O)CC(F)(F)Br Amb24373833 [1,1,0,0,0,0|2,0,0]=4 4762 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [1,1,0,0,0,0|0,0,0]=2 4763 B7R0.9 OC(=O)C[As+](C)(C)C Amb17608518 [1,1,0,0,0,0|1,0,0]=3 4764 B7R0.9 [2H]C([2H])([2H])CC(O)=O Amb22338080 [1,1,0,0,0,0|2,0,0]=4 4765 B7R0.9 [O-]C(=O)C[N+](C)(C)C Amb10843741 [1,1,0,0,0,0|1,0,1]=4 4766 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [1,1,0,0,0,0|1,0,0]=3 4767 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [1,1,0,0,0,0|0,0,2]=4 4768 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [1,1,0,0,0,0|0,0,2]=4 4769 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [1,1,0,0,0,0|0,0,2]=4 4770 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [1,1,0,0,0,0|0,0,2]=4 4771 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [1,1,0,0,0,0|0,0,2]=4 4772 B7R0.16 CC(=O)C(=C)C(C)C Amb25713676 [1,1,0,0,0,0|1,0,1]=4 4773 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [1,1,0,0,0,0|1,0,1]=4 4774 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [1,1,0,0,0,0|1,0,1]=4 4775 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [1,1,0,0,0,0|1,0,0]=3 4776 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [1,1,0,0,0,0|0,0,1]=3 4777 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [1,1,0,0,0,0|1,0,1]=4 4778 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [1,1,0,0,0,0|0,0,0]=2 4779 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [1,1,0,0,0,0|1,0,0]=3 4780 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [1,1,0,0,0,0|2,0,0]=4 4781 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [1,1,0,0,0,0|1,0,0]=3 4782 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [1,1,0,0,0,0|1,0,0]=3 4783 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [1,1,0,0,0,0|1,0,0]=3 4784 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [1,1,0,0,0,0|1,0,0]=3 4785 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [1,1,0,0,0,0|1,0,0]=3 4786 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [1,1,0,0,0,0|1,0,0]=3 4787 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [1,1,0,0,0,0|2,0,0]=4 4788 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [1,1,0,0,0,0|2,0,0]=4 4789 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [1,1,0,0,0,0|1,0,0]=3 4790 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [1,1,0,0,0,0|2,0,0]=4 4791 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [1,1,0,0,0,0|1,0,0]=3 4792 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [1,1,0,0,0,0|2,0,0]=4 4793 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [1,1,0,0,0,0|2,0,0]=4 4794 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [1,1,0,0,0,0|1,0,0]=3 4795 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [1,1,0,0,0,0|2,0,0]=4 4796 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [1,1,0,0,0,0|2,0,0]=4 4797 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [1,1,0,0,0,0|2,0,0]=4 4798 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [1,1,0,0,0,0|0,0,2]=4 4799 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [1,1,0,0,0,0|0,0,2]=4 4800 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [1,1,0,0,0,0|0,0,2]=4 4801 B7R0.16 CC(C)C(=C)C(N)=O Amb24709685 [1,1,0,0,0,0|1,0,1]=4 4802 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [1,1,0,0,0,0|0,0,1]=3 4803 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [1,1,0,0,0,0|1,0,0]=3 4804 B7R0.16 CC(C)C(Br)C(N)=S Amb24524277 [1,1,0,0,0,0|1,1,0]=4 4805 B7R0.16 CC(C)C(C)C(C)=C Amb24649761 [1,1,0,0,0,0|2,0,0]=4 4806 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [1,1,0,0,0,0|1,0,0]=3 4807 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [1,1,0,0,0,0|1,0,1]=4 4808 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [1,1,0,0,0,0|1,0,0]=3 4809 B7R0.16 CC(C)C(C)S(C)=O Amb24528110 [1,1,0,0,0,0|2,0,0]=4 4810 B7R0.16 CC(C)C(C)S([O-])=O Amb25685559 [1,1,0,0,0,0|1,0,1]=4 4811 B7R0.16 CC(C)C(Cl)C(=C)Cl Amb25360075 [1,1,0,0,0,0|2,0,0]=4 4812 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [1,1,0,0,0,0|1,0,0]=3 4813 B7R0.16 CC(C)C(Cl)C(C)=C Amb24483132 [1,1,0,0,0,0|2,0,0]=4 4814 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [1,1,0,0,0,0|1,0,0]=3 4815 B7R0.16 CC(C)C(Cl)C(C)O Amb25124794 [1,1,0,0,0,0|1,0,1]=4 4816 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [1,1,0,0,0,0|1,0,0]=3 4817 B7R0.16 CC(C)C(Cl)S(C)=O Amb24482117 [1,1,0,0,0,0|2,0,0]=4 4818 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [1,1,0,0,0,0|1,0,0]=3 4819 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [1,1,0,0,0,0|1,0,0]=3 4820 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [1,1,0,0,0,0|0,0,0]=2 4821 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [1,1,0,0,0,0|1,0,1]=4 4822 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [1,1,0,0,0,0|0,1,0]=3 4823 B7R0.16 CC(C)C(N)C(C)=C Amb18641748 [1,1,0,0,0,0|2,0,0]=4 4824 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [1,1,0,0,0,0|1,0,0]=3 4825 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [1,1,0,0,0,0|1,0,1]=4 4826 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [1,1,0,0,0,0|1,0,0]=3 4827 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [1,1,0,0,0,0|1,1,0]=4 4828 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [1,1,0,0,0,0|0,0,0]=2 4829 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [1,1,0,0,0,0|1,0,0]=3 4830 B7R0.16 CC(C)C(O)C(N)=N Amb24447862 [1,1,0,0,0,0|2,0,0]=4 4831 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [1,1,0,0,0,0|1,0,0]=3 4832 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [1,1,0,0,0,0|1,0,0]=3 4833 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [1,1,0,0,0,0|0,0,0]=2 4834 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [1,1,0,0,0,0|0,0,0]=2 4835 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [1,1,0,0,0,0|2,0,0]=4 4836 B7R0.16 CC(C)N(N)C(N)=O Amb24679360 [1,1,0,0,0,0|2,0,0]=4 4837 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [1,1,0,0,0,0|2,0,0]=4 4838 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [1,1,0,0,0,0|0,0,0]=2 4839 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [1,1,0,0,0,0|1,0,0]=3 4840 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [1,1,0,0,0,0|1,0,0]=3 4841 B7R0.16 CC(C)[C@@H](Cl)B(O)O Amb25109627 [1,1,0,0,0,0|1,0,1]=4 4842 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [1,1,0,0,0,0|0,0,0]=2 4843 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [1,1,0,0,0,0|0,0,0]=2 4844 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [1,1,0,0,0,0|1,0,0]=3 4845 B7R0.16 CC(C)[C@@H](N)C(C)O Amb24575417 [1,1,0,0,0,0|1,0,1]=4 4846 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [1,1,0,0,0,0|1,0,0]=3 4847 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [1,1,0,0,0,0|1,0,0]=3 4848 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [1,1,0,0,0,0|0,0,0]=2 4849 B7R0.16 CC(C)[C@@H](N)[C@@H](C)O Amb24540375 [1,1,0,0,0,0|1,0,1]=4 4850 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [1,1,0,0,0,0|1,0,0]=3 4851 B7R0.16 CC(C)[C@@H](O)[C@H](C)O Amb24332475 [1,1,0,0,0,0|1,0,1]=4 4852 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [1,1,0,0,0,0|0,0,0]=2 4853 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [1,1,0,0,0,0|1,0,0]=3 4854 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [1,1,0,0,0,0|0,1,0]=3 4855 B7R0.16 CC(C)[C@H](N)C(N)=S Amb24714667 [1,1,0,0,0,0|1,1,0]=4 4856 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [1,1,0,0,0,0|0,0,0]=2 4857 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [1,1,0,0,0,0|0,0,0]=2 4858 B7R0.16 CC(C)[C@H](N)[C@@H](C)O Amb24611787 [1,1,0,0,0,0|1,0,1]=4 4859 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [1,1,0,0,0,0|1,0,0]=3 4860 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [1,1,0,0,0,0|1,0,0]=3 4861 B7R0.16 CC(C)[C@H](O)[C@@H](C)O Amb24591386 [1,1,0,0,0,0|1,0,1]=4 4862 B7R0.16 CC(C)[C@H](O)[C@H](C)O Amb25043671 [1,1,0,0,0,0|1,0,1]=4 4863 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [1,1,0,0,0,0|0,0,0]=2 4864 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [1,1,0,0,0,0|1,0,1]=4 4865 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [1,1,0,0,0,0|2,0,0]=4 4866 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [1,1,0,0,0,0|2,0,0]=4 4867 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [1,1,0,0,0,0|2,0,0]=4 4868 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [1,1,0,0,0,0|1,0,0]=3 4869 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [1,1,0,0,0,0|1,0,0]=3 4870 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [1,1,0,0,0,0|1,0,0]=3 4871 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [1,1,0,0,0,0|1,0,0]=3 4872 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [1,1,0,0,0,0|1,0,0]=3 4873 B7R0.16 CC(N(C(=O)N)C)C Amb1132046 [1,1,0,0,0,0|2,0,0]=4 4874 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [1,1,0,0,0,0|1,0,0]=3 4875 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [1,1,0,0,0,0|1,0,0]=3 4876 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [1,1,0,0,0,0|1,0,0]=3 4877 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [1,1,0,0,0,0|1,0,0]=3 4878 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [1,1,0,0,0,0|1,0,1]=4 4879 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [1,1,0,0,0,0|2,0,0]=4 4880 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [1,1,0,0,0,0|2,0,0]=4 4881 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [1,1,0,0,0,0|2,0,0]=4 4882 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [1,1,0,0,0,0|1,0,0]=3 4883 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [1,1,0,0,0,0|2,0,0]=4 4884 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [1,1,0,0,0,0|1,0,0]=3 4885 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [1,1,0,0,0,0|2,0,0]=4 4886 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [1,1,0,0,0,0|1,0,0]=3 4887 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [1,1,0,0,0,0|1,0,0]=3 4888 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [1,1,0,0,0,0|1,0,0]=3 4889 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [1,1,0,0,0,0|1,0,1]=4 4890 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [1,1,0,0,0,0|1,0,1]=4 4891 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [1,1,0,0,0,0|1,0,0]=3 4892 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [1,1,0,0,0,0|0,0,0]=2 4893 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [1,1,0,0,0,0|2,0,0]=4 4894 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [1,1,0,0,0,0|1,0,0]=3 4895 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [1,1,0,0,0,0|2,0,0]=4 4896 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [1,1,0,0,0,0|1,0,0]=3 4897 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [1,1,0,0,0,0|1,0,0]=3 4898 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [1,1,0,0,0,0|1,0,0]=3 4899 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [1,1,0,0,0,0|1,0,0]=3 4900 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [1,1,0,0,0,0|1,0,0]=3 4901 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [1,1,0,0,0,0|1,0,0]=3 4902 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [1,1,0,0,0,0|1,0,0]=3 4903 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [1,1,0,0,0,0|1,0,0]=3 4904 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [1,1,0,0,0,0|1,0,0]=3 4905 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [1,1,0,0,0,0|2,0,0]=4 4906 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [1,1,0,0,0,0|2,0,0]=4 4907 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [1,1,0,0,0,0|1,0,0]=3 4908 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [1,1,0,0,0,0|2,0,0]=4 4909 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [1,1,0,0,0,0|1,0,0]=3 4910 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [1,1,0,0,0,0|2,0,0]=4 4911 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [1,1,0,0,0,0|1,0,0]=3 4912 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [1,1,0,0,0,0|1,0,0]=3 4913 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [1,1,0,0,0,0|1,0,0]=3 4914 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [1,1,0,0,0,0|1,0,0]=3 4915 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [1,1,0,0,0,0|1,0,0]=3 4916 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [1,1,0,0,0,0|1,0,0]=3 4917 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [1,1,0,0,0,0|1,0,0]=3 4918 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [1,1,0,0,0,0|0,0,0]=2 4919 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [1,1,0,0,0,0|2,0,0]=4 4920 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [1,1,0,0,0,0|1,0,0]=3 4921 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [1,1,0,0,0,0|1,0,0]=3 4922 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [1,1,0,0,0,0|1,0,1]=4 4923 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [1,1,0,0,0,0|2,0,0]=4 4924 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [1,1,0,0,0,0|1,0,0]=3 4925 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [1,1,0,0,0,0|2,0,0]=4 4926 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [1,1,0,0,0,0|1,0,0]=3 4927 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [1,1,0,0,0,0|1,0,0]=3 4928 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [1,1,0,0,0,0|2,0,0]=4 4929 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [1,1,0,0,0,0|1,0,0]=3 4930 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [1,1,0,0,0,0|1,0,0]=3 4931 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [1,1,0,0,0,0|1,0,0]=3 4932 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [1,1,0,0,0,0|1,0,0]=3 4933 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [1,1,0,0,0,0|1,0,0]=3 4934 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [1,1,0,0,0,0|2,0,0]=4 4935 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [1,1,0,0,0,0|1,0,0]=3 4936 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [1,1,0,0,0,0|2,0,0]=4 4937 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [1,1,0,0,0,0|1,0,0]=3 4938 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [1,1,0,0,0,0|2,0,0]=4 4939 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [1,1,0,0,0,0|1,0,0]=3 4940 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [1,1,0,0,0,0|2,0,0]=4 4941 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [1,1,0,0,0,0|1,0,0]=3 4942 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [1,1,0,0,0,0|1,0,0]=3 4943 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [1,1,0,0,0,0|0,0,0]=2 4944 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [1,1,0,0,0,0|2,0,0]=4 4945 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [1,1,0,0,0,0|2,0,0]=4 4946 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [1,1,0,0,0,0|2,0,0]=4 4947 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [1,1,0,0,0,0|2,0,0]=4 4948 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [1,1,0,0,0,0|2,0,0]=4 4949 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [1,1,0,0,0,0|1,0,0]=3 4950 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [1,1,0,0,0,0|1,0,0]=3 4951 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [1,1,0,0,0,0|2,0,0]=4 4952 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [1,1,0,0,0,0|2,0,0]=4 4953 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [1,1,0,0,0,0|0,0,0]=2 4954 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [1,1,0,0,0,0|2,0,0]=4 4955 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [1,1,0,0,0,0|0,0,0]=2 4956 B7R0.16 [13CH3]C([13CH3])C(=O)C([O-])=O Amb22353581 [1,1,0,0,0,0|0,0,2]=4 4957 B7R0.16 [13CH3]C([13CH3])[13C](=O)[13C]([O-])=O Amb22338387 [1,1,0,0,0,0|0,0,2]=4 4958 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [1,1,0,0,0,0|1,0,0]=3 4959 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [1,1,0,0,0,0|0,0,0]=2 4960 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [1,1,0,0,0,0|1,0,0]=3 4961 B7R0.4 BrCCCCC(=O)C Amb16234126 [1,1,0,0,0,0|1,0,0]=3 4962 B7R0.4 C#CCSCC(=O)O Amb2372297 [1,1,0,0,0,0|0,0,2]=4 4963 B7R0.4 C=C(Br)CCCCCl Amb24703183 [1,1,0,0,0,0|2,0,0]=4 4964 B7R0.4 C=C(Br)CCCCO Amb25381428 [1,1,0,0,0,0|2,0,0]=4 4965 B7R0.4 C=C(Cl)CCCCO Amb25064782 [1,1,0,0,0,0|2,0,0]=4 4966 B7R0.4 C=C(F)CCCCBr Amb24635488 [1,1,0,0,0,0|2,0,0]=4 4967 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|2,0,0]=4 4968 B7R0.4 C=CCCCC(=O)C Amb17593171 [1,1,0,0,0,0|1,0,1]=4 4969 B7R0.4 C=CCCCC(N)=O Amb24579642 [1,1,0,0,0,0|1,0,1]=4 4970 B7R0.4 C=CCSCC(=O)O Amb1110888 [1,1,0,0,0,0|0,0,2]=4 4971 B7R0.4 CC#CCCC(C)=O Amb24471185 [1,1,0,0,0,0|1,0,1]=4 4972 B7R0.4 CC(=C)CCCCBr Amb25129478 [1,1,0,0,0,0|2,0,0]=4 4973 B7R0.4 CC(=C)CCCCCl Amb24481468 [1,1,0,0,0,0|2,0,0]=4 4974 B7R0.4 CC(=C)CCCCN Amb25142976 [1,1,0,0,0,0|2,0,0]=4 4975 B7R0.4 CC(=N)CCCCN Amb25076530 [1,1,0,0,0,0|2,0,0]=4 4976 B7R0.4 CC(=O)CCCC#C Amb18115312 [1,1,0,0,0,0|1,0,1]=4 4977 B7R0.4 CC(=O)CCCC=O Amb18641775 [1,1,0,0,0,0|1,0,1]=4 4978 B7R0.4 CC(=O)CNCCO Amb18108527 [1,1,0,0,0,0|2,0,0]=4 4979 B7R0.4 CC(=O)CNCCS Amb25328157 [1,1,0,0,0,0|2,0,0]=4 4980 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|2,0,0]=4 4981 B7R0.4 CC(=O)COCCN Amb18630459 [1,1,0,0,0,0|2,0,0]=4 4982 B7R0.4 CC(=O)CSCCCl Amb25110707 [1,1,0,0,0,0|2,0,0]=4 4983 B7R0.4 CC(=O)CSCCF Amb24621173 [1,1,0,0,0,0|2,0,0]=4 4984 B7R0.4 CC(=O)NCCCF Amb25048794 [1,1,0,0,0,0|2,0,0]=4 4985 B7R0.4 CC(=O)NCCCI Amb24733809 [1,1,0,0,0,0|2,0,0]=4 4986 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|2,0,0]=4 4987 B7R0.4 CC(=O)OCCCF Amb22008199 [1,1,0,0,0,0|2,0,0]=4 4988 B7R0.4 CC(=O)OCCCI Amb24532815 [1,1,0,0,0,0|2,0,0]=4 4989 B7R0.4 CC(=O)OCCCN Amb18641920 [1,1,0,0,0,0|2,0,0]=4 4990 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|2,0,0]=4 4991 B7R0.4 CC(=O)SCCCBr Amb17610077 [1,1,0,0,0,0|2,0,0]=4 4992 B7R0.4 CC(=O)SCCCF Amb25240055 [1,1,0,0,0,0|2,0,0]=4 4993 B7R0.4 CC(=O)SCCCN Amb25368304 [1,1,0,0,0,0|2,0,0]=4 4994 B7R0.4 CC(O)CCCCBr Amb24552945 [1,1,0,0,0,0|1,0,1]=4 4995 B7R0.4 CC(O)CCCCCl Amb24462574 [1,1,0,0,0,0|1,0,1]=4 4996 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|1,0,1]=4 4997 B7R0.4 CC=C=CCC(O)=O Amb25118481 [1,1,0,0,0,0|0,0,2]=4 4998 B7R0.4 CCCC#CC(=O)Cl Amb25250583 [1,1,0,0,0,0|1,0,1]=4 4999 B7R0.4 CCCC=NC(N)=O Amb24411468 [1,1,0,0,0,0|1,0,1]=4 5000 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|2,0,0]=4 5001 B7R0.4 CCCCC=C(F)F Amb10840485 [1,1,0,0,0,0|2,0,0]=4 5002 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,1]=4 5003 B7R0.4 CCCCCC(N)=N Amb19890171 [1,1,0,0,0,0|2,0,0]=4 5004 B7R0.4 CCCCCC(N)O Amb24673933 [1,1,0,0,0,0|1,0,1]=4 5005 B7R0.4 CCCCCC([O-])=O Amb22337624 [1,1,0,0,0,0|0,0,1]=3 5006 B7R0.4 CCCCCC([O-])=O Amb22525161 [1,1,0,0,0,0|0,0,1]=3 5007 B7R0.4 CCCCCC([O-])=O Amb22730527 [1,1,0,0,0,0|0,0,1]=3 5008 B7R0.4 CCCCCC([O-])=O Amb22731343 [1,1,0,0,0,0|0,0,1]=3 5009 B7R0.4 CCCCC[13C](O)=O Amb22353417 [1,1,0,0,0,0|0,0,0]=2 5010 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|1,0,1]=4 5011 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [1,1,0,0,0,0|1,0,1]=4 5012 B7R0.4 CCCCNC(=N)N Amb16206158 [1,1,0,0,0,0|2,0,0]=4 5013 B7R0.4 CCCCNC(=O)Cl Amb24574309 [1,1,0,0,0,0|1,0,0]=3 5014 B7R0.4 CCCCNC(=S)N Amb1152044 [1,1,0,0,0,0|1,1,0]=4 5015 B7R0.4 CCCCNC(C)=C Amb25291695 [1,1,0,0,0,0|2,0,0]=4 5016 B7R0.4 CCCCNC(C)O Amb24715795 [1,1,0,0,0,0|1,0,1]=4 5017 B7R0.4 CCCCNC(N)=N Amb19748357 [1,1,0,0,0,0|2,0,0]=4 5018 B7R0.4 CCCCOB(O)O Amb25687500 [1,1,0,0,0,0|1,0,1]=4 5019 B7R0.4 CCCCOC(=O)F Amb24710483 [1,1,0,0,0,0|1,0,0]=3 5020 B7R0.4 CCCCOC(C)=S Amb22230357 [1,1,0,0,0,0|1,1,0]=4 5021 B7R0.4 CCCCOC(N)=N Amb24579254 [1,1,0,0,0,0|2,0,0]=4 5022 B7R0.4 CCCCOC(N)=S Amb24761515 [1,1,0,0,0,0|1,1,0]=4 5023 B7R0.4 CCCCSC(=N)N Amb10552525 [1,1,0,0,0,0|2,0,0]=4 5024 B7R0.4 CCCCSC(=O)C Amb10552685 [1,1,0,0,0,0|1,0,0]=3 5025 B7R0.4 CCCCSC(=O)Cl Amb22352826 [1,1,0,0,0,0|1,0,0]=3 5026 B7R0.4 CCCCSC(N)=O Amb24533653 [1,1,0,0,0,0|1,0,0]=3 5027 B7R0.4 CCCCSC([O-])=S Amb25359489 [1,1,0,0,0,0|0,1,1]=4 5028 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [1,1,0,0,0,0|0,0,0]=2 5029 B7R0.4 CCCNCC(=C)Br Amb18303968 [1,1,0,0,0,0|2,0,0]=4 5030 B7R0.4 CCCNCC(=C)C Amb17308631 [1,1,0,0,0,0|2,0,0]=4 5031 B7R0.4 CCCNCC(=C)Cl Amb19004838 [1,1,0,0,0,0|2,0,0]=4 5032 B7R0.4 CCCNCC(=O)N Amb1124632 [1,1,0,0,0,0|1,0,0]=3 5033 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,0]=2 5034 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,0]=2 5035 B7R0.4 CCCNCC(=S)N Amb17231883 [1,1,0,0,0,0|1,1,0]=4 5036 B7R0.4 CCCNCC(C)O Amb22292467 [1,1,0,0,0,0|1,0,1]=4 5037 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [1,1,0,0,0,0|1,0,1]=4 5038 B7R0.4 CCCNC[C@H](C)O Amb24473274 [1,1,0,0,0,0|1,0,1]=4 5039 B7R0.4 CCCOC[C@H](C)O Amb24575974 [1,1,0,0,0,0|1,0,1]=4 5040 B7R0.4 CCCSCC(=C)Br Amb25206483 [1,1,0,0,0,0|2,0,0]=4 5041 B7R0.4 CCCSCC(=C)Cl Amb24476596 [1,1,0,0,0,0|2,0,0]=4 5042 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,0,0]=2 5043 B7R0.4 CCCSC[C@H](C)O Amb24526704 [1,1,0,0,0,0|1,0,1]=4 5044 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [1,1,0,0,0,0|1,0,1]=4 5045 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [1,1,0,0,0,0|1,0,1]=4 5046 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|1,0,1]=4 5047 B7R0.4 CCNCCC(=S)N Amb17231882 [1,1,0,0,0,0|1,1,0]=4 5048 B7R0.4 CCNCCC(C)=C Amb18312576 [1,1,0,0,0,0|2,0,0]=4 5049 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,0]=3 5050 B7R0.4 CCNCCC(N)=N Amb25112934 [1,1,0,0,0,0|2,0,0]=4 5051 B7R0.4 CCNCC[C@H](C)O Amb25757479 [1,1,0,0,0,0|1,0,1]=4 5052 B7R0.4 CCNCNC(C)=O Amb25809446 [1,1,0,0,0,0|2,0,0]=4 5053 B7R0.4 CCNOCC(N)=O Amb24505259 [1,1,0,0,0,0|2,0,0]=4 5054 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,0]=3 5055 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 5056 B7R0.4 CCOCCS(C)=O Amb25206909 [1,1,0,0,0,0|2,0,0]=4 5057 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [1,1,0,0,0,0|1,0,1]=4 5058 B7R0.4 CCOCNC(C)=O Amb24334070 [1,1,0,0,0,0|2,0,0]=4 5059 B7R0.4 CCOCNC(N)=O Amb25765493 [1,1,0,0,0,0|2,0,0]=4 5060 B7R0.4 CCOCOC(C)=O Amb25191864 [1,1,0,0,0,0|2,0,0]=4 5061 B7R0.4 CCONCC(N)=O Amb25745510 [1,1,0,0,0,0|2,0,0]=4 5062 B7R0.4 CCSC#CC(O)=O Amb25793529 [1,1,0,0,0,0|0,0,2]=4 5063 B7R0.4 CCSCCC(=S)N Amb17307560 [1,1,0,0,0,0|1,1,0]=4 5064 B7R0.4 CCSCCC(C)=C Amb25236682 [1,1,0,0,0,0|2,0,0]=4 5065 B7R0.4 CCSSCC(O)=O Amb25233433 [1,1,0,0,0,0|1,0,0]=3 5066 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [1,1,0,0,0,0|0,0,2]=4 5067 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [1,1,0,0,0,0|0,0,2]=4 5068 B7R0.4 CC\C=C\CC(N)=O Amb24595892 [1,1,0,0,0,0|1,0,1]=4 5069 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|0,0,0]=2 5070 B7R0.4 CNCCCC(C)=C Amb25742210 [1,1,0,0,0,0|2,0,0]=4 5071 B7R0.4 CNCCCC(N)=O Amb18303611 [1,1,0,0,0,0|1,0,0]=3 5072 B7R0.4 CNCCCC(O)C Amb17569899 [1,1,0,0,0,0|1,0,1]=4 5073 B7R0.4 CNCCCS(O)=O Amb24656214 [1,1,0,0,0,0|1,0,0]=3 5074 B7R0.4 CNCCNC(N)=O Amb18299975 [1,1,0,0,0,0|2,0,0]=4 5075 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|2,0,0]=4 5076 B7R0.4 CNCCOC(N)=O Amb25136928 [1,1,0,0,0,0|2,0,0]=4 5077 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [1,1,0,0,0,0|0,0,2]=4 5078 B7R0.4 COCCCC(=O)Cl Amb24481572 [1,1,0,0,0,0|1,0,0]=3 5079 B7R0.4 COCCCC(N)=N Amb19269156 [1,1,0,0,0,0|2,0,0]=4 5080 B7R0.4 COCCCC(N)=O Amb24670109 [1,1,0,0,0,0|1,0,0]=3 5081 B7R0.4 COCCNC(=O)N Amb1104938 [1,1,0,0,0,0|2,0,0]=4 5082 B7R0.4 COCCOC(N)=O Amb25054225 [1,1,0,0,0,0|2,0,0]=4 5083 B7R0.4 COCSCC(C)=O Amb24717297 [1,1,0,0,0,0|2,0,0]=4 5084 B7R0.4 COC\C=C\C(O)=O Amb18296423 [1,1,0,0,0,0|0,0,2]=4 5085 B7R0.4 CONCCC(C)=O Amb25342369 [1,1,0,0,0,0|2,0,0]=4 5086 B7R0.4 CONCCC(N)=O Amb24481431 [1,1,0,0,0,0|2,0,0]=4 5087 B7R0.4 CONCCC(O)=O Amb24441275 [1,1,0,0,0,0|1,0,0]=3 5088 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [1,1,0,0,0,0|0,0,2]=4 5089 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|0,0,0]=2 5090 B7R0.4 CSCCCC(C)=O Amb25122381 [1,1,0,0,0,0|1,0,0]=3 5091 B7R0.4 CSCCCC(N)=O Amb19129736 [1,1,0,0,0,0|1,0,0]=3 5092 B7R0.4 CSCCOC(=O)Cl Amb25857013 [1,1,0,0,0,0|2,0,0]=4 5093 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [1,1,0,0,0,0|0,0,2]=4 5094 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [1,1,0,0,0,0|1,0,1]=4 5095 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [1,1,0,0,0,0|1,0,1]=4 5096 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [1,1,0,0,0,0|0,0,0]=2 5097 B7R0.4 C\C=C/CCC(C)=O Amb24333832 [1,1,0,0,0,0|1,0,1]=4 5098 B7R0.4 C\C=C\CCC(=O)Cl Amb25246754 [1,1,0,0,0,0|1,0,1]=4 5099 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [1,1,0,0,0,0|0,0,1]=3 5100 B7R0.4 C\C=C\CCC(N)=O Amb25343167 [1,1,0,0,0,0|1,0,1]=4 5101 B7R0.4 ClCCCOC(=O)Cl Amb10844795 [1,1,0,0,0,0|2,0,0]=4 5102 B7R0.4 ClCCOCC(=O)Cl Amb17610887 [1,1,0,0,0,0|2,0,0]=4 5103 B7R0.4 N#CCCCC(=O)C Amb17106756 [1,1,0,0,0,0|1,0,1]=4 5104 B7R0.4 N#CCCCC(O)=O Amb18560874 [1,1,0,0,0,0|0,0,1]=3 5105 B7R0.4 N#CSCCC(O)=O Amb24481186 [1,1,0,0,0,0|1,0,1]=4 5106 B7R0.4 NC(=O)CCCC#N Amb25337207 [1,1,0,0,0,0|1,0,1]=4 5107 B7R0.4 NC(=O)CCCCI Amb25788033 [1,1,0,0,0,0|1,0,0]=3 5108 B7R0.4 NC(=O)CNCCF Amb24443361 [1,1,0,0,0,0|2,0,0]=4 5109 B7R0.4 NC(=O)COCCBr Amb25133475 [1,1,0,0,0,0|2,0,0]=4 5110 B7R0.4 NC(=O)CSCCCl Amb25846245 [1,1,0,0,0,0|2,0,0]=4 5111 B7R0.4 NC(=O)OCCCCl Amb24635478 [1,1,0,0,0,0|2,0,0]=4 5112 B7R0.4 NC(=O)SCCCCl Amb24481372 [1,1,0,0,0,0|2,0,0]=4 5113 B7R0.4 NC(=S)CCCCCl Amb25177620 [1,1,0,0,0,0|1,1,0]=4 5114 B7R0.4 NC(=S)CCCCF Amb24613464 [1,1,0,0,0,0|1,1,0]=4 5115 B7R0.4 NCCCCC(N)=N Amb25714813 [1,1,0,0,0,0|2,0,0]=4 5116 B7R0.4 NCCCCC(N)=O Amb18641897 [1,1,0,0,0,0|1,0,0]=3 5117 B7R0.4 NCCCCC(N)=S Amb24481404 [1,1,0,0,0,0|1,1,0]=4 5118 B7R0.4 NCCCCC(N)O Amb24333310 [1,1,0,0,0,0|1,0,1]=4 5119 B7R0.4 NCCCCC(O)C Amb17569903 [1,1,0,0,0,0|1,0,1]=4 5120 B7R0.4 NCCCCC([O-])=O Amb22753853 [1,1,0,0,0,0|0,0,1]=3 5121 B7R0.4 NCCCCP(O)=O Amb24520720 [1,1,0,0,0,0|1,0,0]=3 5122 B7R0.4 NCCCCS(=O)C Amb17617794 [1,1,0,0,0,0|2,0,0]=4 5123 B7R0.4 NCCCNC(N)=O Amb18296186 [1,1,0,0,0,0|2,0,0]=4 5124 B7R0.4 NCCCNC(N)=O Amb20622408 [1,1,0,0,0,0|2,0,0]=4 5125 B7R0.4 NCCCNC(O)=O Amb24093884 [1,1,0,0,0,0|1,0,0]=3 5126 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|1,0,0]=3 5127 B7R0.4 NCCNCC(O)=O Amb19958818 [1,1,0,0,0,0|1,0,0]=3 5128 B7R0.4 NCCOCC(N)=O Amb18523830 [1,1,0,0,0,0|2,0,0]=4 5129 B7R0.4 NCCOCC(N)=O Amb20631066 [1,1,0,0,0,0|2,0,0]=4 5130 B7R0.4 NCCOCC(O)=O Amb18630146 [1,1,0,0,0,0|1,0,0]=3 5131 B7R0.4 NCCOCC(O)=O Amb22751540 [1,1,0,0,0,0|1,0,0]=3 5132 B7R0.4 NCCSCC(=O)C Amb17500454 [1,1,0,0,0,0|2,0,0]=4 5133 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,0]=3 5134 B7R0.4 NCCSCC(O)=O Amb20622325 [1,1,0,0,0,0|1,0,0]=3 5135 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [1,1,0,0,0,0|0,0,2]=4 5136 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [1,1,0,0,0,0|0,0,2]=4 5137 B7R0.4 NNCCCC(O)=O Amb24455803 [1,1,0,0,0,0|1,0,0]=3 5138 B7R0.4 NOCCCC(=O)O Amb10975956 [1,1,0,0,0,0|1,0,0]=3 5139 B7R0.4 NOCCCC(O)=O Amb22011795 [1,1,0,0,0,0|1,0,0]=3 5140 B7R0.4 O=C(Cl)OCCCBr Amb25137067 [1,1,0,0,0,0|2,0,0]=4 5141 B7R0.4 O=C(F)CCCCCl Amb24472276 [1,1,0,0,0,0|1,0,0]=3 5142 B7R0.4 O=C(F)OCCCCl Amb25122991 [1,1,0,0,0,0|2,0,0]=4 5143 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|0,0,1]=3 5144 B7R0.4 OB(O)CCCCBr Amb20171450 [1,1,0,0,0,0|1,0,1]=4 5145 B7R0.4 OB(O)CCCCCl Amb25184744 [1,1,0,0,0,0|1,0,1]=4 5146 B7R0.4 OC(=O)CCC=C=C Amb10605299 [1,1,0,0,0,0|0,0,2]=4 5147 B7R0.4 OC(=O)CCN=C=S Amb24562253 [1,1,0,0,0,0|1,0,1]=4 5148 B7R0.4 OC(=O)CCNC=O Amb18290434 [1,1,0,0,0,0|1,0,1]=4 5149 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|0,0,2]=4 5150 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [1,1,0,0,0,0|0,0,2]=4 5151 B7R0.4 OC(=O)CNCCS Amb18124468 [1,1,0,0,0,0|1,0,0]=3 5152 B7R0.4 OC(=O)COCCBr Amb24057760 [1,1,0,0,0,0|1,0,0]=3 5153 B7R0.4 OC(=O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,0]=3 5154 B7R0.4 OC(=O)CSCC=O Amb24628311 [1,1,0,0,0,0|1,0,1]=4 5155 B7R0.4 OC(=O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,0]=3 5156 B7R0.4 OC(=O)CSCCS Amb24711400 [1,1,0,0,0,0|1,0,0]=3 5157 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|0,0,2]=4 5158 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [1,1,0,0,0,0|0,0,2]=4 5159 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [1,1,0,0,0,0|0,0,2]=4 5160 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|0,0,2]=4 5161 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [1,1,0,0,0,0|0,0,2]=4 5162 B7R0.4 OCC#CCC(O)=O Amb24395623 [1,1,0,0,0,0|0,0,2]=4 5163 B7R0.4 OCCC#CC(O)=O Amb25844914 [1,1,0,0,0,0|0,0,2]=4 5164 B7R0.4 OCCCCB(O)O Amb25351122 [1,1,0,0,0,0|1,0,1]=4 5165 B7R0.4 OCCCCC(=O)C Amb10603864 [1,1,0,0,0,0|1,0,0]=3 5166 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [1,1,0,0,0,0|0,0,1]=3 5167 B7R0.4 OCCCCC(O)=O Amb22351244 [1,1,0,0,0,0|0,0,0]=2 5168 B7R0.4 OCCCCC(O)O Amb25204642 [1,1,0,0,0,0|0,0,2]=4 5169 B7R0.4 OCCCC[C@H](O)C Amb10605245 [1,1,0,0,0,0|1,0,1]=4 5170 B7R0.4 OCCSCC(=O)O Amb1110090 [1,1,0,0,0,0|1,0,0]=3 5171 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [1,1,0,0,0,0|0,0,2]=4 5172 B7R0.4 OP(=O)OCCCCl Amb24562481 [1,1,0,0,0,0|2,0,0]=4 5173 B7R0.4 SCCCCC(=O)O Amb17503767 [1,1,0,0,0,0|0,0,0]=2 5174 B7R0.4 [N-]=[N+]=NCCC(O)=O Amb20622326 [1,1,0,0,0,0|2,0,0]=4 5175 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [1,1,0,0,0,0|0,0,1]=3 5176 B7R0.4 [O-][N+](=O)CCCCO Amb25739830 [1,1,0,0,0,0|1,0,1]=4 5177 B7R0.4 [O-][N+](=O)NCCCC Amb10552431 [1,1,0,0,0,0|1,0,1]=4 5178 B7R0.4 [O-][N+](=O)OCCCC Amb17610378 [1,1,0,0,0,0|1,0,1]=4 5179 B7R0.4 [S-]C(=S)OCCCC Amb16186572 [1,1,0,0,0,0|0,2,0]=4 5180 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [1,1,0,0,0,0|0,0,2]=4 5181 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [1,1,0,0,0,0|0,0,2]=4 5182 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [1,1,0,0,0,0|0,0,2]=4 5183 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [1,1,0,0,0,0|1,0,1]=4 5184 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,1,0,0,0,0|0,0,1]=3 5185 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [1,1,0,0,0,0|1,0,1]=4 5186 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [1,1,0,0,0,0|1,0,1]=4 5187 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [1,1,0,0,0,0|1,0,1]=4 5188 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [1,1,0,0,0,0|2,0,0]=4 5189 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [1,1,0,0,0,0|0,0,2]=4 5190 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [1,1,0,0,0,0|1,0,1]=4 5191 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,1,0,0,0,0|1,0,1]=4 5192 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,1,0,0,0,0|1,0,1]=4 5193 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [1,1,0,0,0,0|1,0,1]=4 5194 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [1,1,0,0,0,0|1,0,1]=4 5195 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [1,1,0,0,0,0|1,0,0]=3 5196 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [1,1,0,0,0,0|1,0,0]=3 5197 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [1,1,0,0,0,0|0,0,0]=2 5198 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [1,1,0,0,0,0|2,0,0]=4 5199 B7R0.6 CC(Br)COC(C)=O Amb25360690 [1,1,0,0,0,0|2,0,0]=4 5200 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [1,1,0,0,0,0|0,0,2]=4 5201 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [1,1,0,0,0,0|1,0,1]=4 5202 B7R0.6 CC(C)CCC(C)=C Amb22734286 [1,1,0,0,0,0|2,0,0]=4 5203 B7R0.6 CC(C)CCC(N)=N Amb19890005 [1,1,0,0,0,0|2,0,0]=4 5204 B7R0.6 CC(C)CCS(C)=O Amb24369501 [1,1,0,0,0,0|2,0,0]=4 5205 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [1,1,0,0,0,0|0,0,0]=2 5206 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [1,1,0,0,0,0|0,0,1]=3 5207 B7R0.6 CC(C)CC[N+]([O-])=O Amb17672612 [1,1,0,0,0,0|1,0,1]=4 5208 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,1,0,0,0,0|2,0,0]=4 5209 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [1,1,0,0,0,0|1,0,1]=4 5210 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [1,1,0,0,0,0|1,0,1]=4 5211 B7R0.6 CC(C)SCC(C)=O Amb22549127 [1,1,0,0,0,0|2,0,0]=4 5212 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [1,1,0,0,0,0|0,0,2]=4 5213 B7R0.6 CC(CCB(O)O)C Amb13890540 [1,1,0,0,0,0|1,0,1]=4 5214 B7R0.6 CC(CCC(=O)O)C Amb1153016 [1,1,0,0,0,0|0,0,0]=2 5215 B7R0.6 CC(CCC(=O)O)N Amb17593212 [1,1,0,0,0,0|0,0,0]=2 5216 B7R0.6 CC(CNC(=O)N)C Amb1151241 [1,1,0,0,0,0|2,0,0]=4 5217 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,1,0,0,0,0|1,0,0]=3 5218 B7R0.6 CC(Cl)CCC(C)O Amb25136164 [1,1,0,0,0,0|1,0,1]=4 5219 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [1,1,0,0,0,0|1,0,0]=3 5220 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [1,1,0,0,0,0|0,0,0]=2 5221 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [1,1,0,0,0,0|2,0,0]=4 5222 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [1,1,0,0,0,0|2,0,0]=4 5223 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [1,1,0,0,0,0|2,0,0]=4 5224 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [1,1,0,0,0,0|2,0,0]=4 5225 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [1,1,0,0,0,0|2,0,0]=4 5226 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [1,1,0,0,0,0|2,0,0]=4 5227 B7R0.6 CC(F)CCC(O)=O Amb24682772 [1,1,0,0,0,0|0,0,0]=2 5228 B7R0.6 CC(N)CCC(C)=C Amb18641752 [1,1,0,0,0,0|2,0,0]=4 5229 B7R0.6 CC(N)CCC(C)=O Amb24698356 [1,1,0,0,0,0|1,0,0]=3 5230 B7R0.6 CC(N)CCC(N)=O Amb18641901 [1,1,0,0,0,0|1,0,0]=3 5231 B7R0.6 CC(N)CCC(O)=O Amb19515603 [1,1,0,0,0,0|0,0,0]=2 5232 B7R0.6 CC(N)CCS(C)=O Amb19337158 [1,1,0,0,0,0|2,0,0]=4 5233 B7R0.6 CC(N)CCS(C)=O Amb22059582 [1,1,0,0,0,0|2,0,0]=4 5234 B7R0.6 CC(N)CNC(C)=O Amb18631377 [1,1,0,0,0,0|2,0,0]=4 5235 B7R0.6 CC(N)CNC(N)=O Amb18202688 [1,1,0,0,0,0|2,0,0]=4 5236 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [1,1,0,0,0,0|0,0,2]=4 5237 B7R0.6 CC(NCC(=O)N)C Amb2370772 [1,1,0,0,0,0|2,0,0]=4 5238 B7R0.6 CC(NCC(=O)O)C Amb2372347 [1,1,0,0,0,0|1,0,0]=3 5239 B7R0.6 CC(O)CCB(O)O Amb24594819 [1,1,0,0,0,0|1,0,1]=4 5240 B7R0.6 CC(O)CCC(C)=C Amb24062974 [1,1,0,0,0,0|2,0,0]=4 5241 B7R0.6 CC(O)CCC(C)=O Amb25829594 [1,1,0,0,0,0|1,0,0]=3 5242 B7R0.6 CC(O)CCC(C)N Amb18641930 [1,1,0,0,0,0|1,0,1]=4 5243 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,1,0,0,0,0|0,0,0]=2 5244 B7R0.6 CC(O)COC(C)=O Amb24056158 [1,1,0,0,0,0|2,0,0]=4 5245 B7R0.6 CC(O)COP(O)=O Amb24591406 [1,1,0,0,0,0|2,0,0]=4 5246 B7R0.6 CC(O)NCC(O)=O Amb25141558 [1,1,0,0,0,0|1,0,0]=3 5247 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [1,1,0,0,0,0|0,0,2]=4 5248 B7R0.6 CC(S)CNC(C)=O Amb24695989 [1,1,0,0,0,0|2,0,0]=4 5249 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [1,1,0,0,0,0|0,0,2]=4 5250 B7R0.6 CC(SCC(=O)O)C Amb1128460 [1,1,0,0,0,0|1,0,0]=3 5251 B7R0.6 CN(C)CCC(O)=O Amb19888182 [1,1,0,0,0,0|1,0,0]=3 5252 B7R0.6 CN(C)NCC(O)=O Amb24481366 [1,1,0,0,0,0|2,0,0]=4 5253 B7R0.6 CN(CCC(=O)C)C Amb1129203 [1,1,0,0,0,0|2,0,0]=4 5254 B7R0.6 CN(CCC(=O)N)C Amb17231825 [1,1,0,0,0,0|2,0,0]=4 5255 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [1,1,0,0,0,0|2,0,0]=4 5256 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,1,0,0,0,0|1,0,0]=3 5257 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [1,1,0,0,0,0|2,0,0]=4 5258 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [1,1,0,0,0,0|1,0,0]=3 5259 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [1,1,0,0,0,0|0,0,2]=4 5260 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [1,1,0,0,0,0|1,0,1]=4 5261 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [1,1,0,0,0,0|2,0,0]=4 5262 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [1,1,0,0,0,0|1,0,0]=3 5263 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [1,1,0,0,0,0|1,0,1]=4 5264 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [1,1,0,0,0,0|2,0,0]=4 5265 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [1,1,0,0,0,0|2,0,0]=4 5266 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [1,1,0,0,0,0|0,0,0]=2 5267 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [1,1,0,0,0,0|0,0,0]=2 5268 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [1,1,0,0,0,0|2,0,0]=4 5269 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [1,1,0,0,0,0|2,0,0]=4 5270 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [1,1,0,0,0,0|1,0,0]=3 5271 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [1,1,0,0,0,0|1,0,1]=4 5272 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [1,1,0,0,0,0|1,0,1]=4 5273 B7R0.6 NC(=O)CCC(F)F Amb25271130 [1,1,0,0,0,0|2,0,0]=4 5274 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [1,1,0,0,0,0|1,0,1]=4 5275 B7R0.6 O=C(Cl)CCC(Cl)Cl Amb24441999 [1,1,0,0,0,0|2,0,0]=4 5276 B7R0.6 OB(O)CCC(O)=O Amb24640288 [1,1,0,0,0,0|2,0,0]=4 5277 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [1,1,0,0,0,0|1,0,1]=4 5278 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [1,1,0,0,0,0|1,0,0]=3 5279 B7R0.6 OC(=O)CCC(F)F Amb20623135 [1,1,0,0,0,0|1,0,0]=3 5280 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [1,1,0,0,0,0|1,0,1]=4 5281 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [1,1,0,0,0,0|1,0,1]=4 5282 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [1,1,0,0,0,0|1,0,1]=4 5283 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [1,1,0,0,0,0|1,0,1]=4 5284 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [1,1,0,0,0,0|1,0,1]=4 5285 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [1,1,0,0,0,0|1,0,1]=4 5286 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [1,1,0,0,0,0|1,0,1]=4 5287 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [1,1,0,0,0,0|1,0,1]=4 5288 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,1,0,0,0,0|1,0,0]=3 5289 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [1,1,0,0,0,0|1,0,1]=4 5290 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [1,1,0,0,0,0|1,0,1]=4 5291 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [1,1,0,0,0,0|1,0,1]=4 5292 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,1,0,0,0,0|0,0,1]=3 5293 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [1,1,0,0,0,0|1,0,1]=4 5294 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [1,1,0,0,0,0|1,0,1]=4 5295 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [1,1,0,0,0,0|2,0,0]=4 5296 B7R0.8 CCCCB(O)(O)O Amb24422846 [1,1,0,0,0,0|1,0,1]=4 5297 B7R0.8 CCCCP(O)(O)=O Amb22053921 [1,1,0,0,0,0|1,0,0]=3 5298 B7R0.8 CCCCS(=O)(=O)Br Amb23555505 [1,1,0,0,0,0|1,0,1]=4 5299 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [1,1,0,0,0,0|1,0,1]=4 5300 B7R0.8 CCCCS(=O)(=O)N Amb1132715 [1,1,0,0,0,0|1,0,1]=4 5301 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [1,1,0,0,0,0|1,0,0]=3 5302 B7R0.8 CCCCS(C)(=O)=O Amb24643027 [1,1,0,0,0,0|1,0,1]=4 5303 B7R0.8 CCCCS(O)(=O)=O Amb22269868 [1,1,0,0,0,0|1,0,0]=3 5304 B7R0.8 CCCC[B-](O)(O)O Amb24457030 [1,1,0,0,0,0|1,0,1]=4 5305 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [1,1,0,0,0,0|1,0,1]=4 5306 B7R0.8 CCCOP(C)(O)=O Amb24553958 [1,1,0,0,0,0|2,0,0]=4 5307 B7R0.8 CCNCP(=O)(O)O Amb2233009 [1,1,0,0,0,0|2,0,0]=4 5308 B7R0.8 CCNCS(O)(=O)=O Amb25324324 [1,1,0,0,0,0|2,0,0]=4 5309 B7R0.8 CP(O)(=O)CCCO Amb24448096 [1,1,0,0,0,0|2,0,0]=4 5310 B7R0.8 CSCCS(O)(=O)=O Amb25200266 [1,1,0,0,0,0|2,0,0]=4 5311 B7R0.8 NCCCS(O)(=O)=O Amb22349635 [1,1,0,0,0,0|2,0,0]=4 5312 B7R0.8 OCCCS(O)(=O)=O Amb22002051 [1,1,0,0,0,0|2,0,0]=4 5313 B7R0.8 OCCCS(O)(=O)=O Amb22360758 [1,1,0,0,0,0|2,0,0]=4 5314 B7R0.8 OP(O)(=O)CCCCl Amb22388825 [1,1,0,0,0,0|2,0,0]=4 5315 B7R0.8 OS(=O)(=O)CCCS Amb20620653 [1,1,0,0,0,0|2,0,0]=4 5316 B7R0.8 OS(=O)(=O)CCCS Amb22360759 [1,1,0,0,0,0|2,0,0]=4 5317 B7R0.13 CC(=O)C(C)(C)CN Amb25253798 [0,1,0,0,1,0|2,0,0]=4 5318 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [0,1,0,0,1,0|2,0,0]=4 5319 B7R0.13 CC(=O)C(C)(Cl)CBr Amb24692951 [0,1,0,0,1,0|2,0,0]=4 5320 B7R0.13 CC(=O)C(C)(Cl)CO Amb24752373 [0,1,0,0,1,0|2,0,0]=4 5321 B7R0.13 CC(=O)C(C)(N)CO Amb25765120 [0,1,0,0,1,0|2,0,0]=4 5322 B7R0.13 CC(=O)C(C)(O)CCl Amb25794165 [0,1,0,0,1,0|2,0,0]=4 5323 B7R0.13 CC(C(=O)N)(CC)N Amb13952193 [0,1,0,0,1,0|1,0,0]=3 5324 B7R0.13 CC(C(=O)O)(CC)N Amb2235200 [0,1,0,0,1,0|0,0,0]=2 5325 B7R0.13 CC(C)(C=O)C(O)=O Amb25260968 [0,1,0,0,1,0|1,0,1]=4 5326 B7R0.13 CC(C)(CBr)C(=O)Cl Amb25320872 [0,1,0,0,1,0|2,0,0]=4 5327 B7R0.13 CC(C)(CBr)C(N)=O Amb24635645 [0,1,0,0,1,0|2,0,0]=4 5328 B7R0.13 CC(C)(CF)C(O)=O Amb22000679 [0,1,0,0,1,0|1,0,0]=3 5329 B7R0.13 CC(C)(CN)C(N)=O Amb23402034 [0,1,0,0,1,0|2,0,0]=4 5330 B7R0.13 CC(C)(CN)C(O)=O Amb22371031 [0,1,0,0,1,0|1,0,0]=3 5331 B7R0.13 CC(C)(NCl)C(O)=O Amb25698269 [0,1,0,0,1,0|2,0,0]=4 5332 B7R0.13 CC(C)(NO)C(O)=O Amb24407386 [0,1,0,0,1,0|2,0,0]=4 5333 B7R0.13 CC(C)(ON)C(O)=O Amb18641969 [0,1,0,0,1,0|2,0,0]=4 5334 B7R0.13 CC(C)(O[NH3+])C(O)=O Amb22167603 [0,1,0,0,1,0|2,0,0]=4 5335 B7R0.13 CC(Cl)(C#C)C(O)=O Amb25771733 [0,1,0,0,1,0|0,0,2]=4 5336 B7R0.13 CC(Cl)(CCl)C(N)=O Amb24481419 [0,1,0,0,1,0|2,0,0]=4 5337 B7R0.13 CC(Cl)(CCl)C([O-])=O Amb22730332 [0,1,0,0,1,0|1,0,1]=4 5338 B7R0.13 CC(F)(CCl)C(=O)Cl Amb24351071 [0,1,0,0,1,0|2,0,0]=4 5339 B7R0.13 CC(F)(CF)C(O)=O Amb24545976 [0,1,0,0,1,0|1,0,0]=3 5340 B7R0.13 CC(N)(C#C)C(O)=O Amb23504061 [0,1,0,0,1,0|0,0,2]=4 5341 B7R0.13 CC(N)(C=C)C(O)=O Amb18641826 [0,1,0,0,1,0|0,0,2]=4 5342 B7R0.13 CC(N)(CN)C(O)=O Amb25310586 [0,1,0,0,1,0|1,0,0]=3 5343 B7R0.13 CC(N)(CS)C(O)=O Amb18124446 [0,1,0,0,1,0|1,0,0]=3 5344 B7R0.13 CC(N)(CS)C(O)=O Amb24480151 [0,1,0,0,1,0|1,0,0]=3 5345 B7R0.13 CC(O)(C#C)C(O)=O Amb25071834 [0,1,0,0,1,0|0,0,2]=4 5346 B7R0.13 CC(O)(CBr)C(=O)Cl Amb24483059 [0,1,0,0,1,0|2,0,0]=4 5347 B7R0.13 CC(O)(CBr)C(N)=O Amb25108659 [0,1,0,0,1,0|2,0,0]=4 5348 B7R0.13 CC(O)(CBr)C(O)=O Amb18522184 [0,1,0,0,1,0|1,0,0]=3 5349 B7R0.13 CC(O)(CCl)C(N)=O Amb25198321 [0,1,0,0,1,0|2,0,0]=4 5350 B7R0.13 CC(O)(CN)C(O)=O Amb25378699 [0,1,0,0,1,0|1,0,0]=3 5351 B7R0.13 CC(O)(CO)C(O)=O Amb22270195 [0,1,0,0,1,0|1,0,0]=3 5352 B7R0.13 CC(O)(NO)C(O)=O Amb24482657 [0,1,0,0,1,0|2,0,0]=4 5353 B7R0.13 CC(S)(C#N)C(O)=O Amb25134394 [0,1,0,0,1,0|1,0,1]=4 5354 B7R0.13 CCC(C(=O)C)(O)C Amb17593200 [0,1,0,0,1,0|1,0,0]=3 5355 B7R0.13 CCC(C(=O)O)(F)F Amb10982488 [0,1,0,0,1,0|1,0,0]=3 5356 B7R0.13 CCC(C(=S)N)(C)C Amb17466474 [0,1,0,0,1,0|1,1,0]=4 5357 B7R0.13 CCC(C)(Br)C(=O)Br Amb24061144 [0,1,0,0,1,0|1,0,0]=3 5358 B7R0.13 CCC(C)(Br)C(=O)Cl Amb25127778 [0,1,0,0,1,0|1,0,0]=3 5359 B7R0.13 CCC(C)(Br)C(C)=O Amb24570848 [0,1,0,0,1,0|1,0,0]=3 5360 B7R0.13 CCC(C)(Br)C(N)=O Amb25111192 [0,1,0,0,1,0|1,0,0]=3 5361 B7R0.13 CCC(C)(Br)C(O)=O Amb22228657 [0,1,0,0,1,0|0,0,0]=2 5362 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [0,1,0,0,1,0|0,1,0]=3 5363 B7R0.13 CCC(C)(C)C(N)=N Amb24651347 [0,1,0,0,1,0|2,0,0]=4 5364 B7R0.13 CCC(C)(C)S(N)=O Amb24358390 [0,1,0,0,1,0|2,0,0]=4 5365 B7R0.13 CCC(C)(C)[S@@](N)=O Amb23401559 [0,1,0,0,1,0|2,0,0]=4 5366 B7R0.13 CCC(C)(Cl)C(C)=O Amb24434571 [0,1,0,0,1,0|1,0,0]=3 5367 B7R0.13 CCC(C)(Cl)C(O)=O Amb25730682 [0,1,0,0,1,0|0,0,0]=2 5368 B7R0.13 CCC(C)(F)C(O)=O Amb24481385 [0,1,0,0,1,0|0,0,0]=2 5369 B7R0.13 CCC(C)(N)C(C)=O Amb25857157 [0,1,0,0,1,0|1,0,0]=3 5370 B7R0.13 CCC(C)(N)C(N)=N Amb25835758 [0,1,0,0,1,0|2,0,0]=4 5371 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,0,0,1,0|1,0,0]=3 5372 B7R0.13 CCC(C)(N)C(N)=S Amb24387902 [0,1,0,0,1,0|1,1,0]=4 5373 B7R0.13 CCC(C)(N)P(O)=O Amb24505272 [0,1,0,0,1,0|1,0,0]=3 5374 B7R0.13 CCC(C)(O)C(C)O Amb24407375 [0,1,0,0,1,0|1,0,1]=4 5375 B7R0.13 CCC(C)(O)C(N)=N Amb24713514 [0,1,0,0,1,0|2,0,0]=4 5376 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,0,0,1,0|1,0,0]=3 5377 B7R0.13 CCC(Cl)(Cl)C(C)=O Amb25714198 [0,1,0,0,1,0|2,0,0]=4 5378 B7R0.13 CCC(Cl)(Cl)C(O)=O Amb25274946 [0,1,0,0,1,0|1,0,0]=3 5379 B7R0.13 CCC(F)(Cl)C(C)=O Amb24575964 [0,1,0,0,1,0|2,0,0]=4 5380 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [0,1,0,0,1,0|2,0,0]=4 5381 B7R0.13 CCC(F)(F)C([O-])=O Amb19889420 [0,1,0,0,1,0|1,0,1]=4 5382 B7R0.13 CCC(O)(O)C(N)=O Amb24419277 [0,1,0,0,1,0|2,0,0]=4 5383 B7R0.13 CC[C@@](C)(N)C(O)=O Amb19929605 [0,1,0,0,1,0|0,0,0]=2 5384 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [0,1,0,0,1,0|1,0,0]=3 5385 B7R0.13 CC[C@@](C)(O)C(N)=O Amb24668764 [0,1,0,0,1,0|1,0,0]=3 5386 B7R0.13 CC[C@@](C)(O)C([O-])=O Amb17772231 [0,1,0,0,1,0|0,0,1]=3 5387 B7R0.13 CC[C@@](C)(O)[C@@H](C)O Amb25025210 [0,1,0,0,1,0|1,0,1]=4 5388 B7R0.13 CC[C@](C)(Cl)C(O)=O Amb24402244 [0,1,0,0,1,0|0,0,0]=2 5389 B7R0.13 CNC(C)(C)C(C)=O Amb18641844 [0,1,0,0,1,0|2,0,0]=4 5390 B7R0.13 CNC(C)(C)C(N)=O Amb18950551 [0,1,0,0,1,0|2,0,0]=4 5391 B7R0.13 CNC(C)(F)C(O)=O Amb25225635 [0,1,0,0,1,0|1,0,0]=3 5392 B7R0.13 CN[C@@](C)(F)C(O)=O Amb25697457 [0,1,0,0,1,0|1,0,0]=3 5393 B7R0.13 CN[C@](C)(F)C(O)=O Amb25085415 [0,1,0,0,1,0|1,0,0]=3 5394 B7R0.13 COC(C)(C)C(C)=O Amb22169707 [0,1,0,0,1,0|2,0,0]=4 5395 B7R0.13 COC(C)(N)C(C)=O Amb24608852 [0,1,0,0,1,0|2,0,0]=4 5396 B7R0.13 COC(C)(O)C(C)=O Amb25853230 [0,1,0,0,1,0|2,0,0]=4 5397 B7R0.13 COC(C)(S)C(O)=O Amb25201636 [0,1,0,0,1,0|1,0,0]=3 5398 B7R0.13 CSC(C(=O)O)(C)C Amb17501488 [0,1,0,0,1,0|1,0,0]=3 5399 B7R0.13 CSC(C)(C)C(N)=O Amb25293100 [0,1,0,0,1,0|2,0,0]=4 5400 B7R0.13 CSC(C)(Cl)C(C)=O Amb24481499 [0,1,0,0,1,0|2,0,0]=4 5401 B7R0.13 CSC(F)(F)C(O)=O Amb23586472 [0,1,0,0,1,0|2,0,0]=4 5402 B7R0.13 C[C@@](C(=O)O)(CC)N Amb16183896 [0,1,0,0,1,0|0,0,0]=2 5403 B7R0.13 C[C@@](C(=O)O)(CC)O Amb10067076 [0,1,0,0,1,0|0,0,0]=2 5404 B7R0.13 C[C@@](N)(CF)C(O)=O Amb25169596 [0,1,0,0,1,0|1,0,0]=3 5405 B7R0.13 C[C@@](N)(CS)C(O)=O Amb22757501 [0,1,0,0,1,0|1,0,0]=3 5406 B7R0.13 C[C@@](O)(CN)C(O)=O Amb24698181 [0,1,0,0,1,0|1,0,0]=3 5407 B7R0.13 C[C@](C(=O)O)(CBr)O Amb17610012 [0,1,0,0,1,0|1,0,0]=3 5408 B7R0.13 C[C@](C(=O)O)(CC)O Amb10067075 [0,1,0,0,1,0|0,0,0]=2 5409 B7R0.13 C[C@](C(=O)O)(CS)N Amb16183893 [0,1,0,0,1,0|1,0,0]=3 5410 B7R0.13 C[C@](F)(CN)C(O)=O Amb25110675 [0,1,0,0,1,0|1,0,0]=3 5411 B7R0.13 C[C@](N)(C#C)C(O)=O Amb24406693 [0,1,0,0,1,0|0,0,2]=4 5412 B7R0.13 C[C@](N)(C=C)C(O)=O Amb24481465 [0,1,0,0,1,0|0,0,2]=4 5413 B7R0.13 C[C@](N)(CF)C(O)=O Amb25775618 [0,1,0,0,1,0|1,0,0]=3 5414 B7R0.13 C[C@](N)(CN)C(O)=O Amb25690446 [0,1,0,0,1,0|1,0,0]=3 5415 B7R0.13 C[C@](N)(CS)C(O)=O Amb22388665 [0,1,0,0,1,0|1,0,0]=3 5416 B7R0.13 C[C@](N)(CS)C(O)=O Amb24053489 [0,1,0,0,1,0|1,0,0]=3 5417 B7R0.13 C[C@](O)(C=C)C(O)=O Amb24556886 [0,1,0,0,1,0|0,0,2]=4 5418 B7R0.13 C[C@](O)(CBr)C(=O)Cl Amb25824129 [0,1,0,0,1,0|2,0,0]=4 5419 B7R0.13 C[C@](O)(CBr)C(O)=O Amb22224875 [0,1,0,0,1,0|1,0,0]=3 5420 B7R0.13 C[C@](O)(CO)C(O)=O Amb25173833 [0,1,0,0,1,0|1,0,0]=3 5421 B7R0.13 C[C@](O)(NO)C(O)=O Amb24412529 [0,1,0,0,1,0|2,0,0]=4 5422 B7R0.13 NC(N)(CS)C(O)=O Amb24746383 [0,1,0,0,1,0|2,0,0]=4 5423 B7R0.13 NC(O)(CS)C(O)=O Amb25211789 [0,1,0,0,1,0|2,0,0]=4 5424 B7R0.13 NCC(F)(F)C(O)=O Amb19888004 [0,1,0,0,1,0|2,0,0]=4 5425 B7R0.13 OC(=O)C(Cl)(Cl)CCl Amb22731239 [0,1,0,0,1,0|2,0,0]=4 5426 B7R0.13 OC(=O)C(F)(Cl)CCl Amb25189030 [0,1,0,0,1,0|2,0,0]=4 5427 B7R0.13 OC(=O)C(F)(F)CF Amb25711017 [0,1,0,0,1,0|2,0,0]=4 5428 B7R0.13 OCC(C(=O)O)(F)F Amb17593305 [0,1,0,0,1,0|2,0,0]=4 5429 B7R0.13 [C-]#[N+]C(C)(C)C(O)=O Amb24481414 [0,1,0,0,1,0|1,0,1]=4 5430 B7R0.14 CC(CN)S(O)(=O)=O Amb24481489 [0,1,0,0,1,0|2,0,0]=4 5431 B7R0.14 CC(CO)P(O)(O)=O Amb25135495 [0,1,0,0,1,0|2,0,0]=4 5432 B7R0.14 CC(CO)S(O)(=O)=O Amb25285698 [0,1,0,0,1,0|2,0,0]=4 5433 B7R0.14 CCC(C)C(C)(C)O Amb22731889 [0,1,0,0,1,0|1,0,1]=4 5434 B7R0.14 CCC(C)S(=O)(=O)F Amb19889429 [0,1,0,0,1,0|1,0,1]=4 5435 B7R0.14 CCC(C)S(C)(=O)=O Amb22008597 [0,1,0,0,1,0|1,0,1]=4 5436 B7R0.14 CCC(C)S(N)(=O)=O Amb25762563 [0,1,0,0,1,0|1,0,1]=4 5437 B7R0.14 CCC(C)S(O)(=O)=O Amb22372234 [0,1,0,0,1,0|1,0,0]=3 5438 B7R0.14 CCC(Cl)S(O)(=O)=O Amb24627108 [0,1,0,0,1,0|2,0,0]=4 5439 B7R0.14 CCC(N)S(O)(=O)=O Amb24558367 [0,1,0,0,1,0|2,0,0]=4 5440 B7R0.14 CCC(O)P(O)(O)=O Amb24354457 [0,1,0,0,1,0|2,0,0]=4 5441 B7R0.14 CCC(P(=O)(O)O)C Amb10560197 [0,1,0,0,1,0|1,0,0]=3 5442 B7R0.14 CC[C@@H](Cl)P(O)(O)=O Amb24332616 [0,1,0,0,1,0|2,0,0]=4 5443 B7R0.14 CNC(C)P(O)(O)=O Amb25223984 [0,1,0,0,1,0|2,0,0]=4 5444 B7R0.15 CC(=O)C(CC)=NC Amb24518359 [0,1,0,0,1,0|1,0,1]=4 5445 B7R0.15 CC(=O)C(CO)CO Amb22904340 [0,1,0,0,1,0|2,0,0]=4 5446 B7R0.15 CC(=O)\C(\CC)=C/C Amb24481481 [0,1,0,0,1,0|1,0,1]=4 5447 B7R0.15 CC(=O)\C(\CC)=N\C Amb24524263 [0,1,0,0,1,0|1,0,1]=4 5448 B7R0.15 CC(O)C(CCl)CC Amb24671336 [0,1,0,0,1,0|1,0,1]=4 5449 B7R0.15 CC=C(OC)C(O)=O Amb25793698 [0,1,0,0,1,0|0,0,2]=4 5450 B7R0.15 CCC(=C=C)C(O)=O Amb25246162 [0,1,0,0,1,0|0,0,2]=4 5451 B7R0.15 CCC(=CC)C(N)=O Amb25367251 [0,1,0,0,1,0|1,0,1]=4 5452 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [0,1,0,0,1,0|0,0,1]=3 5453 B7R0.15 CCC(C#C)C(C)=O Amb25128229 [0,1,0,0,1,0|1,0,1]=4 5454 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [0,1,0,0,1,0|0,0,1]=3 5455 B7R0.15 CCC(C(=O)N)NC Amb15701261 [0,1,0,0,1,0|1,0,0]=3 5456 B7R0.15 CCC(C(=O)N)OC Amb2027289 [0,1,0,0,1,0|1,0,0]=3 5457 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [0,1,0,0,1,0|0,0,1]=3 5458 B7R0.15 CCC(C(=O)O)NC Amb10610245 [0,1,0,0,1,0|0,0,0]=2 5459 B7R0.15 CCC(C(=O)O)SC Amb17501348 [0,1,0,0,1,0|0,0,0]=2 5460 B7R0.15 CCC(C(=O)[O-])CCl Amb10604125 [0,1,0,0,1,0|0,0,1]=3 5461 B7R0.15 CCC(C(=S)N)CC Amb1118595 [0,1,0,0,1,0|1,1,0]=4 5462 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [0,1,0,0,1,0|0,0,0]=2 5463 B7R0.15 CCC(CC)B(O)O Amb25806465 [0,1,0,0,1,0|1,0,1]=4 5464 B7R0.15 CCC(CC)C(=O)Br Amb25280424 [0,1,0,0,1,0|1,0,0]=3 5465 B7R0.15 CCC(CC)C(N)=N Amb25794850 [0,1,0,0,1,0|2,0,0]=4 5466 B7R0.15 CCC(CC)C([O-])=O Amb22585838 [0,1,0,0,1,0|0,0,1]=3 5467 B7R0.15 CCC(CC)S([O-])=O Amb24722702 [0,1,0,0,1,0|1,0,1]=4 5468 B7R0.15 CCC(CC)[N+]([O-])=O Amb25843309 [0,1,0,0,1,0|1,0,1]=4 5469 B7R0.15 CCC(CN)B(O)O Amb25075896 [0,1,0,0,1,0|1,0,1]=4 5470 B7R0.15 CCC(CN)C(C)=O Amb24548156 [0,1,0,0,1,0|1,0,0]=3 5471 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,0,0,1,0|1,0,0]=3 5472 B7R0.15 CCC(CN)C(O)=O Amb18987934 [0,1,0,0,1,0|0,0,0]=2 5473 B7R0.15 CCC(CN)C(O)=O Amb19514932 [0,1,0,0,1,0|0,0,0]=2 5474 B7R0.15 CCC(CN)S(C)=O Amb25106958 [0,1,0,0,1,0|2,0,0]=4 5475 B7R0.15 CCC(CO)C(C)=O Amb24709237 [0,1,0,0,1,0|1,0,0]=3 5476 B7R0.15 CCC(CO)C(O)=O Amb18641947 [0,1,0,0,1,0|0,0,0]=2 5477 B7R0.15 CCC(CS)C(O)=O Amb24435402 [0,1,0,0,1,0|0,0,0]=2 5478 B7R0.15 CCC(N=C)C(N)=O Amb25811618 [0,1,0,0,1,0|1,0,1]=4 5479 B7R0.15 CCC(NN)C(O)=O Amb18641955 [0,1,0,0,1,0|1,0,0]=3 5480 B7R0.15 CCC(ON)C(N)=O Amb24483121 [0,1,0,0,1,0|2,0,0]=4 5481 B7R0.15 CCC(ON)C(O)=O Amb25697895 [0,1,0,0,1,0|1,0,0]=3 5482 B7R0.15 CCN(C(=O)N)CC Amb1128168 [0,1,0,0,1,0|2,0,0]=4 5483 B7R0.15 CCN(CC)C(O)=S Amb24698748 [0,1,0,0,1,0|1,1,0]=4 5484 B7R0.15 CCN(CC)P(O)=O Amb24550706 [0,1,0,0,1,0|2,0,0]=4 5485 B7R0.15 CCN(CCl)C(=O)Cl Amb24680857 [0,1,0,0,1,0|2,0,0]=4 5486 B7R0.15 CCN(OC)C(N)=O Amb24417375 [0,1,0,0,1,0|2,0,0]=4 5487 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [0,1,0,0,1,0|0,0,0]=2 5488 B7R0.15 CC[C@@H](CO)C(C)=C Amb24525664 [0,1,0,0,1,0|2,0,0]=4 5489 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [0,1,0,0,1,0|0,0,0]=2 5490 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [0,1,0,0,1,0|0,0,0]=2 5491 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [0,1,0,0,1,0|1,0,0]=3 5492 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [0,1,0,0,1,0|0,0,1]=3 5493 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [0,1,0,0,1,0|0,0,0]=2 5494 B7R0.15 CC[C@H](CO)C(C)=C Amb25071554 [0,1,0,0,1,0|2,0,0]=4 5495 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [0,1,0,0,1,0|0,0,0]=2 5496 B7R0.15 CC[C@H](N=C)C(N)=O Amb25738279 [0,1,0,0,1,0|1,0,1]=4 5497 B7R0.15 CC[C@H](NC)C(N)=O Amb25745002 [0,1,0,0,1,0|1,0,0]=3 5498 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [0,1,0,0,1,0|0,0,0]=2 5499 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [0,1,0,0,1,0|0,0,1]=3 5500 B7R0.15 CC\C(=N/O)\C(O)=O Amb25378085 [0,1,0,0,1,0|1,0,1]=4 5501 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [0,1,0,0,1,0|0,0,2]=4 5502 B7R0.15 CNC(CF)C(O)=O Amb25695388 [0,1,0,0,1,0|1,0,0]=3 5503 B7R0.15 CNC(CN)C(O)=O Amb23515020 [0,1,0,0,1,0|1,0,0]=3 5504 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,0,0,1,0|2,0,0]=4 5505 B7R0.15 CNC(SC)C(O)=O Amb25745282 [0,1,0,0,1,0|1,0,0]=3 5506 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [0,1,0,0,1,0|1,0,0]=3 5507 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [0,1,0,0,1,0|1,0,0]=3 5508 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [0,1,0,0,1,0|2,0,0]=4 5509 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [0,1,0,0,1,0|1,0,0]=3 5510 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [0,1,0,0,1,0|1,0,0]=3 5511 B7R0.15 COC(C=C)C(O)=O Amb18641874 [0,1,0,0,1,0|0,0,2]=4 5512 B7R0.15 COC(CBr)C(C)=O Amb24737219 [0,1,0,0,1,0|2,0,0]=4 5513 B7R0.15 COC(CBr)C(N)=O Amb24563790 [0,1,0,0,1,0|2,0,0]=4 5514 B7R0.15 COC(CCl)C(O)=O Amb18643355 [0,1,0,0,1,0|1,0,0]=3 5515 B7R0.15 COC(CN)C(N)=O Amb24719552 [0,1,0,0,1,0|2,0,0]=4 5516 B7R0.15 COC(CN)C(O)=O Amb22059584 [0,1,0,0,1,0|1,0,0]=3 5517 B7R0.15 COC(CN)C(O)=O Amb24271092 [0,1,0,0,1,0|1,0,0]=3 5518 B7R0.15 COC(CO)C(O)=O Amb24482992 [0,1,0,0,1,0|1,0,0]=3 5519 B7R0.15 COC(CS)C(O)=O Amb25305649 [0,1,0,0,1,0|1,0,0]=3 5520 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [0,1,0,0,1,0|2,0,0]=4 5521 B7R0.15 CS(=O)C(CC)CC Amb24747233 [0,1,0,0,1,0|2,0,0]=4 5522 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [0,1,0,0,1,0|1,0,0]=3 5523 B7R0.15 CSC(CO)C(C)=O Amb25746293 [0,1,0,0,1,0|2,0,0]=4 5524 B7R0.15 CSC(CO)C(N)=O Amb25849170 [0,1,0,0,1,0|2,0,0]=4 5525 B7R0.15 CSC(SC)C(N)=O Amb25233004 [0,1,0,0,1,0|2,0,0]=4 5526 B7R0.15 C[C@H](O)C(CC)CC Amb24355152 [0,1,0,0,1,0|1,0,1]=4 5527 B7R0.15 C\C=C(/CBr)\C(O)=O Amb18128301 [0,1,0,0,1,0|0,0,2]=4 5528 B7R0.15 C\C=C(/OC)\C(O)=O Amb18124260 [0,1,0,0,1,0|0,0,2]=4 5529 B7R0.15 C\C=C(\CBr)/C(O)=O Amb24606924 [0,1,0,0,1,0|0,0,2]=4 5530 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [0,1,0,0,1,0|0,0,2]=4 5531 B7R0.15 NCC(C(=O)O)C#N Amb10842157 [0,1,0,0,1,0|1,0,1]=4 5532 B7R0.15 NCC(CN)C(O)=O Amb25335570 [0,1,0,0,1,0|1,0,0]=3 5533 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [0,1,0,0,1,0|1,0,0]=3 5534 B7R0.15 NNC(CS)C(O)=O Amb24117863 [0,1,0,0,1,0|2,0,0]=4 5535 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [0,1,0,0,1,0|2,0,0]=4 5536 B7R0.15 OC(=O)C(CI)CI Amb17779784 [0,1,0,0,1,0|1,0,0]=3 5537 B7R0.15 OC(=O)C(CO)CO Amb18124271 [0,1,0,0,1,0|1,0,0]=3 5538 B7R0.15 OC(=O)C(CS)NS Amb25286626 [0,1,0,0,1,0|2,0,0]=4 5539 B7R0.15 OCC(NO)C(O)=O Amb24719766 [0,1,0,0,1,0|2,0,0]=4 5540 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [0,1,0,0,1,0|0,0,1]=3 5541 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [0,1,0,0,0,1|1,0,1]=4 5542 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,1,0,0,0,1|1,0,1]=4 5543 B9R0.7 CC(=O)C(C)CNC(C)=O Amb24072033 [0,1,0,0,0,1|1,0,1]=4 5544 B9R0.7 CC(=O)C(C)SCC(C)=O Amb24482830 [0,1,0,0,0,1|1,0,1]=4 5545 B9R0.7 CC(=O)CCC(C)C(C)=C Amb25702190 [0,1,0,0,0,1|1,0,1]=4 5546 B9R0.7 CC(=O)CCC(C)C(C)=O Amb25146789 [0,1,0,0,0,1|1,0,1]=4 5547 B9R0.7 CC(=O)CC[C@@H](C)C(C)=C Amb24646916 [0,1,0,0,0,1|1,0,1]=4 5548 B9R0.7 CC(=O)CC[C@H](C)C(C)=C Amb24583145 [0,1,0,0,0,1|1,0,1]=4 5549 B9R0.7 CC(=O)CC[C@H](C)C(C)=O Amb25692099 [0,1,0,0,0,1|1,0,1]=4 5550 B9R0.7 CC(=O)NCC(C)C(C)=C Amb24359912 [0,1,0,0,0,1|1,0,1]=4 5551 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [0,1,0,0,0,1|0,0,1]=3 5552 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,1,0,0,0,1|1,0,1]=4 5553 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [0,1,0,0,0,1|0,0,1]=3 5554 B9R0.7 CC(=O)[C@H](C)COC(C)=O Amb24457434 [0,1,0,0,0,1|1,0,1]=4 5555 B9R0.7 CC(Br)C(Br)\C=C\C(O)=O Amb22347457 [0,1,0,0,0,1|1,0,1]=4 5556 B9R0.7 CC(Br)C(O)\C=C\C(O)=O Amb24611190 [0,1,0,0,0,1|1,0,1]=4 5557 B9R0.7 CC(C(=O)NCC(=O)O)C Amb1112853 [0,1,0,0,0,1|1,0,1]=4 5558 B9R0.7 CC(C(C)C)NCC(=O)N Amb1113849 [0,1,0,0,0,1|1,0,0]=3 5559 B9R0.7 CC(C)=C(C)CCC(O)=O Amb24505016 [0,1,0,0,0,1|0,0,2]=4 5560 B9R0.7 CC(C)C(Br)CCC(O)=O Amb24640345 [0,1,0,0,0,1|1,0,0]=3 5561 B9R0.7 CC(C)C(Br)CNC(C)=O Amb25717188 [0,1,0,0,0,1|2,0,0]=4 5562 B9R0.7 CC(C)C(Br)COC(C)=O Amb24633343 [0,1,0,0,0,1|2,0,0]=4 5563 B9R0.7 CC(C)C(Br)\C=C\C(O)=O Amb25733509 [0,1,0,0,0,1|1,0,1]=4 5564 B9R0.7 CC(C)C(C)CCC(C)=O Amb24423995 [0,1,0,0,0,1|1,0,0]=3 5565 B9R0.7 CC(C)C(C)CCC(C)O Amb25788195 [0,1,0,0,0,1|1,0,1]=4 5566 B9R0.7 CC(C)C(C)CCC(O)=O Amb25843702 [0,1,0,0,0,1|0,0,0]=2 5567 B9R0.7 CC(C)C(C)CNC(N)=N Amb25278437 [0,1,0,0,0,1|2,0,0]=4 5568 B9R0.7 CC(C)C(C)CNC(N)=S Amb25074449 [0,1,0,0,0,1|1,1,0]=4 5569 B9R0.7 CC(C)C(C)NCC(=C)Br Amb18303973 [0,1,0,0,0,1|2,0,0]=4 5570 B9R0.7 CC(C)C(C)NCC(=C)Cl Amb19004844 [0,1,0,0,0,1|2,0,0]=4 5571 B9R0.7 CC(C)C(C)NCC(C)=C Amb25288686 [0,1,0,0,0,1|2,0,0]=4 5572 B9R0.7 CC(C)C(C)NC[C@H](C)O Amb25147782 [0,1,0,0,0,1|1,0,1]=4 5573 B9R0.7 CC(C)C(C)OCC(=C)Br Amb24386814 [0,1,0,0,0,1|2,0,0]=4 5574 B9R0.7 CC(C)C(C)OCC(N)=N Amb24357152 [0,1,0,0,0,1|2,0,0]=4 5575 B9R0.7 CC(C)C(C)OCC(O)=O Amb24479217 [0,1,0,0,0,1|0,0,0]=2 5576 B9R0.7 CC(C)C(C)OC[C@@H](C)O Amb24373041 [0,1,0,0,0,1|1,0,1]=4 5577 B9R0.7 CC(C)C(C)SCC(=C)Br Amb24482674 [0,1,0,0,0,1|2,0,0]=4 5578 B9R0.7 CC(C)C(C)SCC(C)=C Amb24482847 [0,1,0,0,0,1|2,0,0]=4 5579 B9R0.7 CC(C)C(C)SCC(N)=N Amb25325713 [0,1,0,0,0,1|2,0,0]=4 5580 B9R0.7 CC(C)C(C)SCC(N)=O Amb25769868 [0,1,0,0,0,1|1,0,0]=3 5581 B9R0.7 CC(C)C(C)SC[C@H](C)O Amb25726045 [0,1,0,0,0,1|1,0,1]=4 5582 B9R0.7 CC(C)C(C)\C=C\C(C)=O Amb25063008 [0,1,0,0,0,1|1,0,1]=4 5583 B9R0.7 CC(C)C(Cl)CCC(O)=O Amb24413514 [0,1,0,0,0,1|1,0,0]=3 5584 B9R0.7 CC(C)C(F)CCC(O)=O Amb24480880 [0,1,0,0,0,1|1,0,0]=3 5585 B9R0.7 CC(C)C(N)CCC(O)=O Amb18124745 [0,1,0,0,0,1|1,0,0]=3 5586 B9R0.7 CC(C)C(N)CNC(C)=O Amb24757730 [0,1,0,0,0,1|2,0,0]=4 5587 B9R0.7 CC(C)C(N)\C=C\C(O)=O Amb24397928 [0,1,0,0,0,1|1,0,1]=4 5588 B9R0.7 CC(C)C(O)C#CC(O)=O Amb17779780 [0,1,0,0,0,1|1,0,1]=4 5589 B9R0.7 CC(C)C(O)CCC(C)=O Amb24380845 [0,1,0,0,0,1|2,0,0]=4 5590 B9R0.7 CC(C)C(O)CCC(O)=O Amb25252592 [0,1,0,0,0,1|1,0,0]=3 5591 B9R0.7 CC(C)C(S)CCC(C)=O Amb25723213 [0,1,0,0,0,1|2,0,0]=4 5592 B9R0.7 CC(C)C(S)CCC(O)=O Amb25723893 [0,1,0,0,0,1|1,0,0]=3 5593 B9R0.7 CC(C)N(C)CCC(N)=O Amb25216072 [0,1,0,0,0,1|2,0,0]=4 5594 B9R0.7 CC(C)S(=O)CCC(O)=O Amb18312508 [0,1,0,0,0,1|2,0,0]=4 5595 B9R0.7 CC(C)S(=O)NCC(O)=O Amb25177225 [0,1,0,0,0,1|2,0,0]=4 5596 B9R0.7 CC(C)[C@@H](C)CCC(O)=O Amb25076667 [0,1,0,0,0,1|0,0,0]=2 5597 B9R0.7 CC(C)[C@@H](O)C#CC(O)=O Amb25849331 [0,1,0,0,0,1|1,0,1]=4 5598 B9R0.7 CC(C)[C@H](N)C#CC(O)=O Amb25147536 [0,1,0,0,0,1|1,0,1]=4 5599 B9R0.7 CC(C)[C@H](N)CCC(O)=O Amb24452899 [0,1,0,0,0,1|1,0,0]=3 5600 B9R0.7 CC(CCC(C)=C)C(C)Br Amb24572731 [0,1,0,0,0,1|2,0,0]=4 5601 B9R0.7 CC(CCC(O)=O)[N+]([O-])=O Amb25221792 [0,1,0,0,0,1|2,0,0]=4 5602 B9R0.7 CC(CCS(C)=O)C(C)Cl Amb25265317 [0,1,0,0,0,1|2,0,0]=4 5603 B9R0.7 CC(CCS(C)=O)C(C)O Amb24555698 [0,1,0,0,0,1|2,0,0]=4 5604 B9R0.7 CC(CNC(C)=O)N(C)C Amb24479027 [0,1,0,0,0,1|2,0,0]=4 5605 B9R0.7 CC(CNC(N)=O)N(C)C Amb24374971 [0,1,0,0,0,1|2,0,0]=4 5606 B9R0.7 CC(COC(C)=O)C(C)O Amb24719537 [0,1,0,0,0,1|1,0,0]=3 5607 B9R0.7 CC(Cl)C(=O)CCC(O)=O Amb25362323 [0,1,0,0,0,1|1,0,1]=4 5608 B9R0.7 CC(Cl)C(O)CCC(O)=O Amb24677604 [0,1,0,0,0,1|1,0,0]=3 5609 B9R0.7 CC(Cl)C(O)\C=C\C(O)=O Amb24739825 [0,1,0,0,0,1|1,0,1]=4 5610 B9R0.7 CC(F)C(O)CCC(O)=O Amb25831840 [0,1,0,0,0,1|1,0,0]=3 5611 B9R0.7 CC(N)C(=O)CCC(O)=O Amb25709431 [0,1,0,0,0,1|1,0,1]=4 5612 B9R0.7 CC(N)C(N)CCC(O)=O Amb24377171 [0,1,0,0,0,1|1,0,0]=3 5613 B9R0.7 CC(N)C(O)CSC(C)=O Amb25286278 [0,1,0,0,0,1|2,0,0]=4 5614 B9R0.7 CC(NCC(C)O)C(C)N Amb24393087 [0,1,0,0,0,1|1,0,1]=4 5615 B9R0.7 CC(NCC(N)=O)C(F)F Amb24480950 [0,1,0,0,0,1|2,0,0]=4 5616 B9R0.7 CC(NCC(O)=O)C(C)N Amb24637505 [0,1,0,0,0,1|0,0,0]=2 5617 B9R0.7 CC(NCC(O)=O)C(F)F Amb25696710 [0,1,0,0,0,1|1,0,0]=3 5618 B9R0.7 CC(O)C(=O)CCC(O)=O Amb25825263 [0,1,0,0,0,1|1,0,1]=4 5619 B9R0.7 CC(O)C(=O)NCC(O)=O Amb24640434 [0,1,0,0,0,1|1,0,1]=4 5620 B9R0.7 CC(O)C(C)C#CC(O)=O Amb25310844 [0,1,0,0,0,1|0,0,1]=3 5621 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,1,0,0,0,1|0,0,0]=2 5622 B9R0.7 CC(O)C(C)SCC(C)O Amb25185164 [0,1,0,0,0,1|1,0,1]=4 5623 B9R0.7 CC(O)C(C)SC[C@H](C)O Amb24388949 [0,1,0,0,0,1|1,0,1]=4 5624 B9R0.7 CC(O)C(N)CNC(N)=O Amb25809645 [0,1,0,0,0,1|2,0,0]=4 5625 B9R0.7 CC(O)C(O)CCC(O)=O Amb25054706 [0,1,0,0,0,1|1,0,0]=3 5626 B9R0.7 CC(O)C(O)\C=C\C(O)=O Amb24470539 [0,1,0,0,0,1|1,0,1]=4 5627 B9R0.7 CC(O)CC[C@@H](C)[C@@H](C)O Amb25333287 [0,1,0,0,0,1|1,0,1]=4 5628 B9R0.7 CC(OCC(O)=O)C(O)=O Amb25292152 [0,1,0,0,0,1|1,0,1]=4 5629 B9R0.7 CC(SCC(=C)Cl)C(C)O Amb24703030 [0,1,0,0,0,1|2,0,0]=4 5630 B9R0.7 CC(SCC(C)=C)C(C)O Amb25732856 [0,1,0,0,0,1|2,0,0]=4 5631 B9R0.7 CC(SCC(N)=N)C(C)O Amb24509346 [0,1,0,0,0,1|2,0,0]=4 5632 B9R0.7 CC(SCC(N)=O)C(C)O Amb24426482 [0,1,0,0,0,1|1,0,0]=3 5633 B9R0.7 CC([S-])C(=O)NCC(O)=O Amb22730461 [0,1,0,0,0,1|1,0,1]=4 5634 B9R0.7 C[C@@H](CC=C(C)C)C(C)O Amb24706240 [0,1,0,0,0,1|2,0,0]=4 5635 B9R0.7 C[C@@H](CCC(C)=O)[C@@H](C)O Amb22747043 [0,1,0,0,0,1|1,0,0]=3 5636 B9R0.7 C[C@@H](CCC(O)=O)C(O)=O Amb22799543 [0,1,0,0,0,1|1,0,1]=4 5637 B9R0.7 C[C@@H](F)[C@H](N)CCC(O)=O Amb25042508 [0,1,0,0,0,1|1,0,0]=3 5638 B9R0.7 C[C@@H](N)C(=O)NCC(O)=O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 5639 B9R0.7 C[C@@H](NCC(O)=O)C(O)=O Amb22748947 [0,1,0,0,0,1|1,0,1]=4 5640 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,1,0,0,0,1|0,0,0]=2 5641 B9R0.7 C[C@@H](SCC(O)=O)C(O)=O Amb24482305 [0,1,0,0,0,1|1,0,1]=4 5642 B9R0.7 C[C@H](CC=C(C)C)C(C)O Amb24733053 [0,1,0,0,0,1|2,0,0]=4 5643 B9R0.7 C[C@H](CCC(O)=O)C(O)=O Amb22225175 [0,1,0,0,0,1|1,0,1]=4 5644 B9R0.7 C[C@H](N)C(=O)CCC(O)=O Amb25851449 [0,1,0,0,0,1|1,0,1]=4 5645 B9R0.7 C[C@H](N)C(O)CSC(C)=O Amb24678280 [0,1,0,0,0,1|2,0,0]=4 5646 B9R0.7 C[C@H](NCC(O)=O)C(O)=O Amb25133540 [0,1,0,0,0,1|1,0,1]=4 5647 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,1,0,0,0,1|0,0,0]=2 5648 B9R0.7 C[C@H](O)[C@H](O)CCC(N)=O Amb25138530 [0,1,0,0,0,1|2,0,0]=4 5649 B9R0.7 C[C@H](OCC(O)=O)C(O)=O Amb24393806 [0,1,0,0,0,1|1,0,1]=4 5650 B9R0.7 C[C@H](S)C(=O)NCC(O)=O Amb24442955 [0,1,0,0,0,1|1,0,1]=4 5651 B9R0.7 C\C(=C/CC(C)=O)\C(C)C Amb24725292 [0,1,0,0,0,1|1,0,1]=4 5652 B9R0.7 C\C(=C\CC(C)=O)\C(C)C Amb24408897 [0,1,0,0,0,1|1,0,1]=4 5653 B9R0.7 NC(CCC(O)=O)C(F)F Amb19148415 [0,1,0,0,0,1|2,0,0]=4 5654 B9R0.7 OC(=O)CSC(C(=O)O)C Amb2431034 [0,1,0,0,0,1|1,0,1]=4 5655 B9R0.21 CC(COP(O)(O)=O)CO Amb25788118 [0,1,0,0,0,1|2,0,0]=4 5656 B9R0.21 CCC(C)CCS(N)(=O)=O Amb25371078 [0,1,0,0,0,1|1,0,1]=4 5657 B9R0.21 CCC(C)CNS(=O)(=O)Cl Amb25846231 [0,1,0,0,0,1|1,0,1]=4 5658 B9R0.21 CCC(C)CNS(N)(=O)=O Amb24524674 [0,1,0,0,0,1|1,0,1]=4 5659 B9R0.21 CCC(C)COS(C)(=O)=O Amb24724645 [0,1,0,0,0,1|1,0,1]=4 5660 B9R0.21 CCC(C)SCC(C)(C)O Amb18792453 [0,1,0,0,0,1|1,0,1]=4 5661 B9R0.21 CCC(N)COP(O)(O)=O Amb24482294 [0,1,0,0,0,1|2,0,0]=4 5662 B9R0.21 CCC(N)COS(O)(=O)=O Amb24440873 [0,1,0,0,0,1|2,0,0]=4 5663 B9R0.21 CCC(N)CSP(O)(O)=O Amb25087904 [0,1,0,0,0,1|2,0,0]=4 5664 B9R0.21 CCC(N)CSS(O)(=O)=O Amb24634328 [0,1,0,0,0,1|2,0,0]=4 5665 B9R0.21 CCC(NCC(O)(C)C)C Amb17138404 [0,1,0,0,0,1|1,0,1]=4 5666 B9R0.21 CCC(O)COP(O)(O)=O Amb25687163 [0,1,0,0,0,1|2,0,0]=4 5667 B9R0.21 CC[C@H](C)COS(C)(=O)=O Amb22367081 [0,1,0,0,0,1|1,0,1]=4 5668 B9R0.21 CN[C@H](C)COS(O)(=O)=O Amb25046891 [0,1,0,0,0,1|2,0,0]=4 5669 B9R0.23 CC(=CC(O)=O)C(C)OC Amb25045184 [0,1,0,0,0,1|1,0,1]=4 5670 B9R0.23 CC(=O)CC(=O)C(C)CC Amb24544654 [0,1,0,0,0,1|1,0,0]=3 5671 B9R0.23 CC(C#N)N(C)CC(O)=O Amb18985045 [0,1,0,0,0,1|1,0,1]=4 5672 B9R0.23 CC(C#N)S(=O)CC(O)=O Amb18293472 [0,1,0,0,0,1|1,0,1]=4 5673 B9R0.23 CC(C(CC(=O)O)N)CC Amb2438880 [0,1,0,0,0,1|0,0,0]=2 5674 B9R0.23 CC(C=C)C(C)CC(O)=O Amb18643924 [0,1,0,0,0,1|0,0,2]=4 5675 B9R0.23 CC(C=C)N(C)CC(O)=O Amb19023076 [0,1,0,0,0,1|0,0,2]=4 5676 B9R0.23 CC(CC(O)=O)C(N)CC Amb25820735 [0,1,0,0,0,1|1,0,0]=3 5677 B9R0.23 CC(CC)C(Cl)OC(C)=O Amb24509719 [0,1,0,0,0,1|1,0,0]=3 5678 B9R0.23 CC(CC)C(N)CC(N)=O Amb25312995 [0,1,0,0,0,1|1,0,0]=3 5679 B9R0.23 CC(CC)C(O)CC(O)=O Amb18310690 [0,1,0,0,0,1|0,0,0]=2 5680 B9R0.23 CC(CC)[C@@H](N)CC(N)=O Amb25823252 [0,1,0,0,0,1|1,0,0]=3 5681 B9R0.23 CC(CC)[C@H](N)CC(O)=O Amb25117039 [0,1,0,0,0,1|0,0,0]=2 5682 B9R0.23 CC(CC)[C@H](O)CC(C)=C Amb25085716 [0,1,0,0,0,1|2,0,0]=4 5683 B9R0.23 CC(CN)N(C)CC(N)=O Amb24651827 [0,1,0,0,0,1|2,0,0]=4 5684 B9R0.23 CC(CN)S(=O)CC(N)=O Amb24410849 [0,1,0,0,0,1|2,0,0]=4 5685 B9R0.23 CC(CO)N(C)CC(N)=O Amb24357000 [0,1,0,0,0,1|2,0,0]=4 5686 B9R0.23 CC(CO)N(C)CC(O)=O Amb24419908 [0,1,0,0,0,1|1,0,0]=3 5687 B9R0.23 CC(NC(C)=O)C(C)CBr Amb24723278 [0,1,0,0,0,1|2,0,0]=4 5688 B9R0.23 CC(NC(C)=O)C(C)CCl Amb25147745 [0,1,0,0,0,1|2,0,0]=4 5689 B9R0.23 CC(NC(C)=O)C(Cl)CC Amb25286454 [0,1,0,0,0,1|2,0,0]=4 5690 B9R0.23 CC(NC(N)=O)C(C)CN Amb25205914 [0,1,0,0,0,1|2,0,0]=4 5691 B9R0.23 CC(NC(N)=O)C(O)CC Amb24584317 [0,1,0,0,0,1|2,0,0]=4 5692 B9R0.23 CC(OC(C)=O)C(O)CC Amb25225668 [0,1,0,0,0,1|2,0,0]=4 5693 B9R0.23 CC(OC(C)=O)[C@H](C)CCl Amb24480603 [0,1,0,0,0,1|2,0,0]=4 5694 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,1,0,0,0,1|1,0,0]=3 5695 B9R0.23 CC(OC)[C@@H](C)NC(N)=O Amb25271787 [0,1,0,0,0,1|2,0,0]=4 5696 B9R0.23 CC(OC)[C@H](C)NC(N)=O Amb24676126 [0,1,0,0,0,1|2,0,0]=4 5697 B9R0.23 CCC(=C)C(N)CC(O)=O Amb25068441 [0,1,0,0,0,1|0,0,2]=4 5698 B9R0.23 CCC(=O)[C@@H](C)CC(O)=O Amb24504994 [0,1,0,0,0,1|1,0,1]=4 5699 B9R0.23 CCC(=O)[C@H](C)CC(O)=O Amb24426900 [0,1,0,0,0,1|1,0,1]=4 5700 B9R0.23 CCC(C)C(=C)CC(O)=O Amb24451006 [0,1,0,0,0,1|0,0,0]=2 5701 B9R0.23 CCC(C)C(C)CC(O)=O Amb18304200 [0,1,0,0,0,1|0,0,0]=2 5702 B9R0.23 CCC(C)C(C)NC(C)=N Amb24466538 [0,1,0,0,0,1|2,0,0]=4 5703 B9R0.23 CCC(C)C(C)NC(N)=O Amb25261427 [0,1,0,0,0,1|1,0,0]=3 5704 B9R0.23 CCC(C)C(C)NC(N)=S Amb18792303 [0,1,0,0,0,1|1,1,0]=4 5705 B9R0.23 CCC(C)C(C)OC(N)=O Amb25732527 [0,1,0,0,0,1|1,0,0]=3 5706 B9R0.23 CCC(C)C(C)SC(N)=N Amb24398191 [0,1,0,0,0,1|2,0,0]=4 5707 B9R0.23 CCC(C)C(O)CC(C)O Amb25796350 [0,1,0,0,0,1|1,0,1]=4 5708 B9R0.23 CCC(C)N(C)CC(=C)Br Amb24560742 [0,1,0,0,0,1|2,0,0]=4 5709 B9R0.23 CCC(C)N(C)CC(=C)Cl Amb24482966 [0,1,0,0,0,1|2,0,0]=4 5710 B9R0.23 CCC(C)N(C)C[C@H](C)O Amb25790875 [0,1,0,0,0,1|1,0,1]=4 5711 B9R0.23 CCC(C)S(=O)CC(O)=O Amb18523822 [0,1,0,0,0,1|0,0,0]=2 5712 B9R0.23 CCC(Cl)C(O)CC(C)=O Amb25321887 [0,1,0,0,0,1|2,0,0]=4 5713 B9R0.23 CCC(Cl)C(O)CC(O)=O Amb25111208 [0,1,0,0,0,1|1,0,0]=3 5714 B9R0.23 CCC(N(CC(O)C)C)C Amb17334257 [0,1,0,0,0,1|1,0,1]=4 5715 B9R0.23 CCC(O)C(O)CC(O)=O Amb25132101 [0,1,0,0,0,1|1,0,0]=3 5716 B9R0.23 CCN(C)C(=O)CC(O)=O Amb18987423 [0,1,0,0,0,1|1,0,0]=3 5717 B9R0.23 CCN(C)C(C)CC(O)=O Amb22587145 [0,1,0,0,0,1|1,0,0]=3 5718 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,1,0,0,0,1|2,0,0]=4 5719 B9R0.23 CCS(=O)C(C)CC(O)=O Amb19012075 [0,1,0,0,0,1|2,0,0]=4 5720 B9R0.23 CCS(=O)N(C)CC(O)=O Amb24551440 [0,1,0,0,0,1|2,0,0]=4 5721 B9R0.23 CC[C@@H](C)[C@H](C)CC(O)=O Amb24715562 [0,1,0,0,0,1|0,0,0]=2 5722 B9R0.23 CC[C@H](C)C(=O)CC(C)O Amb25146837 [0,1,0,0,0,1|1,0,1]=4 5723 B9R0.23 CC[C@H](O)[C@H](N)CC(O)=O Amb25204323 [0,1,0,0,0,1|1,0,0]=3 5724 B9R0.23 CN(C(=O)CC(=O)N)CC Amb16233768 [0,1,0,0,0,1|2,0,0]=4 5725 B9R0.23 CN(C(=O)CC)CC(=O)O Amb1113094 [0,1,0,0,0,1|1,0,1]=4 5726 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,1,0,0,0,1|2,0,0]=4 5727 B9R0.23 CON(C)C(=O)CC(O)=O Amb18295925 [0,1,0,0,0,1|2,0,0]=4 5728 B9R0.23 C[C@@H](C=C)[C@H](C)CC(O)=O Amb25843885 [0,1,0,0,0,1|0,0,2]=4 5729 B9R0.23 C[C@@H](CC)[C@@H](O)CC(O)=O Amb25068472 [0,1,0,0,0,1|0,0,0]=2 5730 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb19944304 [0,1,0,0,0,1|0,0,0]=2 5731 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb25068405 [0,1,0,0,0,1|0,0,0]=2 5732 B9R0.23 C[C@@H](CC)[C@H](O)CC(O)=O Amb24409363 [0,1,0,0,0,1|0,0,0]=2 5733 B9R0.23 C[C@@H](CO)N(C)CC(N)=O Amb25189238 [0,1,0,0,0,1|2,0,0]=4 5734 B9R0.23 C[C@@H]([C@@H](CC(=O)O)N)CC Amb16184028 [0,1,0,0,0,1|0,0,0]=2 5735 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,1,0,0,0,1|2,0,0]=4 5736 B9R0.23 C[C@H](CC)[C@@H](N)CC(O)=O Amb25689818 [0,1,0,0,0,1|0,0,0]=2 5737 B9R0.23 C[C@H](NC(C)=O)[C@@H](O)CC Amb25730625 [0,1,0,0,0,1|2,0,0]=4 5738 B9R0.23 C[C@H](NC(C)=O)[C@H](O)CC Amb24427505 [0,1,0,0,0,1|2,0,0]=4 5739 B9R0.23 C[C@H](OC(C)=O)[C@@H](Cl)CC Amb24634242 [0,1,0,0,0,1|2,0,0]=4 5740 B9R0.23 C[C@H]([C@H](CC(=O)O)N)CC Amb16184016 [0,1,0,0,0,1|0,0,0]=2 5741 B9R0.23 C\C(=C/C(C)=O)\C(C)CC Amb25142682 [0,1,0,0,0,1|1,0,1]=4 5742 B9R0.23 C\C(=C/C(O)=O)\C(C)CC Amb18969883 [0,1,0,0,0,1|0,0,1]=3 5743 B9R0.23 C\C(=C/C)\C(N)CC(O)=O Amb24377592 [0,1,0,0,0,1|0,0,2]=4 5744 B9R0.23 C\C(=C/C)\C(O)CC(O)=O Amb18644100 [0,1,0,0,0,1|0,0,2]=4 5745 B9R0.23 C\C(=C\C(C)=O)\C(C)CC Amb25718396 [0,1,0,0,0,1|1,0,1]=4 5746 B9R0.23 N[C@@H](CC(O)=O)[C@@H](N)CO Amb25788533 [0,1,0,0,0,1|2,0,0]=4 5747 B9R0.23 OC[C@@H](O)[C@@H](O)CC(O)=O Amb24509722 [0,1,0,0,0,1|2,0,0]=4 5748 B9R0.23 OC[C@@H](O)[C@H](O)CC(O)=O Amb25258026 [0,1,0,0,0,1|2,0,0]=4 5749 B9R0.23 OC[C@H](O)[C@H](O)CC(O)=O Amb24726353 [0,1,0,0,0,1|2,0,0]=4 5750 B9R0.24 CC(C#N)NCC(=O)OC Amb17044888 [0,1,0,0,0,1|1,0,1]=4 5751 B9R0.24 CC(CC)=NNC(=O)CO Amb25800812 [0,1,0,0,0,1|1,0,1]=4 5752 B9R0.24 CC(CC)=NNC(=O)OC Amb24482880 [0,1,0,0,0,1|1,0,1]=4 5753 B9R0.24 CC(CC)CNC(=S)NN Amb10576100 [0,1,0,0,0,1|1,1,0]=4 5754 B9R0.24 CC(CC)NCC(=C)CC Amb24718693 [0,1,0,0,0,1|2,0,0]=4 5755 B9R0.24 CC(CC)NCC(O)CC Amb24649552 [0,1,0,0,0,1|1,0,1]=4 5756 B9R0.24 CC(CC)NCC(O)CN Amb18064937 [0,1,0,0,0,1|1,0,1]=4 5757 B9R0.24 CC(CC)NC[C@H](O)CO Amb24461491 [0,1,0,0,0,1|0,0,2]=4 5758 B9R0.24 CC(CC)OCC(N)CO Amb24619673 [0,1,0,0,0,1|1,0,1]=4 5759 B9R0.24 CC(CC)OCC(O)CBr Amb24479485 [0,1,0,0,0,1|1,0,1]=4 5760 B9R0.24 CC(CC)OCC(O)CC Amb25271058 [0,1,0,0,0,1|1,0,1]=4 5761 B9R0.24 CC(CC)OCC(O)CCl Amb24581833 [0,1,0,0,0,1|1,0,1]=4 5762 B9R0.24 CC(CC)OC[C@@H](N)CO Amb24538009 [0,1,0,0,0,1|1,0,1]=4 5763 B9R0.24 CC(CC)OC[C@H](O)CN Amb24431923 [0,1,0,0,0,1|1,0,1]=4 5764 B9R0.24 CC(CC)SCC(=O)CC Amb18800476 [0,1,0,0,0,1|1,0,0]=3 5765 B9R0.24 CC(CC)SCC(N)CO Amb24509500 [0,1,0,0,0,1|1,0,1]=4 5766 B9R0.24 CC(CC)SCC(O)CBr Amb24479487 [0,1,0,0,0,1|1,0,1]=4 5767 B9R0.24 CC(CC)SCC(O)CC Amb18792452 [0,1,0,0,0,1|1,0,1]=4 5768 B9R0.24 CC(CC)SCC(O)CCl Amb24334953 [0,1,0,0,0,1|1,0,1]=4 5769 B9R0.24 CC(CC)SCC(O)CF Amb24736089 [0,1,0,0,0,1|1,0,1]=4 5770 B9R0.24 CC(CC)SC[C@H](O)CC Amb25782195 [0,1,0,0,0,1|1,0,1]=4 5771 B9R0.24 CC(CCC(=O)NN)CN Amb25287777 [0,1,0,0,0,1|2,0,0]=4 5772 B9R0.24 CC(CCC(O)CC)CC Amb24388933 [0,1,0,0,0,1|1,0,1]=4 5773 B9R0.24 CC(CN)CCC(=O)C#C Amb25138223 [0,1,0,0,0,1|2,0,0]=4 5774 B9R0.24 CC(CN)CCC(=O)C=C Amb24601148 [0,1,0,0,0,1|2,0,0]=4 5775 B9R0.24 CC(CN)CCC(=O)NO Amb25145597 [0,1,0,0,0,1|1,0,0]=3 5776 B9R0.24 CC(CNC(=N)CC)CC Amb24476271 [0,1,0,0,0,1|2,0,0]=4 5777 B9R0.24 CC(CNC(=O)CC)CC Amb24628624 [0,1,0,0,0,1|1,0,0]=3 5778 B9R0.24 CC(CNC(=O)CN)CN Amb25806994 [0,1,0,0,0,1|2,0,0]=4 5779 B9R0.24 CC(CNC(=O)CO)CO Amb25127228 [0,1,0,0,0,1|1,0,0]=3 5780 B9R0.24 CC(CNC(=O)NC)NC Amb24379217 [0,1,0,0,0,1|2,0,0]=4 5781 B9R0.24 CC(CNC(=O)OC)OC Amb24333803 [0,1,0,0,0,1|1,0,0]=3 5782 B9R0.24 CC(CO)CNC(=O)C#C Amb24509725 [0,1,0,0,0,1|2,0,0]=4 5783 B9R0.24 CC(CO)COC(=O)C=C Amb24632595 [0,1,0,0,0,1|2,0,0]=4 5784 B9R0.24 CC(CO)NCC(N)=NO Amb24566953 [0,1,0,0,0,1|2,0,0]=4 5785 B9R0.24 CC(CO)SCC(=O)NN Amb25245928 [0,1,0,0,0,1|2,0,0]=4 5786 B9R0.24 CC(COC(=O)CC)CC Amb24061296 [0,1,0,0,0,1|1,0,0]=3 5787 B9R0.24 CC(COC(=O)CO)C#N Amb24354132 [0,1,0,0,0,1|1,0,1]=4 5788 B9R0.24 CC(\C=C\C(=O)OC)OC Amb24608486 [0,1,0,0,0,1|1,0,1]=4 5789 B9R0.24 CCC(=C)CNC(=O)OC Amb24339405 [0,1,0,0,0,1|0,0,2]=4 5790 B9R0.24 CCC(=O)CCC(=O)OC Amb24369355 [0,1,0,0,0,1|1,0,1]=4 5791 B9R0.24 CCC(=O)CCC(C)CO Amb25146971 [0,1,0,0,0,1|2,0,0]=4 5792 B9R0.24 CCC(=O)CCC(C)OC Amb25147751 [0,1,0,0,0,1|2,0,0]=4 5793 B9R0.24 CCC(=O)CNC(=O)OC Amb25782037 [0,1,0,0,0,1|1,0,1]=4 5794 B9R0.24 CCC(=O)COC(C)CCl Amb25111994 [0,1,0,0,0,1|2,0,0]=4 5795 B9R0.24 CCC(=O)NCC(=O)NO Amb24529194 [0,1,0,0,0,1|1,0,1]=4 5796 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,1,0,0,0,1|2,0,0]=4 5797 B9R0.24 CCC(=O)NCC(C)OC Amb25692806 [0,1,0,0,0,1|2,0,0]=4 5798 B9R0.24 CCC(=O)NC[C@@H](O)CC Amb24447062 [0,1,0,0,0,1|2,0,0]=4 5799 B9R0.24 CCC(=O)OCC(C)CCl Amb25367344 [0,1,0,0,0,1|2,0,0]=4 5800 B9R0.24 CCC(=O)OCC(C)CO Amb24541857 [0,1,0,0,0,1|2,0,0]=4 5801 B9R0.24 CCC(=O)OCC(F)CC Amb25058063 [0,1,0,0,0,1|2,0,0]=4 5802 B9R0.24 CCC(=O)OCC(O)CC Amb24449905 [0,1,0,0,0,1|2,0,0]=4 5803 B9R0.24 CCC(=O)OC[C@@H](O)CC Amb24481128 [0,1,0,0,0,1|2,0,0]=4 5804 B9R0.24 CCC(=O)OC[C@H](C)CO Amb25345171 [0,1,0,0,0,1|2,0,0]=4 5805 B9R0.24 CCC(=O)OC[C@H](O)CC Amb25259058 [0,1,0,0,0,1|2,0,0]=4 5806 B9R0.24 CCC(Br)\C=C\C(=O)OC Amb25277217 [0,1,0,0,0,1|1,0,1]=4 5807 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,1,0,0,0,1|0,0,1]=3 5808 B9R0.24 CCC(C)CCC(=O)NC Amb24482921 [0,1,0,0,0,1|1,0,0]=3 5809 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,1,0,0,0,1|0,0,0]=2 5810 B9R0.24 CCC(C)CCC(C)CO Amb22641860 [0,1,0,0,0,1|1,0,1]=4 5811 B9R0.24 CCC(C)CNC(=O)C=C Amb25238655 [0,1,0,0,0,1|1,0,0]=3 5812 B9R0.24 CCC(C)CNC(=O)CBr Amb23512819 [0,1,0,0,0,1|1,0,0]=3 5813 B9R0.24 CCC(C)CNC(=O)CCl Amb18798260 [0,1,0,0,0,1|1,0,0]=3 5814 B9R0.24 CCC(C)CNC(=O)CN Amb19028765 [0,1,0,0,0,1|1,0,0]=3 5815 B9R0.24 CCC(C)CNC(=O)CS Amb24445028 [0,1,0,0,0,1|0,1,0]=3 5816 B9R0.24 CCC(C)CNC(=O)NN Amb24442838 [0,1,0,0,0,1|1,0,0]=3 5817 B9R0.24 CCC(C)CNC(=O)OC Amb25054721 [0,1,0,0,0,1|0,0,0]=2 5818 B9R0.24 CCC(C)COC(=O)C=C Amb17934097 [0,1,0,0,0,1|1,0,0]=3 5819 B9R0.24 CCC(C)COC(=O)CBr Amb25799480 [0,1,0,0,0,1|1,0,0]=3 5820 B9R0.24 CCC(C)CSC(C)CO Amb25146973 [0,1,0,0,0,1|1,0,1]=4 5821 B9R0.24 CCC(C)CSC(N)=NC Amb25189655 [0,1,0,0,0,1|2,0,0]=4 5822 B9R0.24 CCC(C)C\C=C(/C)\C=O Amb24646940 [0,1,0,0,0,1|1,0,0]=3 5823 B9R0.24 CCC(C)NCC(=O)C#C Amb25679968 [0,1,0,0,0,1|1,0,0]=3 5824 B9R0.24 CCC(C)NCC(=O)C=C Amb24411222 [0,1,0,0,0,1|1,0,0]=3 5825 B9R0.24 CCC(C)NCC(=O)NN Amb25338630 [0,1,0,0,0,1|1,0,0]=3 5826 B9R0.24 CCC(C)NCC(=O)NO Amb24668363 [0,1,0,0,0,1|0,0,0]=2 5827 B9R0.24 CCC(C)NCC(C)CO Amb25335107 [0,1,0,0,0,1|1,0,1]=4 5828 B9R0.24 CCC(C)NCC(C)OC Amb24641117 [0,1,0,0,0,1|1,0,1]=4 5829 B9R0.24 CCC(C)NCC(N)=NO Amb25055504 [0,1,0,0,0,1|1,0,0]=3 5830 B9R0.24 CCC(C)OCC(=C)CCl Amb24703476 [0,1,0,0,0,1|2,0,0]=4 5831 B9R0.24 CCC(C)OCC(=C)CN Amb24748994 [0,1,0,0,0,1|2,0,0]=4 5832 B9R0.24 CCC(C)OCC(=C)CS Amb25136142 [0,1,0,0,0,1|1,1,0]=4 5833 B9R0.24 CCC(C)OCC(=O)NC Amb24482829 [0,1,0,0,0,1|1,0,0]=3 5834 B9R0.24 CCC(C)OCC(=O)NN Amb19960445 [0,1,0,0,0,1|1,0,0]=3 5835 B9R0.24 CCC(C)OCC(=O)NO Amb25220786 [0,1,0,0,0,1|0,0,0]=2 5836 B9R0.24 CCC(C)OCC(C)CO Amb25044070 [0,1,0,0,0,1|1,0,1]=4 5837 B9R0.24 CCC(C)ONC(=O)CO Amb24705434 [0,1,0,0,0,1|1,0,0]=3 5838 B9R0.24 CCC(C)SCC(=C)CCl Amb25788394 [0,1,0,0,0,1|2,0,0]=4 5839 B9R0.24 CCC(C)SCC(=C)CN Amb24388772 [0,1,0,0,0,1|2,0,0]=4 5840 B9R0.24 CCC(C)SCC(=C)CS Amb24673391 [0,1,0,0,0,1|1,1,0]=4 5841 B9R0.24 CCC(C)SCC(=O)C#C Amb25809269 [0,1,0,0,0,1|1,0,0]=3 5842 B9R0.24 CCC(C)SCC(=O)NN Amb24658136 [0,1,0,0,0,1|1,0,0]=3 5843 B9R0.24 CCC(C)SCC(C)=CCl Amb24482757 [0,1,0,0,0,1|2,0,0]=4 5844 B9R0.24 CCC(C)SCC(N)=NN Amb25749056 [0,1,0,0,0,1|2,0,0]=4 5845 B9R0.24 CCC(C)\C=C\C(=O)CCl Amb24480648 [0,1,0,0,0,1|1,0,1]=4 5846 B9R0.24 CCC(Cl)\C=C\C(=O)OC Amb25320866 [0,1,0,0,0,1|1,0,1]=4 5847 B9R0.24 CCC(N)CCC(=O)C=C Amb25201206 [0,1,0,0,0,1|2,0,0]=4 5848 B9R0.24 CCC(N)CCC(=O)NN Amb24726520 [0,1,0,0,0,1|2,0,0]=4 5849 B9R0.24 CCC(N)CNC(=O)C#C Amb24334161 [0,1,0,0,0,1|2,0,0]=4 5850 B9R0.24 CCC(N)CNC(=O)C=C Amb24476780 [0,1,0,0,0,1|2,0,0]=4 5851 B9R0.24 CCC(N)CNC(=O)OC Amb24427801 [0,1,0,0,0,1|1,0,0]=3 5852 B9R0.24 CCC(NCC(CO)O)C Amb17308622 [0,1,0,0,0,1|0,0,2]=4 5853 B9R0.24 CCC(O)C#CC(=O)OC Amb22043388 [0,1,0,0,0,1|1,0,1]=4 5854 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,1,0,0,0,1|1,0,0]=3 5855 B9R0.24 CCC(O)CNC(=O)C=C Amb24389176 [0,1,0,0,0,1|2,0,0]=4 5856 B9R0.24 CCC(O)CNC(=O)CCl Amb24480520 [0,1,0,0,0,1|2,0,0]=4 5857 B9R0.24 CCC(O)COC(=O)C=C Amb25381429 [0,1,0,0,0,1|2,0,0]=4 5858 B9R0.24 CCN(C)CCC(=O)NN Amb24549267 [0,1,0,0,0,1|2,0,0]=4 5859 B9R0.24 CCN(C)\C=C\C(=O)OC Amb25725232 [0,1,0,0,0,1|1,0,1]=4 5860 B9R0.24 CCN(O)CCC(=O)OC Amb24763933 [0,1,0,0,0,1|2,0,0]=4 5861 B9R0.24 CCS(=O)CCC(=O)OC Amb18788300 [0,1,0,0,0,1|2,0,0]=4 5862 B9R0.24 CCS(=O)NCC(=O)OC Amb25273849 [0,1,0,0,0,1|2,0,0]=4 5863 B9R0.24 CC[C@@H](N)COC(=O)CN Amb25147512 [0,1,0,0,0,1|2,0,0]=4 5864 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,1,0,0,0,1|1,0,0]=3 5865 B9R0.24 CC[C@@H](O)COC(=O)C#C Amb24481173 [0,1,0,0,0,1|2,0,0]=4 5866 B9R0.24 CC[C@H](C)CCC(=C)C=O Amb25075582 [0,1,0,0,0,1|1,0,0]=3 5867 B9R0.24 CC[C@H](C)CCC(C)CO Amb25676351 [0,1,0,0,0,1|1,0,1]=4 5868 B9R0.24 CC[C@H](C)CNC(=O)OC Amb24549768 [0,1,0,0,0,1|0,0,0]=2 5869 B9R0.24 CC[C@H](C)CNC(=S)NN Amb24479118 [0,1,0,0,0,1|1,1,0]=4 5870 B9R0.24 CC[C@H](C)COC(=O)CBr Amb24477461 [0,1,0,0,0,1|1,0,0]=3 5871 B9R0.24 CC[C@H](O)C#CC(=O)OC Amb25332399 [0,1,0,0,0,1|1,0,1]=4 5872 B9R0.24 CC[C@H](O)CCC(=O)OC Amb24377641 [0,1,0,0,0,1|1,0,0]=3 5873 B9R0.24 CC[C@H](O)COC(=O)C#C Amb24481174 [0,1,0,0,0,1|2,0,0]=4 5874 B9R0.24 CC[C@H](O)\C=C\C(=O)OC Amb25320330 [0,1,0,0,0,1|1,0,1]=4 5875 B9R0.24 CN(CCC(=O)CC)CC Amb25225879 [0,1,0,0,0,1|2,0,0]=4 5876 B9R0.24 CNC(=O)CCC(C)OC Amb25337100 [0,1,0,0,0,1|2,0,0]=4 5877 B9R0.24 CNC(=O)CCC(C)SC Amb25720834 [0,1,0,0,0,1|2,0,0]=4 5878 B9R0.24 CNC(=O)CSC(C)CO Amb24623354 [0,1,0,0,0,1|2,0,0]=4 5879 B9R0.24 CNC(=O)NCC(C)CN Amb18908393 [0,1,0,0,0,1|2,0,0]=4 5880 B9R0.24 CNC(=O)NCC(C)OC Amb25704552 [0,1,0,0,0,1|2,0,0]=4 5881 B9R0.24 CNC(=O)NCC(C)SC Amb25706035 [0,1,0,0,0,1|2,0,0]=4 5882 B9R0.24 CNC(=O)NCC(O)CC Amb25220048 [0,1,0,0,0,1|2,0,0]=4 5883 B9R0.24 CNC(=O)OCC(C)CBr Amb25680259 [0,1,0,0,0,1|2,0,0]=4 5884 B9R0.24 CNC(C)CNC(=O)C#C Amb25101228 [0,1,0,0,0,1|2,0,0]=4 5885 B9R0.24 CNC(C)CNC(=O)C=C Amb25027841 [0,1,0,0,0,1|2,0,0]=4 5886 B9R0.24 CNC(C)CNC(=O)CC Amb25047872 [0,1,0,0,0,1|2,0,0]=4 5887 B9R0.24 CNC(C)CNC(=O)OC Amb24601169 [0,1,0,0,0,1|1,0,0]=3 5888 B9R0.24 COC(=O)CCC(Br)CBr Amb25343381 [0,1,0,0,0,1|2,0,0]=4 5889 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,1,0,0,0,1|1,0,1]=4 5890 B9R0.24 COC(=O)CCC(C)CBr Amb25032347 [0,1,0,0,0,1|1,0,0]=3 5891 B9R0.24 COC(=O)CCC(C)SC Amb24709195 [0,1,0,0,0,1|1,0,0]=3 5892 B9R0.24 COC(=O)CCC(Cl)CCl Amb25241534 [0,1,0,0,0,1|2,0,0]=4 5893 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,1,0,0,0,1|2,0,0]=4 5894 B9R0.24 COC(=O)CCC(O)CBr Amb25044783 [0,1,0,0,0,1|2,0,0]=4 5895 B9R0.24 COC(=O)CCC(O)CN Amb25857935 [0,1,0,0,0,1|2,0,0]=4 5896 B9R0.24 COC(=O)CCC(O)CO Amb25204294 [0,1,0,0,0,1|2,0,0]=4 5897 B9R0.24 COC(=O)CC[C@@H](C)C=O Amb25104821 [0,1,0,0,0,1|1,0,1]=4 5898 B9R0.24 COC(=O)CC[C@@H](O)CN Amb24744697 [0,1,0,0,0,1|2,0,0]=4 5899 B9R0.24 COC(=O)CNC(C)C=C Amb25693636 [0,1,0,0,0,1|0,0,2]=4 5900 B9R0.24 COC(=O)CNC(C)CN Amb25299776 [0,1,0,0,0,1|1,0,0]=3 5901 B9R0.24 COC(=O)COC(C)CN Amb24480966 [0,1,0,0,0,1|1,0,0]=3 5902 B9R0.24 COC(=O)CSC(C)C#N Amb18800109 [0,1,0,0,0,1|1,0,1]=4 5903 B9R0.24 COC(=O)CSC(C)CO Amb25070989 [0,1,0,0,0,1|1,0,0]=3 5904 B9R0.24 COC(=O)NCC(C)CN Amb18313166 [0,1,0,0,0,1|1,0,0]=3 5905 B9R0.24 COC(=O)NCC(C)SC Amb25206873 [0,1,0,0,0,1|1,0,0]=3 5906 B9R0.24 COC(=O)NCC(Cl)CCl Amb25106564 [0,1,0,0,0,1|2,0,0]=4 5907 B9R0.24 COC(=O)NCC(O)CN Amb24589991 [0,1,0,0,0,1|2,0,0]=4 5908 B9R0.24 COC(=O)NOC(C)CC Amb24524318 [0,1,0,0,0,1|1,0,0]=3 5909 B9R0.24 COC(=O)OCC(=O)CC Amb25059695 [0,1,0,0,0,1|1,0,1]=4 5910 B9R0.24 COC(=O)OCC(Cl)CF Amb25211615 [0,1,0,0,0,1|2,0,0]=4 5911 B9R0.24 COC(=O)OCC(F)CCl Amb25774919 [0,1,0,0,0,1|2,0,0]=4 5912 B9R0.24 COC(=O)\C=C\C(C)CN Amb25229568 [0,1,0,0,0,1|1,0,1]=4 5913 B9R0.24 COC(=O)\C=C\[C@H](C)CO Amb24749656 [0,1,0,0,0,1|1,0,1]=4 5914 B9R0.24 COC(=S)SCC(C)CO Amb24723366 [0,1,0,0,0,1|1,1,0]=4 5915 B9R0.24 COC(C)CNC(=O)C=C Amb24471961 [0,1,0,0,0,1|2,0,0]=4 5916 B9R0.24 COC(C)CNC(=O)CCl Amb24700874 [0,1,0,0,0,1|2,0,0]=4 5917 B9R0.24 COC(C)CNC(=O)NN Amb24446351 [0,1,0,0,0,1|2,0,0]=4 5918 B9R0.24 COC(C)COC(=O)CO Amb24752113 [0,1,0,0,0,1|1,0,0]=3 5919 B9R0.24 CSC(C)CCC(=O)NN Amb25340735 [0,1,0,0,0,1|2,0,0]=4 5920 B9R0.24 CSC(C)CCC(=O)NO Amb24538243 [0,1,0,0,0,1|1,0,0]=3 5921 B9R0.24 CSC(C)CNC(=O)CN Amb25360470 [0,1,0,0,0,1|2,0,0]=4 5922 B9R0.24 CSC(C)CNC(=O)CO Amb25322962 [0,1,0,0,0,1|1,0,0]=3 5923 B9R0.24 CSC(C)CNC(=O)CS Amb24738132 [0,1,0,0,0,1|1,1,0]=4 5924 B9R0.24 CSC(C)CNC(N)=NO Amb25759979 [0,1,0,0,0,1|2,0,0]=4 5925 B9R0.24 C[C@@H](CCC(=O)CC)CC Amb24645778 [0,1,0,0,0,1|1,0,0]=3 5926 B9R0.24 C[C@@H](CCC(O)CC)CC Amb25686198 [0,1,0,0,0,1|1,0,1]=4 5927 B9R0.24 C[C@H](CCC(=O)CC)CC Amb25094462 [0,1,0,0,0,1|1,0,0]=3 5928 B9R0.24 C[C@H](CCC(O)CO)CC Amb25332161 [0,1,0,0,0,1|0,0,2]=4 5929 B9R0.24 C[C@H](CC[C@@H](O)CO)CC Amb24592097 [0,1,0,0,0,1|0,0,2]=4 5930 B9R0.24 OC(COC(=O)CO)CO Amb25854328 [0,1,0,0,0,1|2,0,0]=4 5931 B9R0.42 C=C(CC(N)CN)C(O)=O Amb24502423 [0,1,0,0,0,1|2,0,0]=4 5932 B9R0.42 CC(=C)C(=O)CC(C)CC Amb25064630 [0,1,0,0,0,1|2,0,0]=4 5933 B9R0.42 CC(=O)C(=O)CC(C)CC Amb24707036 [0,1,0,0,0,1|1,0,0]=3 5934 B9R0.42 CC(C(=O)O)NC(=O)CC Amb1116933 [0,1,0,0,0,1|1,0,1]=4 5935 B9R0.42 CC(CC(Br)C(O)=O)CN Amb24478240 [0,1,0,0,0,1|1,0,0]=3 5936 B9R0.42 CC(CC(C)C#N)C(O)=O Amb25694006 [0,1,0,0,0,1|1,0,1]=4 5937 B9R0.42 CC(CC(C)C=C)C(O)=O Amb18643935 [0,1,0,0,0,1|0,0,2]=4 5938 B9R0.42 CC(CC(C)C=O)C(O)=O Amb18644134 [0,1,0,0,0,1|1,0,1]=4 5939 B9R0.42 CC(CC(F)C(O)=O)CN Amb25265347 [0,1,0,0,0,1|1,0,0]=3 5940 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [0,1,0,0,0,1|1,0,0]=3 5941 B9R0.42 CC(CC(N)C(C)=O)CC Amb25747386 [0,1,0,0,0,1|1,0,0]=3 5942 B9R0.42 CC(CC(N)C(N)=O)OC Amb25349298 [0,1,0,0,0,1|2,0,0]=4 5943 B9R0.42 CC(CC(N)C(O)=O)C#C Amb25067277 [0,1,0,0,0,1|0,0,2]=4 5944 B9R0.42 CC(CC(N)C(O)=O)C#N Amb25262927 [0,1,0,0,0,1|1,0,1]=4 5945 B9R0.42 CC(CC(N)C(O)=O)C=C Amb25778211 [0,1,0,0,0,1|0,0,2]=4 5946 B9R0.42 CC(CC(N)C(O)=O)CC Amb18313985 [0,1,0,0,0,1|0,0,0]=2 5947 B9R0.42 CC(CC(N)C(O)=O)CC Amb20667726 [0,1,0,0,0,1|0,0,0]=2 5948 B9R0.42 CC(CC(N)C(O)=O)CCl Amb24480574 [0,1,0,0,0,1|1,0,0]=3 5949 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [0,1,0,0,0,1|1,0,0]=3 5950 B9R0.42 CC(CC(N)C(O)=O)NC Amb24711878 [0,1,0,0,0,1|1,0,0]=3 5951 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [0,1,0,0,0,1|1,0,0]=3 5952 B9R0.42 CC(CC(N)C(O)=O)SC Amb24365891 [0,1,0,0,0,1|1,0,0]=3 5953 B9R0.42 CC(CC(O)C(O)=O)CC Amb25849308 [0,1,0,0,0,1|0,0,0]=2 5954 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,1,0,0,0,1|2,0,0]=4 5955 B9R0.42 CC(CC(S)C(O)=O)CC Amb18798152 [0,1,0,0,0,1|0,0,0]=2 5956 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [0,1,0,0,0,1|1,0,0]=3 5957 B9R0.42 CC(CC)OC(F)C(O)=O Amb25043871 [0,1,0,0,0,1|0,0,0]=2 5958 B9R0.42 CC(CF)NC(=O)C(O)=O Amb24591520 [0,1,0,0,0,1|1,0,1]=4 5959 B9R0.42 CC(CN(C)C(N)=O)CN Amb18292980 [0,1,0,0,0,1|2,0,0]=4 5960 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [0,1,0,0,0,1|1,0,0]=3 5961 B9R0.42 CC(CN)CN(C)C(C)=O Amb18523773 [0,1,0,0,0,1|2,0,0]=4 5962 B9R0.42 CC(CN)\C=C(\F)/C(O)=O Amb25213358 [0,1,0,0,0,1|1,0,1]=4 5963 B9R0.42 CC(CO)CN(C)C(C)=O Amb25136734 [0,1,0,0,0,1|2,0,0]=4 5964 B9R0.42 CC(CO)NC(=O)C(O)=O Amb25106609 [0,1,0,0,0,1|1,0,1]=4 5965 B9R0.42 CC(C[C@@H](N)C(O)=O)CC Amb25127143 [0,1,0,0,0,1|0,0,0]=2 5966 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [0,1,0,0,0,1|1,0,0]=3 5967 B9R0.42 CC(C[C@@H](N)C(O)=O)SC Amb24692660 [0,1,0,0,0,1|1,0,0]=3 5968 B9R0.42 CC(C[C@H](N)C(O)=O)C#C Amb25214668 [0,1,0,0,0,1|0,0,2]=4 5969 B9R0.42 CC(C[C@H](N)C(O)=O)CCl Amb24479195 [0,1,0,0,0,1|1,0,0]=3 5970 B9R0.42 CC(NC(C)C#C)C(O)=O Amb25088637 [0,1,0,0,0,1|0,0,2]=4 5971 B9R0.42 CC(NC(C)C=C)C(O)=O Amb18310595 [0,1,0,0,0,1|0,0,2]=4 5972 B9R0.42 CC(NC(C)CF)C(N)=O Amb25333137 [0,1,0,0,0,1|2,0,0]=4 5973 B9R0.42 CC(NC(C)CO)C(O)=O Amb18315378 [0,1,0,0,0,1|1,0,0]=3 5974 B9R0.42 CC(OC(C)C#N)C(O)=O Amb25185255 [0,1,0,0,0,1|1,0,1]=4 5975 B9R0.42 CC(OC(C)CN)C(C)=O Amb18110684 [0,1,0,0,0,1|2,0,0]=4 5976 B9R0.42 CC(OC(C)CN)C(N)=O Amb24359073 [0,1,0,0,0,1|2,0,0]=4 5977 B9R0.42 CC(OC(C)CN)C(O)=O Amb18110542 [0,1,0,0,0,1|1,0,0]=3 5978 B9R0.42 CC(SC(C)C#N)C(O)=O Amb18292357 [0,1,0,0,0,1|1,0,1]=4 5979 B9R0.42 CC(SC(C)C=C)C(O)=O Amb18310581 [0,1,0,0,0,1|0,0,2]=4 5980 B9R0.42 CC(SC(C)CN)C(N)=O Amb25707956 [0,1,0,0,0,1|2,0,0]=4 5981 B9R0.42 CC(SC(C)CN)C(O)=O Amb25096975 [0,1,0,0,0,1|1,0,0]=3 5982 B9R0.42 CC(SC(C)CO)C(O)=O Amb24687156 [0,1,0,0,0,1|1,0,0]=3 5983 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [0,1,0,0,0,1|0,0,2]=4 5984 B9R0.42 CCC(=C)CC(O)C(O)=O Amb25200851 [0,1,0,0,0,1|0,0,2]=4 5985 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [0,1,0,0,0,1|0,0,2]=4 5986 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [0,1,0,0,0,1|0,0,2]=4 5987 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,1,0,0,0,1|1,0,1]=4 5988 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,1,0,0,0,1|1,0,1]=4 5989 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [0,1,0,0,0,1|1,0,1]=4 5990 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,1,0,0,0,1|1,0,1]=4 5991 B9R0.42 CCC(=O)N[C@@H](C)C(O)=O Amb22901053 [0,1,0,0,0,1|1,0,1]=4 5992 B9R0.42 CCC(=O)OC(C)C(O)=O Amb18644241 [0,1,0,0,0,1|1,0,1]=4 5993 B9R0.42 CCC(C)CC(C)C(C)=O Amb25056188 [0,1,0,0,0,1|1,0,0]=3 5994 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [0,1,0,0,0,1|1,0,1]=4 5995 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [0,1,0,0,0,1|0,0,0]=2 5996 B9R0.42 CCC(C)CC(O)C(C)O Amb25265593 [0,1,0,0,0,1|1,0,1]=4 5997 B9R0.42 CCC(C)NC(=N)C(O)=O Amb25366732 [0,1,0,0,0,1|0,0,1]=3 5998 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [0,1,0,0,0,1|0,0,0]=2 5999 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [0,1,0,0,0,1|0,0,0]=2 6000 B9R0.42 CCC(C)OC(=O)C(=O)Cl Amb25140154 [0,1,0,0,0,1|1,0,1]=4 6001 B9R0.42 CCC(C)OC(=O)C(O)=O Amb24629707 [0,1,0,0,0,1|0,0,1]=3 6002 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [0,1,0,0,0,1|0,0,0]=2 6003 B9R0.42 CCC(C)SC(C)C(N)=N Amb18797918 [0,1,0,0,0,1|2,0,0]=4 6004 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [0,1,0,0,0,1|1,0,0]=3 6005 B9R0.42 CCC(C)\C=C(/Cl)\C(O)=O Amb24650875 [0,1,0,0,0,1|0,0,1]=3 6006 B9R0.42 CCC(C)\C=C(\F)/C(O)=O Amb25376745 [0,1,0,0,0,1|0,0,1]=3 6007 B9R0.42 CCC(Cl)CC(N)C(O)=O Amb24374416 [0,1,0,0,0,1|1,0,0]=3 6008 B9R0.42 CCC(NC(=O)C(=O)C)C Amb17399880 [0,1,0,0,0,1|1,0,1]=4 6009 B9R0.42 CCC(O)CC(N)C(O)=O Amb24117068 [0,1,0,0,0,1|1,0,0]=3 6010 B9R0.42 CCC(O)C[C@H](N)C(O)=O Amb24759913 [0,1,0,0,0,1|1,0,0]=3 6011 B9R0.42 CCN(C)CC(=C)C(O)=O Amb24681944 [0,1,0,0,0,1|1,0,0]=3 6012 B9R0.42 CCN(C)CC(Cl)C(O)=O Amb25713950 [0,1,0,0,0,1|1,0,0]=3 6013 B9R0.42 CCN(C)CC(O)C(O)=O Amb25367420 [0,1,0,0,0,1|1,0,0]=3 6014 B9R0.42 CCN(C)NC(C)C(N)=O Amb24419421 [0,1,0,0,0,1|2,0,0]=4 6015 B9R0.42 CCN(O)CC(=C)C(O)=O Amb24622746 [0,1,0,0,0,1|2,0,0]=4 6016 B9R0.42 CCN(O)CC(O)C(O)=O Amb24699297 [0,1,0,0,0,1|2,0,0]=4 6017 B9R0.42 CCS(=N)CC(N)C(O)=O Amb25046702 [0,1,0,0,0,1|2,0,0]=4 6018 B9R0.42 CCS(=N)C[C@H](N)C(O)=O Amb24502175 [0,1,0,0,0,1|2,0,0]=4 6019 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [0,1,0,0,0,1|2,0,0]=4 6020 B9R0.42 CCS(=O)N[C@H](C)C(O)=O Amb24572538 [0,1,0,0,0,1|2,0,0]=4 6021 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [0,1,0,0,0,1|0,0,0]=2 6022 B9R0.42 CC[C@@H](F)C[C@H](N)C(O)=O Amb25147291 [0,1,0,0,0,1|1,0,0]=3 6023 B9R0.42 CC[C@H](C)CC(=C)C(O)=O Amb25367282 [0,1,0,0,0,1|0,0,0]=2 6024 B9R0.42 CC[C@H](C)CC(C)C(C)=O Amb25821401 [0,1,0,0,0,1|1,0,0]=3 6025 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [0,1,0,0,0,1|0,0,0]=2 6026 B9R0.42 CNC(C)CC(C)C(O)=O Amb25291515 [0,1,0,0,0,1|1,0,0]=3 6027 B9R0.42 CNC(C)CN(C)C(C)=O Amb24096771 [0,1,0,0,0,1|2,0,0]=4 6028 B9R0.42 COC(C)\C=C(\F)/C(O)=O Amb25263824 [0,1,0,0,0,1|1,0,1]=4 6029 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,1,0,0,0,1|1,0,0]=3 6030 B9R0.42 C[C@@H](CF)NC(=O)C(O)=O Amb25213683 [0,1,0,0,0,1|1,0,1]=4 6031 B9R0.42 C[C@@H](C[C@@H](C)C=C)C(O)=O Amb25756960 [0,1,0,0,0,1|0,0,2]=4 6032 B9R0.42 C[C@@H](C[C@@H](N)C(O)=O)CC Amb25844637 [0,1,0,0,0,1|0,0,0]=2 6033 B9R0.42 C[C@@H](C[C@H](C)C=C)C(O)=O Amb25757917 [0,1,0,0,0,1|0,0,2]=4 6034 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)C=C Amb25727679 [0,1,0,0,0,1|0,0,2]=4 6035 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CC Amb24619367 [0,1,0,0,0,1|0,0,0]=2 6036 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CF Amb25147611 [0,1,0,0,0,1|1,0,0]=3 6037 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,1,0,0,0,1|2,0,0]=4 6038 B9R0.42 C[C@@H](NC(C)CN)C(O)=O Amb25291159 [0,1,0,0,0,1|1,0,0]=3 6039 B9R0.42 C[C@@H](N[C@@H](C)C#N)C(O)=O Amb24479136 [0,1,0,0,0,1|1,0,1]=4 6040 B9R0.42 C[C@H](C[C@@H](N)C(O)=O)CC Amb25738618 [0,1,0,0,0,1|0,0,0]=2 6041 B9R0.42 C[C@H](C[C@H](C)C=C)C(O)=O Amb24352097 [0,1,0,0,0,1|0,0,2]=4 6042 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,1,0,0,0,1|1,0,0]=3 6043 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C#N Amb24529159 [0,1,0,0,0,1|1,0,1]=4 6044 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C=C Amb24561660 [0,1,0,0,0,1|0,0,2]=4 6045 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CC Amb25662528 [0,1,0,0,0,1|0,0,0]=2 6046 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CF Amb25378691 [0,1,0,0,0,1|1,0,0]=3 6047 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [0,1,0,0,0,1|1,0,0]=3 6048 B9R0.42 C[C@H](C[C@H](N)C(O)=O)SC Amb25848560 [0,1,0,0,0,1|1,0,0]=3 6049 B9R0.42 C[C@H](C[C@H](O)C(O)=O)CC Amb24446982 [0,1,0,0,0,1|0,0,0]=2 6050 B9R0.42 C[C@H](OC(C)C#N)C(O)=O Amb25265720 [0,1,0,0,0,1|1,0,1]=4 6051 B9R0.42 C[C@H](OC(C)C=C)C(O)=O Amb25185256 [0,1,0,0,0,1|0,0,2]=4 6052 B9R0.42 C\C(=C/C(C)CC)\C(C)=O Amb25146534 [0,1,0,0,0,1|1,0,1]=4 6053 B9R0.42 C\C(=C/C(C)CC)\C(O)=O Amb18643945 [0,1,0,0,0,1|0,0,1]=3 6054 B9R0.42 C\C(=C/[C@@H](C)CC)\C(C)=O Amb24586848 [0,1,0,0,0,1|1,0,1]=4 6055 B9R0.42 C\C(=C\C(C)CC)\C(C)=O Amb25112631 [0,1,0,0,0,1|1,0,1]=4 6056 B9R0.42 C\C(\CC(=C)C(O)=O)=C/C Amb24746757 [0,1,0,0,0,1|0,0,2]=4 6057 B9R0.42 C\C(\CC(N)C(O)=O)=C/C Amb24587021 [0,1,0,0,0,1|0,0,2]=4 6058 B9R0.42 C\C(\CCl)=C/[C@H](C)C(O)=O Amb25313581 [0,1,0,0,0,1|1,0,1]=4 6059 B9R0.42 C\C(\C[C@H](N)C(O)=O)=C\C Amb24746992 [0,1,0,0,0,1|0,0,2]=4 6060 B9R0.42 NC(CC(F)CN)C(O)=O Amb24709973 [0,1,0,0,0,1|2,0,0]=4 6061 B9R0.42 NC(CC(O)CCl)C(O)=O Amb20179638 [0,1,0,0,0,1|2,0,0]=4 6062 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [0,1,0,0,0,1|2,0,0]=4 6063 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [0,1,0,0,0,1|2,0,0]=4 6064 B9R0.42 NC[C@H](O)C[C@H](O)C(O)=O Amb24383534 [0,1,0,0,0,1|2,0,0]=4 6065 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [0,1,0,0,0,1|2,0,0]=4 6066 B9R0.42 N[C@@H](CC(O)CN)C(O)=O Amb24455060 [0,1,0,0,0,1|2,0,0]=4 6067 B9R0.42 N[C@@H](C[C@@H](O)CN)C(O)=O Amb25320209 [0,1,0,0,0,1|2,0,0]=4 6068 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [0,1,0,0,0,1|2,0,0]=4 6069 B9R0.42 N[C@@H](C[C@H](O)CCl)C(O)=O Amb25265266 [0,1,0,0,0,1|2,0,0]=4 6070 B9R0.42 N[C@@H](C[C@H](O)CN)C(O)=O Amb24446199 [0,1,0,0,0,1|2,0,0]=4 6071 B9R0.42 N[C@H](C[C@@H](O)CN)C(O)=O Amb24480730 [0,1,0,0,0,1|2,0,0]=4 6072 B9R0.42 N[C@H](C[C@H](O)CN)C(O)=O Amb25147418 [0,1,0,0,0,1|2,0,0]=4 6073 B9R0.42 OC(=O)C(=O)CC(O)CO Amb25733244 [0,1,0,0,0,1|2,0,0]=4 6074 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [0,1,0,0,0,1|2,0,0]=4 6075 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [0,1,0,0,0,1|2,0,0]=4 6076 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [0,1,0,0,0,1|2,0,0]=4 6077 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [0,1,0,0,0,1|2,0,0]=4 6078 B9R0.43 CC(=C)CNC(CC)CC Amb25704535 [0,1,0,0,0,1|2,0,0]=4 6079 B9R0.43 CC(=O)C=CC(CC)CC Amb22345907 [0,1,0,0,0,1|1,0,1]=4 6080 B9R0.43 CC(=O)CC=C(CC)CC Amb25320085 [0,1,0,0,0,1|1,0,1]=4 6081 B9R0.43 CC(=O)CCC(CC)=CC Amb24518433 [0,1,0,0,0,1|1,0,1]=4 6082 B9R0.43 CC(=O)CCC(OC)OC Amb25146554 [0,1,0,0,0,1|2,0,0]=4 6083 B9R0.43 CC(=O)CC\C(\CC)=C\C Amb25857597 [0,1,0,0,0,1|1,0,1]=4 6084 B9R0.43 CC(=O)CSC(CC)CC Amb24431275 [0,1,0,0,0,1|1,0,0]=3 6085 B9R0.43 CC(=O)NCC(CC)=CC Amb24478998 [0,1,0,0,0,1|1,0,1]=4 6086 B9R0.43 CC(=O)NCN(CC)CC Amb24472258 [0,1,0,0,0,1|2,0,0]=4 6087 B9R0.43 CC(=O)OCC(CCl)CCl Amb24726208 [0,1,0,0,0,1|2,0,0]=4 6088 B9R0.43 CC(O)COC(CC)OC Amb25855716 [0,1,0,0,0,1|1,0,1]=4 6089 B9R0.43 CCC(=CC)C#CC(O)=O Amb25305748 [0,1,0,0,0,1|0,0,2]=4 6090 B9R0.43 CCC(C#N)SCC(C)=O Amb24541426 [0,1,0,0,0,1|1,0,1]=4 6091 B9R0.43 CCC(C#N)SCC(O)=O Amb18182420 [0,1,0,0,0,1|0,0,1]=3 6092 B9R0.43 CCC(CBr)CCS(C)=O Amb25292711 [0,1,0,0,0,1|2,0,0]=4 6093 B9R0.43 CCC(CC)=C=CC(O)=O Amb24480770 [0,1,0,0,0,1|0,0,2]=4 6094 B9R0.43 CCC(CC)=CCC(N)=O Amb24426409 [0,1,0,0,0,1|1,0,1]=4 6095 B9R0.43 CCC(CC)=CCC(O)=O Amb24358562 [0,1,0,0,0,1|0,0,1]=3 6096 B9R0.43 CCC(CC)NCC(=C)Cl Amb18800601 [0,1,0,0,0,1|2,0,0]=4 6097 B9R0.43 CCC(CC)SCC(N)=O Amb25769020 [0,1,0,0,0,1|1,0,0]=3 6098 B9R0.43 CCC(CC)\C=C/C(N)=O Amb25127960 [0,1,0,0,0,1|1,0,1]=4 6099 B9R0.43 CCC(CC)\C=C\C(N)=O Amb24616434 [0,1,0,0,0,1|1,0,1]=4 6100 B9R0.43 CCC(CC)\C=C\C(O)=O Amb24375784 [0,1,0,0,0,1|0,0,1]=3 6101 B9R0.43 CCC(CCC(C)=O)C#N Amb18643428 [0,1,0,0,0,1|1,0,1]=4 6102 B9R0.43 CCC(CCC(C)=O)C=C Amb24354954 [0,1,0,0,0,1|1,0,1]=4 6103 B9R0.43 CCC(CCC(C)=O)C=O Amb18643911 [0,1,0,0,0,1|1,0,1]=4 6104 B9R0.43 CCC(CCC(N)=O)CC Amb25784811 [0,1,0,0,0,1|1,0,0]=3 6105 B9R0.43 CCC(CCC(O)=O)=CC Amb24480728 [0,1,0,0,0,1|0,0,1]=3 6106 B9R0.43 CCC(CCC(O)=O)C#N Amb18643712 [0,1,0,0,0,1|0,0,1]=3 6107 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [0,1,0,0,0,1|0,0,1]=3 6108 B9R0.43 CCC(CCC(O)=O)NN Amb24478238 [0,1,0,0,0,1|1,0,0]=3 6109 B9R0.43 CCC(CCl)CCS(C)=O Amb24617545 [0,1,0,0,0,1|2,0,0]=4 6110 B9R0.43 CCC(CCl)COC(C)=O Amb24480383 [0,1,0,0,0,1|1,0,0]=3 6111 B9R0.43 CCC(CN)CCS(C)=O Amb24699721 [0,1,0,0,0,1|2,0,0]=4 6112 B9R0.43 CCC(CNC(C)=O)OC Amb25852654 [0,1,0,0,0,1|1,0,0]=3 6113 B9R0.43 CCC(CNC(N)=N)CC Amb25146754 [0,1,0,0,0,1|2,0,0]=4 6114 B9R0.43 CCC(CNC(N)=N)OC Amb25318289 [0,1,0,0,0,1|2,0,0]=4 6115 B9R0.43 CCC(CNC(N)=O)CC Amb25789490 [0,1,0,0,0,1|1,0,0]=3 6116 B9R0.43 CCC(CNC(N)=S)OC Amb24458521 [0,1,0,0,0,1|1,1,0]=4 6117 B9R0.43 CCC(CO)COC(N)=O Amb25840638 [0,1,0,0,0,1|1,0,0]=3 6118 B9R0.43 CCC(CO)NCC(=C)Cl Amb18800732 [0,1,0,0,0,1|2,0,0]=4 6119 B9R0.43 CCC(CO)NCC(C)=C Amb24469956 [0,1,0,0,0,1|2,0,0]=4 6120 B9R0.43 CCC(COC(=O)Cl)CC Amb25142812 [0,1,0,0,0,1|1,0,0]=3 6121 B9R0.43 CCC(CSC(C)=O)C=O Amb24497347 [0,1,0,0,0,1|1,0,1]=4 6122 B9R0.43 CCC(NCC(=O)N)CC Amb1121177 [0,1,0,0,0,1|1,0,0]=3 6123 B9R0.43 CCC(\C=C\C(O)=O)OC Amb24707577 [0,1,0,0,0,1|0,0,1]=3 6124 B9R0.43 CCN(CC)OCC(N)=O Amb25284108 [0,1,0,0,0,1|2,0,0]=4 6125 B9R0.43 CCN(CC)\C=C\C(O)=O Amb24412624 [0,1,0,0,0,1|1,0,1]=4 6126 B9R0.43 CCN(CCC(=O)N)CC Amb17231985 [0,1,0,0,0,1|2,0,0]=4 6127 B9R0.43 CCN(CCC(O)=O)C=O Amb19010092 [0,1,0,0,0,1|1,0,1]=4 6128 B9R0.43 CCN(CCC(O)=O)N=O Amb24659873 [0,1,0,0,0,1|2,0,0]=4 6129 B9R0.43 CCP(CCC(O)=O)CC Amb24390842 [0,1,0,0,0,1|1,0,0]=3 6130 B9R0.43 CC[C@@H](CBr)COC(C)=O Amb24441456 [0,1,0,0,0,1|1,0,0]=3 6131 B9R0.43 CC[C@@H](CCC(C)=O)C=O Amb24573990 [0,1,0,0,0,1|1,0,1]=4 6132 B9R0.43 CC[C@@H](CCC(O)=O)NN Amb24640349 [0,1,0,0,0,1|1,0,0]=3 6133 B9R0.43 CC[S+](CCC(O)=O)CC Amb24702750 [0,1,0,0,0,1|1,0,0]=3 6134 B9R0.43 CNC(=NC)SCC(O)=O Amb24623623 [0,1,0,0,0,1|1,0,1]=4 6135 B9R0.43 CNC(NC)=NCC(O)=O Amb24478941 [0,1,0,0,0,1|1,0,1]=4 6136 B9R0.43 CN[C@H](CS)CCC(O)=O Amb24482183 [0,1,0,0,0,1|1,0,0]=3 6137 B9R0.43 COC(CBr)CNC(N)=O Amb25726341 [0,1,0,0,0,1|2,0,0]=4 6138 B9R0.43 COC(CCC(N)=O)OC Amb25843468 [0,1,0,0,0,1|2,0,0]=4 6139 B9R0.43 COC(CCC(O)=O)OC Amb24657204 [0,1,0,0,0,1|1,0,0]=3 6140 B9R0.43 COC(CNC(=O)C)OC Amb10808671 [0,1,0,0,0,1|2,0,0]=4 6141 B9R0.43 COC(CNC(=O)N)OC Amb16244926 [0,1,0,0,0,1|2,0,0]=4 6142 B9R0.43 COC(COC(C)=O)CC Amb24323241 [0,1,0,0,0,1|1,0,0]=3 6143 B9R0.43 CO[C@H](CN)CCC(O)=O Amb24544386 [0,1,0,0,0,1|1,0,0]=3 6144 B9R0.43 CO[C@H](CO)COC(C)=O Amb25271459 [0,1,0,0,0,1|2,0,0]=4 6145 B9R0.43 C[C@@H](O)CNC(CC)CC Amb25695643 [0,1,0,0,0,1|1,0,1]=4 6146 B9R0.43 C[C@@H](O)CNC(CO)CC Amb25840919 [0,1,0,0,0,1|1,0,1]=4 6147 B9R0.43 C\C=C(/CC)\C=C\C(O)=O Amb18643591 [0,1,0,0,0,1|0,0,2]=4 6148 B9R0.43 NC(=O)CNC(CO)CO Amb24402052 [0,1,0,0,0,1|2,0,0]=4 6149 B9R0.43 NCC(CCC(O)=O)CN Amb25062561 [0,1,0,0,0,1|1,0,0]=3 6150 B9R0.43 OC(=O)COC(CF)CF Amb25095931 [0,1,0,0,0,1|1,0,0]=3 6151 B9R0.48 C#CCC(O)CCC(O)=O Amb25077171 [0,1,0,0,0,1|1,0,1]=4 6152 B9R0.48 C#CCN(CCC(=O)O)C Amb17561257 [0,1,0,0,0,1|1,0,1]=4 6153 B9R0.48 C=CCC(N)CCC(O)=O Amb25132628 [0,1,0,0,0,1|1,0,1]=4 6154 B9R0.48 C=CCN(CCC(=O)O)C Amb17334214 [0,1,0,0,0,1|1,0,1]=4 6155 B9R0.48 C=CC[C@@H](N)CCC(O)=O Amb25308063 [0,1,0,0,0,1|1,0,1]=4 6156 B9R0.48 CC#CC(C)SCC(O)=O Amb24482141 [0,1,0,0,0,1|0,0,1]=3 6157 B9R0.48 CC(=O)OCC(Cl)CCCl Amb25274075 [0,1,0,0,0,1|2,0,0]=4 6158 B9R0.48 CC(=O)OCC(O)CCO Amb24371331 [0,1,0,0,0,1|2,0,0]=4 6159 B9R0.48 CC(CC#C)CCC(O)=O Amb25331115 [0,1,0,0,0,1|0,0,1]=3 6160 B9R0.48 CC(CC#N)=CCC(O)=O Amb24480771 [0,1,0,0,0,1|0,0,2]=4 6161 B9R0.48 CC(CC#N)CCC(C)=O Amb18124541 [0,1,0,0,0,1|1,0,1]=4 6162 B9R0.48 CC(CC#N)CCC(O)=O Amb25826195 [0,1,0,0,0,1|0,0,1]=3 6163 B9R0.48 CC(CC#N)NCC(N)=O Amb19006655 [0,1,0,0,0,1|1,0,1]=4 6164 B9R0.48 CC(CC=C)CNC(C)=O Amb24351217 [0,1,0,0,0,1|1,0,1]=4 6165 B9R0.48 CC(CC=C)NCC(O)=O Amb25096722 [0,1,0,0,0,1|0,0,1]=3 6166 B9R0.48 CC(CC=C)OCC(O)=O Amb25064284 [0,1,0,0,0,1|0,0,1]=3 6167 B9R0.48 CC(CC=O)COC(C)=O Amb18644137 [0,1,0,0,0,1|1,0,1]=4 6168 B9R0.48 CC(CCBr)COC(C)=O Amb24759472 [0,1,0,0,0,1|1,0,0]=3 6169 B9R0.48 CC(CCC(C)O)COC Amb25378257 [0,1,0,0,0,1|1,0,1]=4 6170 B9R0.48 CC(CCC(O)=O)NC=O Amb24602293 [0,1,0,0,0,1|1,0,1]=4 6171 B9R0.48 CC(CCCl)COC(C)=O Amb25757525 [0,1,0,0,0,1|1,0,0]=3 6172 B9R0.48 CC(CCN)CCC(C)=C Amb25067186 [0,1,0,0,0,1|2,0,0]=4 6173 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,1,0,0,0,1|1,0,0]=3 6174 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [0,1,0,0,0,1|0,0,0]=2 6175 B9R0.48 CC(CCN)CCS(C)=O Amb24585879 [0,1,0,0,0,1|2,0,0]=4 6176 B9R0.48 CC(CCN)NCC(C)O Amb20090514 [0,1,0,0,0,1|1,0,1]=4 6177 B9R0.48 CC(CCN)SCC(C)=C Amb24366862 [0,1,0,0,0,1|2,0,0]=4 6178 B9R0.48 CC(CCN)SCC(C)O Amb24701880 [0,1,0,0,0,1|1,0,1]=4 6179 B9R0.48 CC(CCO)CC=C(C)C Amb24397049 [0,1,0,0,0,1|2,0,0]=4 6180 B9R0.48 CC(CCO)COC(C)=O Amb24524456 [0,1,0,0,0,1|1,0,0]=3 6181 B9R0.48 CC(CCO)NCC(C)=C Amb25138314 [0,1,0,0,0,1|2,0,0]=4 6182 B9R0.48 CC(CCO)SCC(=C)Br Amb24634521 [0,1,0,0,0,1|2,0,0]=4 6183 B9R0.48 CC(CCO)SCC(N)=N Amb25777250 [0,1,0,0,0,1|2,0,0]=4 6184 B9R0.48 CC(CCO)SCC(N)=O Amb25122527 [0,1,0,0,0,1|1,0,0]=3 6185 B9R0.48 CC(CCO)SCC(O)=O Amb25056289 [0,1,0,0,0,1|0,0,0]=2 6186 B9R0.48 CC(CNC)OCC(C)O Amb24644350 [0,1,0,0,0,1|1,0,1]=4 6187 B9R0.48 CC(COC(C)=O)OCCl Amb24746780 [0,1,0,0,0,1|2,0,0]=4 6188 B9R0.48 CC(CSC)=CCC(O)=O Amb25238257 [0,1,0,0,0,1|0,0,1]=3 6189 B9R0.48 CC(CSC)NC[C@H](C)O Amb24663678 [0,1,0,0,0,1|1,0,1]=4 6190 B9R0.48 CC(O)CNC(C)CCO Amb25048906 [0,1,0,0,0,1|1,0,1]=4 6191 B9R0.48 CC(O)CSC(C)CCO Amb24373349 [0,1,0,0,0,1|1,0,1]=4 6192 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [0,1,0,0,0,1|1,0,0]=3 6193 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,1,0,0,0,1|1,0,1]=4 6194 B9R0.48 CCCC(C)COC(=O)Cl Amb25783542 [0,1,0,0,0,1|1,0,0]=3 6195 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,1,0,0,0,1|1,0,0]=3 6196 B9R0.48 CCCC(C)CSC(N)=N Amb25246067 [0,1,0,0,0,1|2,0,0]=4 6197 B9R0.48 CCCC(C)NCC(=C)Cl Amb18183485 [0,1,0,0,0,1|2,0,0]=4 6198 B9R0.48 CCCC(C)NCC(C)=C Amb25704086 [0,1,0,0,0,1|2,0,0]=4 6199 B9R0.48 CCCC(C)OCC(=C)Br Amb25698155 [0,1,0,0,0,1|2,0,0]=4 6200 B9R0.48 CCCC(C)OCC(C)O Amb24504646 [0,1,0,0,0,1|1,0,1]=4 6201 B9R0.48 CCCC(C)OCC(N)=N Amb24481038 [0,1,0,0,0,1|2,0,0]=4 6202 B9R0.48 CCCC(C)OCC(N)=O Amb25227310 [0,1,0,0,0,1|1,0,0]=3 6203 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [0,1,0,0,0,1|0,0,0]=2 6204 B9R0.48 CCCC(C)OC[C@@H](C)O Amb24441315 [0,1,0,0,0,1|1,0,1]=4 6205 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,1,0,0,0,1|1,0,1]=4 6206 B9R0.48 CCCC(CCC(=O)C)C Amb10807385 [0,1,0,0,0,1|1,0,0]=3 6207 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [0,1,0,0,0,1|2,0,0]=4 6208 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [0,1,0,0,0,1|1,0,0]=3 6209 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [0,1,0,0,0,1|1,0,1]=4 6210 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [0,1,0,0,0,1|1,0,0]=3 6211 B9R0.48 CCCC(Cl)COC(C)=O Amb25088458 [0,1,0,0,0,1|2,0,0]=4 6212 B9R0.48 CCCC(F)CCC(C)=O Amb25723377 [0,1,0,0,0,1|2,0,0]=4 6213 B9R0.48 CCCC(N)CNC(N)=O Amb24443520 [0,1,0,0,0,1|2,0,0]=4 6214 B9R0.48 CCCC(O)C#CC(O)=O Amb25823661 [0,1,0,0,0,1|1,0,1]=4 6215 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [0,1,0,0,0,1|1,0,0]=3 6216 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [0,1,0,0,0,1|1,0,1]=4 6217 B9R0.48 CCCC(O)CNC(C)=O Amb24333057 [0,1,0,0,0,1|2,0,0]=4 6218 B9R0.48 CCCN(C)CCC(O)=O Amb19280988 [0,1,0,0,0,1|1,0,0]=3 6219 B9R0.48 CCCS(=O)CCC(O)=O Amb18792575 [0,1,0,0,0,1|2,0,0]=4 6220 B9R0.48 CCC[C@@H](Br)COC(C)=O Amb25733071 [0,1,0,0,0,1|2,0,0]=4 6221 B9R0.48 CCC[C@@H](C)CCC(C)O Amb25806670 [0,1,0,0,0,1|1,0,1]=4 6222 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [0,1,0,0,0,1|0,0,0]=2 6223 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [0,1,0,0,0,1|0,0,0]=2 6224 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [0,1,0,0,0,1|1,0,0]=3 6225 B9R0.48 CCNC(=N)NCC(O)=O Amb25263286 [0,1,0,0,0,1|1,0,1]=4 6226 B9R0.48 CCNC(=O)NCC(=O)O Amb1129570 [0,1,0,0,0,1|1,0,1]=4 6227 B9R0.48 CCNC(=O)SCC(O)=O Amb24390827 [0,1,0,0,0,1|1,0,1]=4 6228 B9R0.48 CCNC(=S)NCC(O)=O Amb25857780 [0,1,0,0,0,1|1,0,1]=4 6229 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [0,1,0,0,0,1|0,0,0]=2 6230 B9R0.48 CCN[C@@H](C)CNC(N)=O Amb25811109 [0,1,0,0,0,1|1,0,0]=3 6231 B9R0.48 CCN[C@H](C)CNC(N)=O Amb24570937 [0,1,0,0,0,1|1,0,0]=3 6232 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,1,0,0,0,1|1,0,1]=4 6233 B9R0.48 CCOC(=O)OCC(O)=O Amb25367281 [0,1,0,0,0,1|1,0,1]=4 6234 B9R0.48 CCOC(=O)SCC(O)=O Amb24726215 [0,1,0,0,0,1|1,0,1]=4 6235 B9R0.48 CCOC(C)C#CC(O)=O Amb24480724 [0,1,0,0,0,1|0,0,1]=3 6236 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [0,1,0,0,0,1|0,0,0]=2 6237 B9R0.48 CCOC(C)CNC(C)=N Amb24359991 [0,1,0,0,0,1|2,0,0]=4 6238 B9R0.48 CCOC(C)OCC(C)=O Amb24752470 [0,1,0,0,0,1|1,0,0]=3 6239 B9R0.48 CCOC(C)SCC(O)=O Amb24443054 [0,1,0,0,0,1|0,0,0]=2 6240 B9R0.48 CCOC(Cl)CSC(C)=O Amb24429156 [0,1,0,0,0,1|2,0,0]=4 6241 B9R0.48 CCO\C(\C)=C/CC(C)=O Amb25713031 [0,1,0,0,0,1|1,0,1]=4 6242 B9R0.48 CCSC(=O)CCC(O)=O Amb24482232 [0,1,0,0,0,1|1,0,1]=4 6243 B9R0.48 CCSC(=O)NCC(O)=O Amb25295471 [0,1,0,0,0,1|1,0,1]=4 6244 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [0,1,0,0,0,1|0,0,0]=2 6245 B9R0.48 CCS\C(\S)=N/CC(O)=O Amb21862600 [0,1,0,0,0,1|1,0,1]=4 6246 B9R0.48 CC\C=C(\C)/CCC(C)=O Amb24511429 [0,1,0,0,0,1|1,0,1]=4 6247 B9R0.48 CN(CCF)CCC(N)=O Amb25681499 [0,1,0,0,0,1|2,0,0]=4 6248 B9R0.48 CN(CCF)CCC(O)=O Amb25054517 [0,1,0,0,0,1|1,0,0]=3 6249 B9R0.48 CN(CCN)CCC(N)=O Amb24355517 [0,1,0,0,0,1|2,0,0]=4 6250 B9R0.48 CNCC(=O)NCC(O)=O Amb19010138 [0,1,0,0,0,1|1,0,1]=4 6251 B9R0.48 CNCC(=O)OCC(O)=O Amb25366854 [0,1,0,0,0,1|1,0,1]=4 6252 B9R0.48 CNCC(=O)SCC(O)=O Amb24550580 [0,1,0,0,0,1|1,0,1]=4 6253 B9R0.48 CNCC(C)CCC(C)=C Amb24353317 [0,1,0,0,0,1|2,0,0]=4 6254 B9R0.48 CNCC(C)CCS(C)=O Amb24538764 [0,1,0,0,0,1|2,0,0]=4 6255 B9R0.48 CNCC(C)OCC(=C)Cl Amb18798257 [0,1,0,0,0,1|2,0,0]=4 6256 B9R0.48 CNCC(C)OCC(C)=C Amb25083727 [0,1,0,0,0,1|2,0,0]=4 6257 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [0,1,0,0,0,1|1,0,0]=3 6258 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,1,0,0,0,1|2,0,0]=4 6259 B9R0.48 COCC(=O)NCC(=O)O Amb1118442 [0,1,0,0,0,1|1,0,1]=4 6260 B9R0.48 COCC(Br)CNC(C)=O Amb25707089 [0,1,0,0,0,1|2,0,0]=4 6261 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [0,1,0,0,0,1|0,0,0]=2 6262 B9R0.48 COCC(C)CNC(C)=N Amb24721998 [0,1,0,0,0,1|2,0,0]=4 6263 B9R0.48 COCC(C)CNC(C)=O Amb25099602 [0,1,0,0,0,1|1,0,0]=3 6264 B9R0.48 COCC(C)CNC(N)=N Amb25250271 [0,1,0,0,0,1|2,0,0]=4 6265 B9R0.48 COCC(C)CNC(N)=O Amb25809151 [0,1,0,0,0,1|1,0,0]=3 6266 B9R0.48 COCC(C)CNC(N)=S Amb18788151 [0,1,0,0,0,1|1,1,0]=4 6267 B9R0.48 COCC(C)NCC(=C)Cl Amb18800733 [0,1,0,0,0,1|2,0,0]=4 6268 B9R0.48 COCC(C)NCC(O)=O Amb19408155 [0,1,0,0,0,1|0,0,0]=2 6269 B9R0.48 COCC(C)OCC(C)O Amb24064024 [0,1,0,0,0,1|1,0,1]=4 6270 B9R0.48 COCC(C)OCC(N)=O Amb25146467 [0,1,0,0,0,1|1,0,0]=3 6271 B9R0.48 COCC(C)OCC(N)=S Amb25146450 [0,1,0,0,0,1|1,1,0]=4 6272 B9R0.48 COCC(C)OC[C@@H](C)O Amb25145657 [0,1,0,0,0,1|1,0,1]=4 6273 B9R0.48 COCC(C)OC[C@H](C)O Amb24465390 [0,1,0,0,0,1|1,0,1]=4 6274 B9R0.48 COCC(C)ONC(C)=O Amb25681602 [0,1,0,0,0,1|2,0,0]=4 6275 B9R0.48 COCC(C)ONC(N)=O Amb24625263 [0,1,0,0,0,1|2,0,0]=4 6276 B9R0.48 COCC(C)SCC(=C)Br Amb24403555 [0,1,0,0,0,1|2,0,0]=4 6277 B9R0.48 COCC(C)SCC(C)=C Amb24474742 [0,1,0,0,0,1|2,0,0]=4 6278 B9R0.48 COCC(Cl)COC(C)=O Amb24710120 [0,1,0,0,0,1|2,0,0]=4 6279 B9R0.48 COCC(O)CCC(C)=O Amb24438108 [0,1,0,0,0,1|2,0,0]=4 6280 B9R0.48 COCC(O)CNC(C)=O Amb24731685 [0,1,0,0,0,1|2,0,0]=4 6281 B9R0.48 COCC(O)COC(C)=O Amb25346275 [0,1,0,0,0,1|2,0,0]=4 6282 B9R0.48 COC[C@@H](O)CNC(N)=O Amb25681169 [0,1,0,0,0,1|2,0,0]=4 6283 B9R0.48 COC[C@H](O)CNC(C)=O Amb24447557 [0,1,0,0,0,1|2,0,0]=4 6284 B9R0.48 COC[C@H](O)CNC(N)=O Amb24482761 [0,1,0,0,0,1|2,0,0]=4 6285 B9R0.48 COC[C@H](O)COC(C)=O Amb24687445 [0,1,0,0,0,1|2,0,0]=4 6286 B9R0.48 CSCC(C)CNC(C)=N Amb24744260 [0,1,0,0,0,1|2,0,0]=4 6287 B9R0.48 CSCC(C)CNC(N)=N Amb25146342 [0,1,0,0,0,1|2,0,0]=4 6288 B9R0.48 CSCC(C)COC(=O)Cl Amb25370807 [0,1,0,0,0,1|1,0,0]=3 6289 B9R0.48 CSCC(C)NCC(=C)Cl Amb24367446 [0,1,0,0,0,1|2,0,0]=4 6290 B9R0.48 CSCC(C)NCC(C)=C Amb25297875 [0,1,0,0,0,1|2,0,0]=4 6291 B9R0.48 CSCC(C)NCC(O)=O Amb25701279 [0,1,0,0,0,1|0,0,0]=2 6292 B9R0.48 CSS[C@@H](C)CCC(O)=O Amb25798967 [0,1,0,0,0,1|1,0,0]=3 6293 B9R0.48 CSS[C@H](C)CCC(O)=O Amb24652619 [0,1,0,0,0,1|1,0,0]=3 6294 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [0,1,0,0,0,1|0,0,1]=3 6295 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [0,1,0,0,0,1|0,0,0]=2 6296 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [0,1,0,0,0,1|0,0,0]=2 6297 B9R0.48 C[C@H](CCO)CCC(C)=O Amb25319945 [0,1,0,0,0,1|1,0,0]=3 6298 B9R0.48 C[C@H](CCO)OCC(C)=C Amb25848415 [0,1,0,0,0,1|2,0,0]=4 6299 B9R0.48 C[C@H](O)CSC(C)CCO Amb25137385 [0,1,0,0,0,1|1,0,1]=4 6300 B9R0.48 C\C(\C=CC(O)=O)=C\CC Amb24562528 [0,1,0,0,0,1|0,0,2]=4 6301 B9R0.48 C\C(\C=C\C(O)=O)=C/CC Amb18643546 [0,1,0,0,0,1|0,0,2]=4 6302 B9R0.48 C\C(\CC=C)=C\CC(O)=O Amb24707088 [0,1,0,0,0,1|0,0,2]=4 6303 B9R0.48 C\C(\CCC(O)=O)=C/CO Amb25694396 [0,1,0,0,0,1|0,0,2]=4 6304 B9R0.48 C\C(\CCC(O)=O)=C\SC Amb24520805 [0,1,0,0,0,1|0,0,2]=4 6305 B9R0.48 C\C(\CSC)=C\CC(O)=O Amb18126246 [0,1,0,0,0,1|0,0,1]=3 6306 B9R0.48 C\C=C\C(C)C=CC(O)=O Amb25340463 [0,1,0,0,0,1|0,0,2]=4 6307 B9R0.48 C\C=C\C(C)CNC(N)=O Amb22365219 [0,1,0,0,0,1|1,0,1]=4 6308 B9R0.48 C\C=C\C(O)CCC(O)=O Amb25275755 [0,1,0,0,0,1|1,0,1]=4 6309 B9R0.48 C\C=C\[C@H](O)CCC(O)=O Amb24538051 [0,1,0,0,0,1|1,0,1]=4 6310 B9R0.48 N#CCN(CCC(=O)O)C Amb17561163 [0,1,0,0,0,1|1,0,1]=4 6311 B9R0.48 NC(CC#N)CCC(O)=O Amb24595715 [0,1,0,0,0,1|1,0,1]=4 6312 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [0,1,0,0,0,1|1,0,0]=3 6313 B9R0.48 NCCC(=O)CCC(O)=O Amb25790735 [0,1,0,0,0,1|1,0,1]=4 6314 B9R0.48 NN(CCO)CCC(O)=O Amb25259231 [0,1,0,0,0,1|2,0,0]=4 6315 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [0,1,0,0,0,1|1,0,0]=3 6316 B9R0.48 N[C@H](CC#N)CCC(O)=O Amb24541852 [0,1,0,0,0,1|1,0,1]=4 6317 B9R0.48 OC(=O)CCC(=O)CCO Amb25265246 [0,1,0,0,0,1|1,0,1]=4 6318 B9R0.48 OC(=O)CCS(=O)CCF Amb25040432 [0,1,0,0,0,1|2,0,0]=4 6319 B9R0.48 OC(=O)CNC(=O)CCBr Amb25258869 [0,1,0,0,0,1|1,0,1]=4 6320 B9R0.48 OC(=O)CNC(=O)CCO Amb24745672 [0,1,0,0,0,1|1,0,1]=4 6321 B9R0.48 OC(=O)CNC(=O)CCS Amb18126369 [0,1,0,0,0,1|1,0,1]=4 6322 B9R0.48 OC(=O)COC(=O)CCCl Amb25241988 [0,1,0,0,0,1|1,0,1]=4 6323 B9R0.48 OC(=O)COC(=O)CCS Amb24482372 [0,1,0,0,0,1|1,0,1]=4 6324 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [0,1,0,0,0,1|1,0,0]=3 6325 B9R0.48 OCCN(CCC(=O)Cl)C Amb17142907 [0,1,0,0,0,1|2,0,0]=4 6326 B9R0.48 OCCN(CCC(=O)N)C Amb17142868 [0,1,0,0,0,1|2,0,0]=4 6327 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [0,1,0,0,0,1|1,0,0]=3 6328 B9R0.64 CC(=O)CCC(C)(O)CO Amb25713212 [0,1,0,0,0,1|2,0,0]=4 6329 B9R0.64 CC(=O)COC(C)(C)CCl Amb25739312 [0,1,0,0,0,1|2,0,0]=4 6330 B9R0.64 CC(=O)NCC(C)(C)CN Amb25810145 [0,1,0,0,0,1|2,0,0]=4 6331 B9R0.64 CC(=O)NCC(C)(O)CO Amb25685703 [0,1,0,0,0,1|2,0,0]=4 6332 B9R0.64 CC(=O)OCC(C)(C)CBr Amb25350030 [0,1,0,0,0,1|2,0,0]=4 6333 B9R0.64 CC(=O)OCC(C)(C)CCl Amb24560912 [0,1,0,0,0,1|2,0,0]=4 6334 B9R0.64 CC(C)(C#C)NCC(O)=O Amb25146466 [0,1,0,0,0,1|0,0,2]=4 6335 B9R0.64 CC(C)(C#N)NCC(O)=O Amb25699825 [0,1,0,0,0,1|1,0,1]=4 6336 B9R0.64 CC(C)(C=C)OCC(O)=O Amb25359044 [0,1,0,0,0,1|0,0,2]=4 6337 B9R0.64 CC(C)(CCC(O)=O)C#C Amb24480418 [0,1,0,0,0,1|0,0,2]=4 6338 B9R0.64 CC(C)(CCC(O)=O)C=O Amb18644118 [0,1,0,0,0,1|1,0,1]=4 6339 B9R0.64 CC(C)(CCC(O)=O)N=O Amb24428514 [0,1,0,0,0,1|2,0,0]=4 6340 B9R0.64 CC(C)(CO)CNC(N)=O Amb18831448 [0,1,0,0,0,1|2,0,0]=4 6341 B9R0.64 CC(C)(CO)SCC(O)=O Amb24659002 [0,1,0,0,0,1|1,0,0]=3 6342 B9R0.64 CC(Cl)(CCC(O)=O)N=O Amb24423829 [0,1,0,0,0,1|2,0,0]=4 6343 B9R0.64 CC(O)(CCC(O)=O)CO Amb25108439 [0,1,0,0,0,1|1,0,0]=3 6344 B9R0.64 CC(O)(CNC(N)=O)CO Amb24391888 [0,1,0,0,0,1|2,0,0]=4 6345 B9R0.64 CCC(C)(C)CCC(C)O Amb25168708 [0,1,0,0,0,1|1,0,1]=4 6346 B9R0.64 CCC(C)(C)CCC(O)=O Amb18644164 [0,1,0,0,0,1|0,0,0]=2 6347 B9R0.64 CCC(C)(C)CNC(N)=N Amb25794886 [0,1,0,0,0,1|2,0,0]=4 6348 B9R0.64 CCC(C)(C)N=CC(C)=O Amb25233570 [0,1,0,0,0,1|1,0,1]=4 6349 B9R0.64 CCC(C)(C)NCC(=C)Br Amb19005213 [0,1,0,0,0,1|2,0,0]=4 6350 B9R0.64 CCC(C)(C)NCC(=C)Cl Amb18303281 [0,1,0,0,0,1|2,0,0]=4 6351 B9R0.64 CCC(C)(C)NCC(C)O Amb18304004 [0,1,0,0,0,1|1,0,1]=4 6352 B9R0.64 CCC(C)(C)NC[C@H](C)O Amb25349537 [0,1,0,0,0,1|1,0,1]=4 6353 B9R0.64 CCC(C)(C)NNC(N)=O Amb25276592 [0,1,0,0,0,1|2,0,0]=4 6354 B9R0.64 CCC(C)(C)OC[C@H](C)O Amb25336130 [0,1,0,0,0,1|1,0,1]=4 6355 B9R0.64 CCC(C)(C)\C=C\C(C)=O Amb24633582 [0,1,0,0,0,1|1,0,1]=4 6356 B9R0.64 CCC(C)(C)\C=C\C(N)=O Amb24478259 [0,1,0,0,0,1|1,0,1]=4 6357 B9R0.64 CCC(C)(C)\C=C\C(O)=O Amb24576545 [0,1,0,0,0,1|0,0,1]=3 6358 B9R0.64 CCC(C)(C)\N=C\C(C)=O Amb24725377 [0,1,0,0,0,1|1,0,1]=4 6359 B9R0.64 CCC(C)(O)C#CC(C)=O Amb25130662 [0,1,0,0,0,1|1,0,1]=4 6360 B9R0.64 CCC(C)(O)C#CC(O)=O Amb24480767 [0,1,0,0,0,1|0,0,1]=3 6361 B9R0.64 CCC(C)(O)CCB(O)O Amb25326403 [0,1,0,0,0,1|1,0,1]=4 6362 B9R0.64 CCC(C)(O)CCC(N)=O Amb25723101 [0,1,0,0,0,1|1,0,0]=3 6363 B9R0.64 CCC(C)(O)CCC(O)=O Amb25317242 [0,1,0,0,0,1|0,0,0]=2 6364 B9R0.64 CCC(C)(O)CNC(N)=N Amb25756845 [0,1,0,0,0,1|2,0,0]=4 6365 B9R0.64 CCC(C)(O)CNS(C)=O Amb24707643 [0,1,0,0,0,1|2,0,0]=4 6366 B9R0.64 CCC(C)(O)CSC(N)=N Amb25239230 [0,1,0,0,0,1|2,0,0]=4 6367 B9R0.64 CCC(N)(N)C#CC(O)=O Amb24580644 [0,1,0,0,0,1|1,0,1]=4 6368 B9R0.64 CCS(=O)(=O)NCC(=O)O Amb1112815 [0,1,0,0,0,1|2,0,0]=4 6369 B9R0.64 CC[C@@](C)(O)CCC(O)=O Amb24461550 [0,1,0,0,0,1|0,0,0]=2 6370 B9R0.64 CC[Si](C)(C)C#CC(O)=O Amb24634330 [0,1,0,0,0,1|0,1,1]=4 6371 B9R0.64 CC[Si](C)(C)CCC(O)=O Amb24482202 [0,1,0,0,0,1|0,1,0]=3 6372 B9R0.64 CNC(C)(C)COC(C)=O Amb24712887 [0,1,0,0,0,1|2,0,0]=4 6373 B9R0.64 COC(C)(C)C#CC(O)=O Amb25777780 [0,1,0,0,0,1|1,0,1]=4 6374 B9R0.64 COC(C)(C)CCC(C)=O Amb25767114 [0,1,0,0,0,1|2,0,0]=4 6375 B9R0.64 COC(C)(C)COC(=O)Cl Amb24647421 [0,1,0,0,0,1|2,0,0]=4 6376 B9R0.64 COC(C)(C)OCC(C)=O Amb24564909 [0,1,0,0,0,1|2,0,0]=4 6377 B9R0.64 COC(C)(C)\C=C\C(O)=O Amb24391131 [0,1,0,0,0,1|1,0,1]=4 6378 B9R0.64 COP(C)(=O)CCC(O)=O Amb25288153 [0,1,0,0,0,1|2,0,0]=4 6379 B9R0.64 C[Si](C)(CCl)CCC(O)=O Amb25337752 [0,1,0,0,0,1|1,1,0]=4 6380 B9R0.64 NCC(O)(O)CCC(O)=O Amb24401314 [0,1,0,0,0,1|2,0,0]=4 6381 B9R0.64 OC(=O)CCC(F)(F)CBr Amb25766479 [0,1,0,0,0,1|2,0,0]=4 6382 B9R0.6 C=CCC(N)C(O)C(O)=O Amb25147612 [0,2,0,0,0,0|1,0,1]=4 6383 B9R0.6 C=CC[C@@H](O)[C@H](N)C(O)=O Amb24459826 [0,2,0,0,0,0|1,0,1]=4 6384 B9R0.6 CC#C[C@H](O)[C@H](N)C(O)=O Amb25313389 [0,2,0,0,0,0|1,0,1]=4 6385 B9R0.6 CC(=C=CC)[C@H](O)C(O)=O Amb25083036 [0,2,0,0,0,0|0,0,2]=4 6386 B9R0.6 CC(=O)C(O)C(O)CCO Amb24458926 [0,2,0,0,0,0|2,0,0]=4 6387 B9R0.6 CC(=O)[C@@H](O)[C@H](O)CCO Amb24409676 [0,2,0,0,0,0|2,0,0]=4 6388 B9R0.6 CC(C(C)=O)N(C)CCO Amb24475705 [0,2,0,0,0,0|2,0,0]=4 6389 B9R0.6 CC(C(C)CC=C)C(O)=O Amb18643938 [0,2,0,0,0,0|0,0,1]=3 6390 B9R0.6 CC(C(C)CC=O)C(O)=O Amb18644133 [0,2,0,0,0,0|0,0,1]=3 6391 B9R0.6 CC(C(C)CCO)C(C)=C Amb25055319 [0,2,0,0,0,0|2,0,0]=4 6392 B9R0.6 CC(C(C)CNC)C(O)=O Amb25379230 [0,2,0,0,0,0|0,0,0]=2 6393 B9R0.6 CC(C(C)COC)C(C)=O Amb24701910 [0,2,0,0,0,0|1,0,0]=3 6394 B9R0.6 CC(C(C)COC)C(N)=O Amb25682872 [0,2,0,0,0,0|1,0,0]=3 6395 B9R0.6 CC(C(C)NC=O)C(O)=O Amb24543868 [0,2,0,0,0,0|1,0,1]=4 6396 B9R0.6 CC(C(C)NOC)C(O)=O Amb24465798 [0,2,0,0,0,0|1,0,0]=3 6397 B9R0.6 CC(C(N)=O)N(C)CCN Amb19013777 [0,2,0,0,0,0|2,0,0]=4 6398 B9R0.6 CC(C(N)CCC)C(O)=O Amb24763852 [0,2,0,0,0,0|1,0,0]=3 6399 B9R0.6 CC(C(O)=O)N(C)CC#C Amb18993822 [0,2,0,0,0,0|1,0,1]=4 6400 B9R0.6 CC(C(O)=O)N(C)CC#N Amb18983872 [0,2,0,0,0,0|1,0,1]=4 6401 B9R0.6 CC(C(O)=O)N(C)CC=C Amb18313114 [0,2,0,0,0,0|1,0,1]=4 6402 B9R0.6 CC(C(O)=O)N(C)CCN Amb19028451 [0,2,0,0,0,0|1,0,0]=3 6403 B9R0.6 CC(C(O)=O)S(=O)CCF Amb24638591 [0,2,0,0,0,0|2,0,0]=4 6404 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [0,2,0,0,0,0|1,0,0]=3 6405 B9R0.6 CC(C(O)\C=C\C)C(O)=O Amb18644138 [0,2,0,0,0,0|1,0,1]=4 6406 B9R0.6 CC(C=C=C)C(N)C(O)=O Amb25785751 [0,2,0,0,0,0|0,0,2]=4 6407 B9R0.6 CC(CC=C)C(=O)C(O)=O Amb25063844 [0,2,0,0,0,0|0,0,2]=4 6408 B9R0.6 CC(CCC)=C(Br)C(O)=O Amb25365223 [0,2,0,0,0,0|0,0,2]=4 6409 B9R0.6 CC(CCC)C(Br)C(N)=O Amb24451592 [0,2,0,0,0,0|1,0,0]=3 6410 B9R0.6 CC(CCC)C(Cl)C(N)=O Amb18800738 [0,2,0,0,0,0|1,0,0]=3 6411 B9R0.6 CC(CCC)C(F)C(C)=O Amb25146866 [0,2,0,0,0,0|1,0,0]=3 6412 B9R0.6 CC(CCC)C(N)C(C)=C Amb25357806 [0,2,0,0,0,0|2,0,0]=4 6413 B9R0.6 CC(CCC)C(N)C(O)=O Amb20622789 [0,2,0,0,0,0|0,0,0]=2 6414 B9R0.6 CC(CCC)C(O)C(C)=C Amb25140812 [0,2,0,0,0,0|2,0,0]=4 6415 B9R0.6 CC(CCC)C(S)C(O)=O Amb24438702 [0,2,0,0,0,0|0,0,0]=2 6416 B9R0.6 CC(CCCl)C(N)C(O)=O Amb25803640 [0,2,0,0,0,0|0,0,0]=2 6417 B9R0.6 CC(CCN)C(N)C(O)=O Amb25309114 [0,2,0,0,0,0|0,0,0]=2 6418 B9R0.6 CC(CCO)C(N)C(O)=O Amb25054791 [0,2,0,0,0,0|0,0,0]=2 6419 B9R0.6 CC(CCO)C(O)C(C)=C Amb24704631 [0,2,0,0,0,0|2,0,0]=4 6420 B9R0.6 CC(CCO)C(O)C(O)=O Amb24392760 [0,2,0,0,0,0|0,0,0]=2 6421 B9R0.6 CC(CCO)N(C)C(N)=O Amb25268566 [0,2,0,0,0,0|2,0,0]=4 6422 B9R0.6 CC(CCO)[C@H](N)C(O)=O Amb24744497 [0,2,0,0,0,0|0,0,0]=2 6423 B9R0.6 CC(COC)C(N)C(N)=O Amb24468545 [0,2,0,0,0,0|1,0,0]=3 6424 B9R0.6 CC(COC)C(N)C(O)=O Amb24116980 [0,2,0,0,0,0|0,0,0]=2 6425 B9R0.6 CC(COC)[C@H](N)C(O)=O Amb25729786 [0,2,0,0,0,0|0,0,0]=2 6426 B9R0.6 CC(CSC)[C@@H](N)C(O)=O Amb24482316 [0,2,0,0,0,0|0,0,0]=2 6427 B9R0.6 CC(N=[N+]=[N-])C(N)C(O)=O Amb24477179 [0,2,0,0,0,0|2,0,0]=4 6428 B9R0.6 CC(NCC)C(O)C(O)=O Amb25679409 [0,2,0,0,0,0|0,0,0]=2 6429 B9R0.6 CC(OCC)C(Br)C(O)=O Amb24416715 [0,2,0,0,0,0|0,0,0]=2 6430 B9R0.6 CC(OCC)[C@H](S)C(O)=O Amb25053429 [0,2,0,0,0,0|0,0,0]=2 6431 B9R0.6 CC(OCO)C(N)C(O)=O Amb24567906 [0,2,0,0,0,0|1,0,0]=3 6432 B9R0.6 CC([C@H](N)CCC)C(O)=O Amb25238448 [0,2,0,0,0,0|1,0,0]=3 6433 B9R0.6 CC(\C=C\C)C(Br)C(O)=O Amb25703798 [0,2,0,0,0,0|0,0,1]=3 6434 B9R0.6 CC(\C=C\C)C(F)C(O)=O Amb24595961 [0,2,0,0,0,0|0,0,1]=3 6435 B9R0.6 CC(\C=C\C)C(O)C(O)=O Amb18644120 [0,2,0,0,0,0|0,0,1]=3 6436 B9R0.6 CCCC(Br)C(O)C(O)=O Amb25229083 [0,2,0,0,0,0|1,0,0]=3 6437 B9R0.6 CCCC(C(C(=O)C)C)O Amb17593628 [0,2,0,0,0,0|2,0,0]=4 6438 B9R0.6 CCCC(C(C(=O)O)N)F Amb10839857 [0,2,0,0,0,0|1,0,0]=3 6439 B9R0.6 CCCC(C)C(=O)C(O)=O Amb24747027 [0,2,0,0,0,0|0,0,1]=3 6440 B9R0.6 CCCC(C)C(C)C(C)=O Amb24396748 [0,2,0,0,0,0|1,0,0]=3 6441 B9R0.6 CCCC(C)C(C)C(N)=O Amb25361926 [0,2,0,0,0,0|1,0,0]=3 6442 B9R0.6 CCCC(N)C(O)C(N)=O Amb20247342 [0,2,0,0,0,0|2,0,0]=4 6443 B9R0.6 CCCC(N)C(O)C(O)=O Amb20242874 [0,2,0,0,0,0|1,0,0]=3 6444 B9R0.6 CCCC(O)C(=C)C(O)=O Amb25131217 [0,2,0,0,0,0|1,0,1]=4 6445 B9R0.6 CCCC(O)C(Br)C(O)=O Amb24633342 [0,2,0,0,0,0|1,0,0]=3 6446 B9R0.6 CCCC(O)C(N)C(N)=O Amb25375285 [0,2,0,0,0,0|2,0,0]=4 6447 B9R0.6 CCCC(O)C(N)C(O)=O Amb18124815 [0,2,0,0,0,0|1,0,0]=3 6448 B9R0.6 CCCC(O)[C@@H](N)C(O)=O Amb25268432 [0,2,0,0,0,0|1,0,0]=3 6449 B9R0.6 CCCC(S)[C@H](N)C(O)=O Amb24359854 [0,2,0,0,0,0|1,0,0]=3 6450 B9R0.6 CCCN(C)C(C)C(N)=O Amb25663070 [0,2,0,0,0,0|2,0,0]=4 6451 B9R0.6 CCCN(C)[C@@H](C)C(O)=O Amb25834811 [0,2,0,0,0,0|1,0,0]=3 6452 B9R0.6 CCCN(C)[C@H](C)C(N)=O Amb25686765 [0,2,0,0,0,0|2,0,0]=4 6453 B9R0.6 CCCS(=O)C(C)C(O)=O Amb18304634 [0,2,0,0,0,0|2,0,0]=4 6454 B9R0.6 CCC[C@@H](N)[C@@H](O)C(O)=O Amb22747816 [0,2,0,0,0,0|1,0,0]=3 6455 B9R0.6 CCC[C@@H](N)[C@H](O)C(O)=O Amb22747809 [0,2,0,0,0,0|1,0,0]=3 6456 B9R0.6 CCC[C@@H](O)[C@@H](N)C(O)=O Amb25367288 [0,2,0,0,0,0|1,0,0]=3 6457 B9R0.6 CCC[C@@H](O)[C@H](N)C(O)=O Amb24715802 [0,2,0,0,0,0|1,0,0]=3 6458 B9R0.6 CCC[C@@H](O)[C@H](O)C(C)=O Amb25282703 [0,2,0,0,0,0|2,0,0]=4 6459 B9R0.6 CCC[C@@H](O)[C@H](O)C(O)=O Amb24480722 [0,2,0,0,0,0|1,0,0]=3 6460 B9R0.6 CCC[C@H](N)C(O)C(N)=O Amb25303990 [0,2,0,0,0,0|2,0,0]=4 6461 B9R0.6 CCC[C@H](N)[C@H](O)C(O)=O Amb25084552 [0,2,0,0,0,0|1,0,0]=3 6462 B9R0.6 CCC[C@H](O)[C@@H](Br)C(O)=O Amb25309541 [0,2,0,0,0,0|1,0,0]=3 6463 B9R0.6 CCC[C@H](O)[C@H](Br)C(O)=O Amb24727027 [0,2,0,0,0,0|1,0,0]=3 6464 B9R0.6 CCC[C@H](O)[C@H](N)C(O)=O Amb25113866 [0,2,0,0,0,0|1,0,0]=3 6465 B9R0.6 CCOC(=O)C(Br)C(O)=O Amb24729305 [0,2,0,0,0,0|1,0,1]=4 6466 B9R0.6 CCOC(=O)C(Cl)C(O)=O Amb18126462 [0,2,0,0,0,0|1,0,1]=4 6467 B9R0.6 CCOC(=O)C(F)C(O)=O Amb25774508 [0,2,0,0,0,0|1,0,1]=4 6468 B9R0.6 CCOC(=O)[C@@H](F)C(O)=O Amb24652368 [0,2,0,0,0,0|1,0,1]=4 6469 B9R0.6 CCOC(=O)[C@H](C)C(O)=O Amb25368327 [0,2,0,0,0,0|1,0,1]=4 6470 B9R0.6 CCOC(C)=C(C)C(O)=O Amb24629929 [0,2,0,0,0,0|0,0,2]=4 6471 B9R0.6 CCOC(C)C(C)C(C)O Amb25846233 [0,2,0,0,0,0|1,0,1]=4 6472 B9R0.6 CCOC(C)N(C)C(N)=O Amb24694930 [0,2,0,0,0,0|2,0,0]=4 6473 B9R0.6 CCSC(=O)C(C)C(O)=O Amb25032473 [0,2,0,0,0,0|1,0,1]=4 6474 B9R0.6 CCS\C(\C)=C(\C)/C(O)=O Amb24740679 [0,2,0,0,0,0|0,0,2]=4 6475 B9R0.6 CN(C(C(=O)Cl)C)CCO Amb17142906 [0,2,0,0,0,0|2,0,0]=4 6476 B9R0.6 CN(C(C(=O)N)C)CCO Amb17142867 [0,2,0,0,0,0|2,0,0]=4 6477 B9R0.6 CN(CCO)C(=O)C(O)=O Amb18970475 [0,2,0,0,0,0|1,0,1]=4 6478 B9R0.6 CNCC(C)N(C)C(C)=O Amb24096768 [0,2,0,0,0,0|2,0,0]=4 6479 B9R0.6 COCC(=C)C(O)C(O)=O Amb24607009 [0,2,0,0,0,0|0,0,2]=4 6480 B9R0.6 COCC(C)N(C)C(=O)Cl Amb25358263 [0,2,0,0,0,0|2,0,0]=4 6481 B9R0.6 COCC(O)C(N)C(O)=O Amb25147551 [0,2,0,0,0,0|1,0,0]=3 6482 B9R0.6 CSCC(C)N(C)C(=O)Cl Amb24479468 [0,2,0,0,0,0|2,0,0]=4 6483 B9R0.6 CSCC(C)N(C)C(C)=O Amb24432891 [0,2,0,0,0,0|2,0,0]=4 6484 B9R0.6 CSCC(O)C(N)C(O)=O Amb18646340 [0,2,0,0,0,0|1,0,0]=3 6485 B9R0.6 C[C@@H](CCC)[C@H](O)C(C)=C Amb25136114 [0,2,0,0,0,0|2,0,0]=4 6486 B9R0.6 C[C@@H](CCC)[C@H](O)C(O)=O Amb25368297 [0,2,0,0,0,0|0,0,0]=2 6487 B9R0.6 C[C@@H](CCF)[C@H](N)C(O)=O Amb25147533 [0,2,0,0,0,0|0,0,0]=2 6488 B9R0.6 C[C@@H](CCO)[C@@H](O)C(C)=C Amb25346351 [0,2,0,0,0,0|2,0,0]=4 6489 B9R0.6 C[C@@H](CCO)[C@H](N)C(O)=O Amb25709206 [0,2,0,0,0,0|0,0,0]=2 6490 B9R0.6 C[C@@H](OCC)[C@@H](N)C(O)=O Amb22747686 [0,2,0,0,0,0|0,0,0]=2 6491 B9R0.6 C[C@@H]([C@@H](C(=O)O)N)OCC Amb10807408 [0,2,0,0,0,0|0,0,0]=2 6492 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [0,2,0,0,0,0|1,0,0]=3 6493 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [0,2,0,0,0,0|1,0,0]=3 6494 B9R0.6 C[C@@H]([C@H](O)\C=C\C)C(O)=O Amb25340404 [0,2,0,0,0,0|1,0,1]=4 6495 B9R0.6 C[C@@H](\C=C\C)[C@@H](O)C(O)=O Amb24480683 [0,2,0,0,0,0|0,0,1]=3 6496 B9R0.6 C[C@@H](\C=C\C)[C@H](Br)C(O)=O Amb25309543 [0,2,0,0,0,0|0,0,1]=3 6497 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [0,2,0,0,0,0|1,0,0]=3 6498 B9R0.6 C[C@H](CC=C)[C@H](N)C(O)=O Amb25347201 [0,2,0,0,0,0|0,0,1]=3 6499 B9R0.6 C[C@H](CCC)[C@H](N)C(O)=O Amb25062732 [0,2,0,0,0,0|0,0,0]=2 6500 B9R0.6 C[C@H](CCC)[C@H](O)C(O)=O Amb25786123 [0,2,0,0,0,0|0,0,0]=2 6501 B9R0.6 C[C@H](CCF)[C@H](N)C(O)=O Amb25132099 [0,2,0,0,0,0|0,0,0]=2 6502 B9R0.6 C[C@H](CCO)[C@H](N)C(O)=O Amb25111969 [0,2,0,0,0,0|0,0,0]=2 6503 B9R0.6 C[C@H](CCO)[C@H](O)C(O)=O Amb25122108 [0,2,0,0,0,0|0,0,0]=2 6504 B9R0.6 C[C@H](CSC)[C@@H](N)C(O)=O Amb24642749 [0,2,0,0,0,0|0,0,0]=2 6505 B9R0.6 C[C@H](CSC)[C@H](N)C(O)=O Amb25851133 [0,2,0,0,0,0|0,0,0]=2 6506 B9R0.6 C[C@H]([C@@H](O)CCC)C(C)=O Amb25145582 [0,2,0,0,0,0|2,0,0]=4 6507 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [0,2,0,0,0,0|1,0,0]=3 6508 B9R0.6 C[C@H]([C@@H](O)\C=C\C)C(O)=O Amb24359088 [0,2,0,0,0,0|1,0,1]=4 6509 B9R0.6 C[C@H]([C@H](C)NOC)C(O)=O Amb24451571 [0,2,0,0,0,0|1,0,0]=3 6510 B9R0.6 C[C@H]([C@H](C)OC=O)C(O)=O Amb24479221 [0,2,0,0,0,0|1,0,1]=4 6511 B9R0.6 C[C@H]([C@H](O)CCC)C(C)=O Amb25128812 [0,2,0,0,0,0|2,0,0]=4 6512 B9R0.6 C[C@H]([C@H](O)\C=C\C)C(O)=O Amb25378724 [0,2,0,0,0,0|1,0,1]=4 6513 B9R0.6 C[C@H](\C=C\C)[C@H](F)C(O)=O Amb25727302 [0,2,0,0,0,0|0,0,1]=3 6514 B9R0.6 C\C(=C/CC)\C(C)C(C)=O Amb25146561 [0,2,0,0,0,0|1,0,1]=4 6515 B9R0.6 C\C(=C/CC)\C(O)C(N)=O Amb25147605 [0,2,0,0,0,0|1,0,1]=4 6516 B9R0.6 C\C(=C/CC)\[C@@H](O)C(C)=O Amb25821326 [0,2,0,0,0,0|1,0,1]=4 6517 B9R0.6 C\C(=C\CC)\C(O)C(O)=O Amb24568401 [0,2,0,0,0,0|0,0,1]=3 6518 B9R0.6 C\C=C\C(C)C(C)C(C)=O Amb24570391 [0,2,0,0,0,0|1,0,1]=4 6519 B9R0.6 C\C=C\[C@H](C)[C@H](C)C(N)=O Amb25314369 [0,2,0,0,0,0|1,0,1]=4 6520 B9R0.6 NC(C(S)CCO)C(O)=O Amb24724703 [0,2,0,0,0,0|1,0,0]=3 6521 B9R0.6 N[C@@H](C(S)CCO)C(O)=O Amb25320812 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.6 OCCC(O)C(O)C(O)=O Amb24482452 [0,2,0,0,0,0|1,0,0]=3 6523 B9R0.25 CC(C(N)CC)S(O)(=O)=O Amb24538064 [0,2,0,0,0,0|2,0,0]=4 6524 B9R0.25 CC(CC)[C@H](N)P(O)(O)=O Amb24742149 [0,2,0,0,0,0|1,0,0]=3 6525 B9R0.25 CCC(C)C(C)S(=O)(=O)Cl Amb18324777 [0,2,0,0,0,0|1,0,1]=4 6526 B9R0.25 CCC(C)C(C)S(N)(=O)=O Amb18183525 [0,2,0,0,0,0|1,0,1]=4 6527 B9R0.25 CCC(N)C(O)P(O)(O)=O Amb24427387 [0,2,0,0,0,0|2,0,0]=4 6528 B9R0.25 CCC(O)C(N)P(O)(O)=O Amb25109911 [0,2,0,0,0,0|2,0,0]=4 6529 B9R0.25 CC[C@H](N)[C@@H](O)P(O)(O)=O Amb25840959 [0,2,0,0,0,0|2,0,0]=4 6530 B9R0.25 C[C@@H](CC)[C@H](N)C(C)(C)O Amb22747498 [0,2,0,0,0,0|1,0,1]=4 6531 B9R0.25 C[C@@H](CC)[C@H](N)P(O)(O)=O Amb25853637 [0,2,0,0,0,0|1,0,0]=3 6532 B9R0.25 C[C@H](CC)C(O)S([O-])(=O)=O Amb24735219 [0,2,0,0,0,0|1,0,1]=4 6533 B9R0.25 C[C@H](CC)[C@@H](N)C(C)(C)O Amb25131231 [0,2,0,0,0,0|1,0,1]=4 6534 B9R0.27 CC(=CC)[C@H](O)C(=O)OC Amb25787374 [0,2,0,0,0,0|0,0,2]=4 6535 B9R0.27 CC(C(=O)CC)N(C)CC Amb24590355 [0,2,0,0,0,0|2,0,0]=4 6536 B9R0.27 CC(C(=O)OC)N(C)OC Amb24482762 [0,2,0,0,0,0|2,0,0]=4 6537 B9R0.27 CC(C(C)C=C)C(=O)OC Amb24607215 [0,2,0,0,0,0|0,0,2]=4 6538 B9R0.27 CC(C(C)C=O)C(=O)OC Amb25828591 [0,2,0,0,0,0|1,0,1]=4 6539 B9R0.27 CC(C(Cl)CC)C(=O)CC Amb25321929 [0,2,0,0,0,0|2,0,0]=4 6540 B9R0.27 CC(C(O)CC)C(=O)OC Amb24731247 [0,2,0,0,0,0|1,0,0]=3 6541 B9R0.27 CC(C(O)OC)C(=O)OC Amb25049424 [0,2,0,0,0,0|2,0,0]=4 6542 B9R0.27 CC(C=C)C(N)C(=O)OC Amb18644005 [0,2,0,0,0,0|0,0,2]=4 6543 B9R0.27 CC(C=C)C(N)C(=O)OC Amb24271135 [0,2,0,0,0,0|0,0,2]=4 6544 B9R0.27 CC(C=C)C(O)C(=O)OC Amb25125510 [0,2,0,0,0,0|0,0,2]=4 6545 B9R0.27 CC(C=C)[C@@H](O)C(=O)OC Amb24422774 [0,2,0,0,0,0|0,0,2]=4 6546 B9R0.27 CC(C=C)[C@H](O)C(=O)OC Amb25107561 [0,2,0,0,0,0|0,0,2]=4 6547 B9R0.27 CC(C=O)C(Br)C(=O)OC Amb24640254 [0,2,0,0,0,0|1,0,1]=4 6548 B9R0.27 CC(CC)C(=O)C(=O)CC Amb24383812 [0,2,0,0,0,0|1,0,1]=4 6549 B9R0.27 CC(CC)C(Br)C(=O)CC Amb25254147 [0,2,0,0,0,0|1,0,0]=3 6550 B9R0.27 CC(CC)C(Cl)C(=O)NC Amb18800740 [0,2,0,0,0,0|1,0,0]=3 6551 B9R0.27 CC(CC)C(Cl)C(=O)OC Amb18800857 [0,2,0,0,0,0|0,0,0]=2 6552 B9R0.27 CC(CC)C(N)C(=O)CBr Amb24740869 [0,2,0,0,0,0|1,0,0]=3 6553 B9R0.27 CC(CC)C(N)C(=O)CCl Amb25779268 [0,2,0,0,0,0|1,0,0]=3 6554 B9R0.27 CC(CC)C(N)C(=O)NN Amb25146438 [0,2,0,0,0,0|1,0,0]=3 6555 B9R0.27 CC(CC)C(N)C(=O)NO Amb24572995 [0,2,0,0,0,0|0,0,0]=2 6556 B9R0.27 CC(CC)C(O)C(=O)CC Amb25718578 [0,2,0,0,0,0|1,0,0]=3 6557 B9R0.27 CC(CC)C(O)C(=O)NC Amb25209606 [0,2,0,0,0,0|1,0,0]=3 6558 B9R0.27 CC(CC)C(O)C(=O)OC Amb23596600 [0,2,0,0,0,0|0,0,0]=2 6559 B9R0.27 CC(CC)[C@@H](N)C(=O)NO Amb22800472 [0,2,0,0,0,0|0,0,0]=2 6560 B9R0.27 CC(CC)[C@@H](N)C(=O)OC Amb25111579 [0,2,0,0,0,0|0,0,0]=2 6561 B9R0.27 CC(CC)[C@H](N)C(=O)NN Amb25279310 [0,2,0,0,0,0|1,0,0]=3 6562 B9R0.27 CC(CC)[C@H](O)C(=O)OC Amb25136173 [0,2,0,0,0,0|0,0,0]=2 6563 B9R0.27 CC(NC)C(Cl)C(=O)OC Amb25139466 [0,2,0,0,0,0|1,0,0]=3 6564 B9R0.27 CC(OC)C(Cl)C(=O)NC Amb24588762 [0,2,0,0,0,0|2,0,0]=4 6565 B9R0.27 CC(OC)C(Cl)C(=O)OC Amb24373136 [0,2,0,0,0,0|1,0,0]=3 6566 B9R0.27 CC(OC)C(N)C(=O)OC Amb25111509 [0,2,0,0,0,0|1,0,0]=3 6567 B9R0.27 CC(OC)C(O)C(=O)OC Amb25234709 [0,2,0,0,0,0|1,0,0]=3 6568 B9R0.27 CC(ON)C(N)C(=O)OC Amb25075953 [0,2,0,0,0,0|2,0,0]=4 6569 B9R0.27 CC([C@@H](O)CC)C(=O)OC Amb25740781 [0,2,0,0,0,0|1,0,0]=3 6570 B9R0.27 CCC(=O)C(Br)C(=O)OC Amb25214433 [0,2,0,0,0,0|1,0,1]=4 6571 B9R0.27 CCC(=O)C(C)C(C)OC Amb25374408 [0,2,0,0,0,0|2,0,0]=4 6572 B9R0.27 CCC(=O)C(Cl)C(=O)OC Amb18368799 [0,2,0,0,0,0|1,0,1]=4 6573 B9R0.27 CCC(=O)C(N)C(=O)OC Amb18124723 [0,2,0,0,0,0|1,0,1]=4 6574 B9R0.27 CCC(Br)C(=O)C(=O)OC Amb25187252 [0,2,0,0,0,0|1,0,1]=4 6575 B9R0.27 CCC(C(C(=O)OC)N)C Amb1154182 [0,2,0,0,0,0|0,0,0]=2 6576 B9R0.27 CCC(C)=C(C)C(=O)OC Amb25763729 [0,2,0,0,0,0|0,0,2]=4 6577 B9R0.27 CCC(C)C(=O)C(=O)CBr Amb24477159 [0,2,0,0,0,0|1,0,1]=4 6578 B9R0.27 CCC(C)C(=O)C(=O)OC Amb25145521 [0,2,0,0,0,0|0,0,1]=3 6579 B9R0.27 CCC(C)C(C)C(=O)NC Amb25058995 [0,2,0,0,0,0|1,0,0]=3 6580 B9R0.27 CCC(C)C(C)C(=O)NO Amb25761241 [0,2,0,0,0,0|0,0,0]=2 6581 B9R0.27 CCC(C)C(C)C(N)CO Amb24425754 [0,2,0,0,0,0|1,0,1]=4 6582 B9R0.27 CCC(C)C(C)C(O)C=O Amb25101847 [0,2,0,0,0,0|0,0,1]=3 6583 B9R0.27 CCC(C)C(O)C(C)OC Amb25839336 [0,2,0,0,0,0|1,0,1]=4 6584 B9R0.27 CCC(C)N(C)C(=O)CBr Amb24674753 [0,2,0,0,0,0|2,0,0]=4 6585 B9R0.27 CCC(C)N(C)C(=O)CO Amb25788008 [0,2,0,0,0,0|1,0,0]=3 6586 B9R0.27 CCC(C)N(C)C(=O)OC Amb25143649 [0,2,0,0,0,0|1,0,0]=3 6587 B9R0.27 CCC(C)[C@@H](O)[C@@H](C)CO Amb25236166 [0,2,0,0,0,0|1,0,1]=4 6588 B9R0.27 CCC(Cl)C(Cl)C(=O)OC Amb24675863 [0,2,0,0,0,0|1,0,0]=3 6589 B9R0.27 CCC(F)C(=O)C(=O)OC Amb25142683 [0,2,0,0,0,0|1,0,1]=4 6590 B9R0.27 CCC(N)C(O)C(=O)OC Amb24459819 [0,2,0,0,0,0|1,0,0]=3 6591 B9R0.27 CCC(O)C(Cl)C(=O)OC Amb24400655 [0,2,0,0,0,0|1,0,0]=3 6592 B9R0.27 CCC(O)C(N)C(=O)OC Amb18644322 [0,2,0,0,0,0|1,0,0]=3 6593 B9R0.27 CCC(O)C(O)C(=O)CO Amb25146801 [0,2,0,0,0,0|1,0,0]=3 6594 B9R0.27 CCC(O)C(O)C(=O)OC Amb24457791 [0,2,0,0,0,0|1,0,0]=3 6595 B9R0.27 CCC(O)C(O)C(O)C=O Amb25833335 [0,2,0,0,0,0|1,0,1]=4 6596 B9R0.27 CCC([C@@H](C(=O)NC)N)C Amb17231991 [0,2,0,0,0,0|1,0,0]=3 6597 B9R0.27 CCC([C@@H](C(=O)OC)N)C Amb10807496 [0,2,0,0,0,0|0,0,0]=2 6598 B9R0.27 CCN(C)C(=O)C(=O)OC Amb24478461 [0,2,0,0,0,0|1,0,1]=4 6599 B9R0.27 CCN(C)C(C)C(=O)NC Amb24485058 [0,2,0,0,0,0|2,0,0]=4 6600 B9R0.27 CCN(C)C(C)C(=O)OC Amb24505224 [0,2,0,0,0,0|1,0,0]=3 6601 B9R0.27 CCS(=O)C(C)C(=O)OC Amb18798266 [0,2,0,0,0,0|2,0,0]=4 6602 B9R0.27 CC[C@@H](C)[C@@H](O)[C@H](C)CO Amb25681382 [0,2,0,0,0,0|1,0,1]=4 6603 B9R0.27 CC[C@@H](O)[C@@H](O)C(=O)CO Amb25663072 [0,2,0,0,0,0|1,0,0]=3 6604 B9R0.27 CC[C@H](C)C(=O)C(=O)OC Amb24570432 [0,2,0,0,0,0|0,0,1]=3 6605 B9R0.27 CC[C@H](C)[C@@H](O)[C@H](C)CO Amb25719773 [0,2,0,0,0,0|1,0,1]=4 6606 B9R0.27 CC[C@H](O)[C@@H](O)C(=O)CO Amb25370711 [0,2,0,0,0,0|1,0,0]=3 6607 B9R0.27 CC[C@H](O)[C@H](O)C(=O)CO Amb24478272 [0,2,0,0,0,0|1,0,0]=3 6608 B9R0.27 CC[C@H]([C@@H](C(=O)OC)N)C Amb10844606 [0,2,0,0,0,0|0,0,0]=2 6609 B9R0.27 COC(=O)C(=C)C(C)CO Amb25335437 [0,2,0,0,0,0|1,0,1]=4 6610 B9R0.27 COC(=O)C(Br)C(Br)CBr Amb20241612 [0,2,0,0,0,0|2,0,0]=4 6611 B9R0.27 COC(=O)C(Br)C(O)CBr Amb25293763 [0,2,0,0,0,0|2,0,0]=4 6612 B9R0.27 COC(=O)C(C)C(C)SC Amb25851772 [0,2,0,0,0,0|1,0,0]=3 6613 B9R0.27 COC(=O)C(F)C(O)CO Amb25120052 [0,2,0,0,0,0|2,0,0]=4 6614 B9R0.27 COC(=O)C(O)C(F)CBr Amb24477361 [0,2,0,0,0,0|2,0,0]=4 6615 B9R0.27 COC(=O)C(O)C(F)CO Amb25097732 [0,2,0,0,0,0|2,0,0]=4 6616 B9R0.27 COC(=O)C(O)C(N)CO Amb25288549 [0,2,0,0,0,0|2,0,0]=4 6617 B9R0.27 COC(=O)N(C)C(C)CN Amb18908397 [0,2,0,0,0,0|2,0,0]=4 6618 B9R0.27 COC(=O)N(C)[C@@H](C)CO Amb24482597 [0,2,0,0,0,0|2,0,0]=4 6619 B9R0.27 COC(=O)N(C)[C@H](C)CO Amb24573876 [0,2,0,0,0,0|2,0,0]=4 6620 B9R0.27 COC(=O)[C@@H](Br)[C@H](O)CO Amb25288997 [0,2,0,0,0,0|2,0,0]=4 6621 B9R0.27 COC(=O)[C@@H](F)[C@@H](O)CO Amb24353362 [0,2,0,0,0,0|2,0,0]=4 6622 B9R0.27 COC(=O)[C@@H](O)[C@@H](F)CBr Amb24477336 [0,2,0,0,0,0|2,0,0]=4 6623 B9R0.27 COC(=O)[C@@H](O)[C@@H](F)CO Amb24524431 [0,2,0,0,0,0|2,0,0]=4 6624 B9R0.27 COC(=O)[C@@H](O)[C@H](F)CO Amb25712976 [0,2,0,0,0,0|2,0,0]=4 6625 B9R0.27 COC(=O)[C@@H](O)[C@H](N)CO Amb25265465 [0,2,0,0,0,0|2,0,0]=4 6626 B9R0.27 COC(=O)[C@H](O)[C@@H](O)CCl Amb24480650 [0,2,0,0,0,0|2,0,0]=4 6627 B9R0.27 COC(=O)[C@H](O)[C@H](O)CBr Amb25311327 [0,2,0,0,0,0|2,0,0]=4 6628 B9R0.27 COC(C)N(C)C(=O)CO Amb24474156 [0,2,0,0,0,0|2,0,0]=4 6629 B9R0.27 CSC(C)C(C)C(=O)NN Amb25356697 [0,2,0,0,0,0|2,0,0]=4 6630 B9R0.27 C[C@@H](C(O)CC)C(=O)CC Amb25735211 [0,2,0,0,0,0|2,0,0]=4 6631 B9R0.27 C[C@@H](CC)C(O)C(=O)OC Amb25077852 [0,2,0,0,0,0|0,0,0]=2 6632 B9R0.27 C[C@@H](CC)[C@@H](N)C(=O)OC Amb22747221 [0,2,0,0,0,0|0,0,0]=2 6633 B9R0.27 C[C@@H](CC)[C@@H](O)C(=O)OC Amb25320601 [0,2,0,0,0,0|0,0,0]=2 6634 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)CC Amb25790371 [0,2,0,0,0,0|1,0,0]=3 6635 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NC Amb24478007 [0,2,0,0,0,0|1,0,0]=3 6636 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NN Amb25146437 [0,2,0,0,0,0|1,0,0]=3 6637 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NO Amb25146430 [0,2,0,0,0,0|0,0,0]=2 6638 B9R0.27 C[C@@H](NC)[C@H](Cl)C(=O)OC Amb24482166 [0,2,0,0,0,0|1,0,0]=3 6639 B9R0.27 C[C@@H](OC)C(=O)C(=O)OC Amb25146480 [0,2,0,0,0,0|1,0,1]=4 6640 B9R0.27 C[C@@H](ON)[C@H](N)C(=O)OC Amb25378740 [0,2,0,0,0,0|2,0,0]=4 6641 B9R0.27 C[C@@H](SC)[C@H](Cl)C(=O)OC Amb24470163 [0,2,0,0,0,0|1,0,0]=3 6642 B9R0.27 C[C@@H]([C@@H](C)C=O)C(=O)OC Amb25142663 [0,2,0,0,0,0|1,0,1]=4 6643 B9R0.27 C[C@@H]([C@@H](C)CO)C(=O)OC Amb25279746 [0,2,0,0,0,0|1,0,0]=3 6644 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)CC Amb25266330 [0,2,0,0,0,0|2,0,0]=4 6645 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)NO Amb25058433 [0,2,0,0,0,0|1,0,0]=3 6646 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)OC Amb25769352 [0,2,0,0,0,0|1,0,0]=3 6647 B9R0.27 C[C@@H]([C@H](C)C=C)C(=O)OC Amb25780851 [0,2,0,0,0,0|0,0,2]=4 6648 B9R0.27 C[C@@H]([C@H](O)CC)C(=O)CC Amb25146623 [0,2,0,0,0,0|2,0,0]=4 6649 B9R0.27 C[C@@H]([C@H](O)CC)C(=O)OC Amb24556034 [0,2,0,0,0,0|1,0,0]=3 6650 B9R0.27 C[C@H](C=C)[C@@H](O)C(=O)OC Amb25097689 [0,2,0,0,0,0|0,0,2]=4 6651 B9R0.27 C[C@H](CO)N(C)C(=O)CO Amb24749523 [0,2,0,0,0,0|2,0,0]=4 6652 B9R0.27 C[C@H](NC)[C@H](Cl)C(=O)OC Amb24482167 [0,2,0,0,0,0|1,0,0]=3 6653 B9R0.27 C[C@H](OC)[C@H](Br)C(=O)OC Amb24502160 [0,2,0,0,0,0|1,0,0]=3 6654 B9R0.27 C[C@H](SC)[C@H](Cl)C(=O)OC Amb25684816 [0,2,0,0,0,0|1,0,0]=3 6655 B9R0.27 C[C@H]([C@@H](O)CC)C(=O)CC Amb25853384 [0,2,0,0,0,0|2,0,0]=4 6656 B9R0.27 C[C@H]([C@H](O)CC)C(=O)OC Amb25045706 [0,2,0,0,0,0|1,0,0]=3 6657 B9R0.27 C\C(=C/C)\C(O)C(=O)CO Amb25360465 [0,2,0,0,0,0|0,0,2]=4 6658 B9R0.27 C\C(=C\C)\[C@@H](N)C(=O)OC Amb25367761 [0,2,0,0,0,0|0,0,2]=4 6659 B9R0.27 OC(CO)C(O)C(=O)CO Amb25099014 [0,2,0,0,0,0|2,0,0]=4 6660 B9R0.27 OC(CO)[C@H](O)C(=O)CO Amb25146835 [0,2,0,0,0,0|2,0,0]=4 6661 B9R0.27 OCC(=O)C(O)C(O)CF Amb25830531 [0,2,0,0,0,0|2,0,0]=4 6662 B9R0.27 OCC(=O)[C@@H](O)C(O)CF Amb25146806 [0,2,0,0,0,0|2,0,0]=4 6663 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CBr Amb24477214 [0,2,0,0,0,0|2,0,0]=4 6664 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CCl Amb24562237 [0,2,0,0,0,0|2,0,0]=4 6665 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CS Amb25839360 [0,2,0,0,0,0|2,0,0]=4 6666 B9R0.27 OCC(O)C(O)C(=O)NO Amb25676772 [0,2,0,0,0,0|2,0,0]=4 6667 B9R0.27 OC[C@@H](O)[C@H](O)C(=O)NO Amb25057744 [0,2,0,0,0,0|2,0,0]=4 6668 B9R0.27 O[C@@H](CO)[C@@H](O)C(=O)CO Amb22800928 [0,2,0,0,0,0|2,0,0]=4 6669 B9R0.27 O[C@@H](CO)[C@H](O)C(=O)CO Amb22352819 [0,2,0,0,0,0|2,0,0]=4 6670 B9R0.27 O[C@H](CO)[C@@H](O)C(=O)CO Amb22230606 [0,2,0,0,0,0|2,0,0]=4 6671 B9R0.28 CC(C#C)C(C)(N)C(O)=O Amb25061187 [0,2,0,0,0,0|0,0,2]=4 6672 B9R0.28 CC(C)([C@H](N)CO)C(O)=O Amb25245841 [0,2,0,0,0,0|2,0,0]=4 6673 B9R0.28 CC(C=C)C(C)(C)C(O)=O Amb25073155 [0,2,0,0,0,0|0,0,2]=4 6674 B9R0.28 CC(C=C)C(C)(F)C(O)=O Amb24617972 [0,2,0,0,0,0|0,0,2]=4 6675 B9R0.28 CC(C=C)C(C)(N)C(O)=O Amb25147471 [0,2,0,0,0,0|0,0,2]=4 6676 B9R0.28 CC(C=C)C(C)(O)C(O)=O Amb18644094 [0,2,0,0,0,0|0,0,2]=4 6677 B9R0.28 CC(C=C)C(F)(Cl)C(O)=O Amb25124094 [0,2,0,0,0,0|0,0,2]=4 6678 B9R0.28 CC(C=C)C(F)(F)C(O)=O Amb25100968 [0,2,0,0,0,0|0,0,2]=4 6679 B9R0.28 CC(C=O)C(C)(C)C(O)=O Amb25063874 [0,2,0,0,0,0|1,0,1]=4 6680 B9R0.28 CC(CN)C(C)(O)C(O)=O Amb24700228 [0,2,0,0,0,0|1,0,0]=3 6681 B9R0.28 CC(O)([C@H](O)CO)C(O)=O Amb24524547 [0,2,0,0,0,0|2,0,0]=4 6682 B9R0.28 CCC(Br)C(C)(O)C(O)=O Amb24478191 [0,2,0,0,0,0|1,0,0]=3 6683 B9R0.28 CCC(C)C(C)(N)C(N)=O Amb18289874 [0,2,0,0,0,0|1,0,0]=3 6684 B9R0.28 CCC(C)C(N)(O)C(O)=O Amb25147278 [0,2,0,0,0,0|0,0,0]=2 6685 B9R0.28 CCC(O)C(C)(O)C(O)=O Amb18644353 [0,2,0,0,0,0|1,0,0]=3 6686 B9R0.28 CCC(O)C(F)(F)C(O)=O Amb18796752 [0,2,0,0,0,0|1,0,0]=3 6687 B9R0.28 CCN(C)C(C)(C)C(O)=O Amb18302285 [0,2,0,0,0,0|1,0,0]=3 6688 B9R0.28 CCN(C)C(C)(C)C(O)=O Amb22099527 [0,2,0,0,0,0|1,0,0]=3 6689 B9R0.28 CCS(=O)C(C)(C)C(O)=O Amb25679415 [0,2,0,0,0,0|2,0,0]=4 6690 B9R0.28 CCS(=O)C(F)(F)C(O)=O Amb24726893 [0,2,0,0,0,0|2,0,0]=4 6691 B9R0.28 CC[C@@H](C)C(N)(N)C(O)=O Amb25147542 [0,2,0,0,0,0|0,0,0]=2 6692 B9R0.28 CC[C@@H](O)[C@](C)(O)C(C)=O Amb25373304 [0,2,0,0,0,0|2,0,0]=4 6693 B9R0.28 CC[C@@H](O)[C@](C)(O)C(O)=O Amb25111955 [0,2,0,0,0,0|1,0,0]=3 6694 B9R0.28 CC[C@H](C)C(C)(C)C(N)=O Amb25261342 [0,2,0,0,0,0|1,0,0]=3 6695 B9R0.28 CC[C@H](C)C(C)(C)C(O)=O Amb24480772 [0,2,0,0,0,0|0,0,0]=2 6696 B9R0.28 CC[C@H](C)[C@](C)(N)C(O)=O Amb24538030 [0,2,0,0,0,0|0,0,0]=2 6697 B9R0.28 CC[C@H](O)[C@](C)(O)C(C)=O Amb25735127 [0,2,0,0,0,0|2,0,0]=4 6698 B9R0.28 CC[C@H](O)[C@](C)(O)C(O)=O Amb24624659 [0,2,0,0,0,0|1,0,0]=3 6699 B9R0.28 COC(C)C(C)(C)C(O)=O Amb25211514 [0,2,0,0,0,0|1,0,0]=3 6700 B9R0.28 COC(C)C(C)(N)C(N)=O Amb25361711 [0,2,0,0,0,0|2,0,0]=4 6701 B9R0.28 COC(C)C(C)(N)C(O)=O Amb25336838 [0,2,0,0,0,0|1,0,0]=3 6702 B9R0.28 COC(C)C(C)(O)C(C)=O Amb24722344 [0,2,0,0,0,0|2,0,0]=4 6703 B9R0.28 COC(C)C(C)(O)C(N)=O Amb24722981 [0,2,0,0,0,0|2,0,0]=4 6704 B9R0.28 C[C@@H](C#C)[C@](C)(O)C(O)=O Amb24480794 [0,2,0,0,0,0|0,0,2]=4 6705 B9R0.28 C[C@@H](C=C)[C@](C)(N)C(O)=O Amb24573053 [0,2,0,0,0,0|0,0,2]=4 6706 B9R0.28 C[C@@H](C=C)[C@](C)(O)C(O)=O Amb24683050 [0,2,0,0,0,0|0,0,2]=4 6707 B9R0.28 C[C@@H](CN)[C@](C)(O)C(O)=O Amb25366576 [0,2,0,0,0,0|1,0,0]=3 6708 B9R0.28 C[C@@](O)([C@H](O)CO)C(O)=O Amb24687216 [0,2,0,0,0,0|2,0,0]=4 6709 B9R0.28 C[C@H](C#C)[C@](C)(O)C(O)=O Amb24480793 [0,2,0,0,0,0|0,0,2]=4 6710 B9R0.28 C[C@H](C=C)[C@](C)(N)C(O)=O Amb25757514 [0,2,0,0,0,0|0,0,2]=4 6711 B9R0.28 N[C@@H](CO)C(F)(F)C(O)=O Amb24479410 [0,2,0,0,0,0|2,0,0]=4 6712 B9R0.28 OC(=O)C(F)(Cl)C(Cl)CCl Amb24477396 [0,2,0,0,0,0|2,0,0]=4 6713 B9R0.29 CC(=O)\C(=N/O)\C(C)CC Amb25146515 [0,2,0,0,0,0|1,0,1]=4 6714 B9R0.29 CC(C=C)C(CC)C(O)=O Amb18643888 [0,2,0,0,0,0|0,0,2]=4 6715 B9R0.29 CC(CC)=C(C#N)C(O)=O Amb25203845 [0,2,0,0,0,0|0,0,2]=4 6716 B9R0.29 CC(CC)=C(CC)C(O)=O Amb24662984 [0,2,0,0,0,0|0,0,2]=4 6717 B9R0.29 CC(CC)C(C#N)C(N)=O Amb24590058 [0,2,0,0,0,0|1,0,0]=3 6718 B9R0.29 CC(CC)C(C=C)C(O)=O Amb25076396 [0,2,0,0,0,0|0,0,0]=2 6719 B9R0.29 CC(CC)C(CC)C(C)=O Amb25775510 [0,2,0,0,0,0|1,0,0]=3 6720 B9R0.29 CC(CC)C(CC)C(C)O Amb24529315 [0,2,0,0,0,0|1,0,1]=4 6721 B9R0.29 CC(CC)C(NBr)C(O)=O Amb25125862 [0,2,0,0,0,0|0,0,0]=2 6722 B9R0.29 CC(CC)C(NC)C(C)=C Amb25069442 [0,2,0,0,0,0|2,0,0]=4 6723 B9R0.29 CC(CC)C(NC)C(N)=O Amb18304752 [0,2,0,0,0,0|1,0,0]=3 6724 B9R0.29 CC(CC)C(NCl)C(O)=O Amb25279236 [0,2,0,0,0,0|0,0,0]=2 6725 B9R0.29 CC(CC)C(NN)C(C)=C Amb24523120 [0,2,0,0,0,0|2,0,0]=4 6726 B9R0.29 CC(CC)C(NN)C(N)=O Amb24479121 [0,2,0,0,0,0|1,0,0]=3 6727 B9R0.29 CC(CC)C(NN)C(O)=O Amb24398974 [0,2,0,0,0,0|0,0,0]=2 6728 B9R0.29 CC(CC)C(NO)C(O)=O Amb25378713 [0,2,0,0,0,0|0,0,0]=2 6729 B9R0.29 CC(CC)C(OC)C(N)=O Amb25084689 [0,2,0,0,0,0|1,0,0]=3 6730 B9R0.29 CC(CC)C(OC)C(O)=O Amb24563898 [0,2,0,0,0,0|0,0,0]=2 6731 B9R0.29 CC(CC)C(SC)C(O)=O Amb25076827 [0,2,0,0,0,0|0,0,0]=2 6732 B9R0.29 CC(CC)N(CC)C(=O)Cl Amb24352847 [0,2,0,0,0,0|2,0,0]=4 6733 B9R0.29 CC(CC)N(CC)C(C)=O Amb25369883 [0,2,0,0,0,0|2,0,0]=4 6734 B9R0.29 CC(CO)C(NC)C(O)=O Amb18644323 [0,2,0,0,0,0|1,0,0]=3 6735 B9R0.29 CC(OC)C(CC)C(O)=O Amb24597787 [0,2,0,0,0,0|1,0,0]=3 6736 B9R0.29 CC(OC)C(NC)C(O)=O Amb24117895 [0,2,0,0,0,0|1,0,0]=3 6737 B9R0.29 CC(OC)C(NC)C(O)=O Amb24596308 [0,2,0,0,0,0|1,0,0]=3 6738 B9R0.29 CC=C(C(C)OC)C(O)=O Amb24574145 [0,2,0,0,0,0|1,0,1]=4 6739 B9R0.29 CCC(C(CC)C)C(=O)N Amb17621194 [0,2,0,0,0,0|1,0,0]=3 6740 B9R0.29 CCC(C)C(=NO)C(N)=O Amb24681014 [0,2,0,0,0,0|1,0,1]=4 6741 B9R0.29 CCC(C)N(N=O)C(N)=O Amb24505117 [0,2,0,0,0,0|2,0,0]=4 6742 B9R0.29 CCC(O)C(=CC)C(O)=O Amb24622470 [0,2,0,0,0,0|1,0,1]=4 6743 B9R0.29 CCC(O)C(C=C)C(O)=O Amb18644141 [0,2,0,0,0,0|1,0,0]=3 6744 B9R0.29 CCC(O)C(NC)C(O)=O Amb25046706 [0,2,0,0,0,0|1,0,0]=3 6745 B9R0.29 CCC(O)C(OC)C(O)=O Amb18644355 [0,2,0,0,0,0|1,0,0]=3 6746 B9R0.29 CCC(O)\C(=C/C)\C(O)=O Amb18644125 [0,2,0,0,0,0|1,0,1]=4 6747 B9R0.29 CCN(C)C(C=C)C(O)=O Amb24481160 [0,2,0,0,0,0|1,0,0]=3 6748 B9R0.29 CCN(C)C(CN)C(O)=O Amb24697507 [0,2,0,0,0,0|1,0,0]=3 6749 B9R0.29 CCN(O)C(CN)C(O)=O Amb24548240 [0,2,0,0,0,0|2,0,0]=4 6750 B9R0.29 CCS(=O)C(CC)C(O)=O Amb18306058 [0,2,0,0,0,0|2,0,0]=4 6751 B9R0.29 CC[C@@H](O)[C@H](C=C)C(O)=O Amb24480681 [0,2,0,0,0,0|1,0,0]=3 6752 B9R0.29 CC[C@@H]([C@@H](C(=O)O)NC)C Amb16183967 [0,2,0,0,0,0|0,0,0]=2 6753 B9R0.29 CC[C@H](N)[C@H](CC)C(O)=O Amb24505157 [0,2,0,0,0,0|1,0,0]=3 6754 B9R0.29 CC[C@H](O)[C@H](NC)C(O)=O Amb24446992 [0,2,0,0,0,0|1,0,0]=3 6755 B9R0.29 CN(CC)[C@@H](CC)C(O)=O Amb25859429 [0,2,0,0,0,0|1,0,0]=3 6756 B9R0.29 CO[C@H]([C@@H](O)CO)C(O)=O Amb25065328 [0,2,0,0,0,0|2,0,0]=4 6757 B9R0.29 CO[C@H]([C@H](O)CO)C(O)=O Amb25053877 [0,2,0,0,0,0|2,0,0]=4 6758 B9R0.29 C[C@@H](C#C)[C@@H](CC)C(O)=O Amb24716321 [0,2,0,0,0,0|0,0,2]=4 6759 B9R0.29 C[C@@H](C=C)[C@H](CC)C(O)=O Amb25064183 [0,2,0,0,0,0|0,0,2]=4 6760 B9R0.29 C[C@@H](C=C)[C@H](OC)C(O)=O Amb25824161 [0,2,0,0,0,0|0,0,2]=4 6761 B9R0.29 C[C@@H](CC)[C@@H](CC)C(O)=O Amb24713592 [0,2,0,0,0,0|0,0,0]=2 6762 B9R0.29 C[C@@H](CC)[C@@H](CN)C(O)=O Amb25147293 [0,2,0,0,0,0|0,0,0]=2 6763 B9R0.29 C[C@@H](CC)[C@@H](NC)C(O)=O Amb25132156 [0,2,0,0,0,0|0,0,0]=2 6764 B9R0.29 C[C@@H](CC)[C@H](CN)C(O)=O Amb25791124 [0,2,0,0,0,0|0,0,0]=2 6765 B9R0.29 C[C@@H](CC)[C@H](NBr)C(O)=O Amb24640231 [0,2,0,0,0,0|0,0,0]=2 6766 B9R0.29 C[C@@H](CC)[C@H](NC)C(O)=O Amb22747123 [0,2,0,0,0,0|0,0,0]=2 6767 B9R0.29 C[C@@H](CC)[C@H](NN)C(O)=O Amb25102747 [0,2,0,0,0,0|0,0,0]=2 6768 B9R0.29 C[C@@H](OC)[C@H](NC)C(O)=O Amb25340790 [0,2,0,0,0,0|1,0,0]=3 6769 B9R0.29 C[C@@H](OC)[C@H](OC)C(O)=O Amb25677780 [0,2,0,0,0,0|1,0,0]=3 6770 B9R0.29 C[C@H](C=C)[C@@H](CC)C(O)=O Amb25339204 [0,2,0,0,0,0|0,0,2]=4 6771 B9R0.29 C[C@H](CC)[C@H](C=C)C(O)=O Amb24561616 [0,2,0,0,0,0|0,0,0]=2 6772 B9R0.29 C[C@H](CC)[C@H](NC)C(O)=O Amb24544666 [0,2,0,0,0,0|0,0,0]=2 6773 B9R0.29 C[C@H](OC)[C@H](NC)C(O)=O Amb24478844 [0,2,0,0,0,0|1,0,0]=3 6774 B9R0.29 NC[C@@H]([C@H](O)CF)C(O)=O Amb25102471 [0,2,0,0,0,0|2,0,0]=4 6775 B9R0.32 CC(=O)C(=C)C(C)(C)CC Amb25729012 [0,2,0,0,0,0|1,0,1]=4 6776 B9R0.32 CC(C(O)=O)C(C)(C)C=C Amb18643892 [0,2,0,0,0,0|0,0,2]=4 6777 B9R0.32 CC(C(O)=O)C(C)(O)C#N Amb25367972 [0,2,0,0,0,0|1,0,1]=4 6778 B9R0.32 CC(C)(C=C)C(N)C(O)=O Amb25703173 [0,2,0,0,0,0|0,0,2]=4 6779 B9R0.32 CC(C)(C=C)C(O)C(O)=O Amb25789992 [0,2,0,0,0,0|0,0,2]=4 6780 B9R0.32 CC(C)(C=O)C(O)C(O)=O Amb25118019 [0,2,0,0,0,0|1,0,1]=4 6781 B9R0.32 CC(C)(CCl)C(N)C(O)=O Amb24558312 [0,2,0,0,0,0|1,0,0]=3 6782 B9R0.32 CC(C)(CN)[C@@H](O)C(O)=O Amb25757349 [0,2,0,0,0,0|1,0,0]=3 6783 B9R0.32 CC(C)(CO)C(O)C(=O)Cl Amb24480409 [0,2,0,0,0,0|2,0,0]=4 6784 B9R0.32 CC(C)(CO)C(O)C(O)=O Amb18644357 [0,2,0,0,0,0|1,0,0]=3 6785 B9R0.32 CC(C)(CO)C(O)C([O-])=O Amb24118017 [0,2,0,0,0,0|1,0,1]=4 6786 B9R0.32 CC(C)(CO)[C@H](N)C(O)=O Amb25265734 [0,2,0,0,0,0|1,0,0]=3 6787 B9R0.32 CC(C)(CO)[C@H](O)C(N)=O Amb25858946 [0,2,0,0,0,0|2,0,0]=4 6788 B9R0.32 CC(C)(SS)C(N)C(O)=O Amb25282986 [0,2,0,0,0,0|2,0,0]=4 6789 B9R0.32 CC(O)(CF)C(O)C(O)=O Amb24440807 [0,2,0,0,0,0|1,0,0]=3 6790 B9R0.32 CC(O)C(C)C(C)(O)CC Amb25676790 [0,2,0,0,0,0|1,0,1]=4 6791 B9R0.32 CCC(C(=O)C(=O)O)(C)C Amb10569501 [0,2,0,0,0,0|0,0,1]=3 6792 B9R0.32 CCC(C)(C)C(N)C(C)=C Amb25284677 [0,2,0,0,0,0|2,0,0]=4 6793 B9R0.32 CCC(C)(C)C(N)C(N)=O Amb24565547 [0,2,0,0,0,0|1,0,0]=3 6794 B9R0.32 CCC(C)(C)C(O)C(C)=C Amb24660387 [0,2,0,0,0,0|2,0,0]=4 6795 B9R0.32 CCC(C)(C)N(C)C(C)=O Amb25229467 [0,2,0,0,0,0|2,0,0]=4 6796 B9R0.32 CCC(C)(C)N(Cl)C(N)=O Amb24648787 [0,2,0,0,0,0|2,0,0]=4 6797 B9R0.32 CCC(C)(C)[C@H](N)C(O)=O Amb24699415 [0,2,0,0,0,0|0,0,0]=2 6798 B9R0.32 CCC(C)(Cl)C(C)C(C)=O Amb25146576 [0,2,0,0,0,0|1,0,0]=3 6799 B9R0.32 CCC(C)(Cl)[C@H](N)C(O)=O Amb25701696 [0,2,0,0,0,0|0,0,0]=2 6800 B9R0.32 CCC(C)(N)C(O)C(N)=O Amb24746386 [0,2,0,0,0,0|1,0,0]=3 6801 B9R0.32 CCC(C)(O)C(=O)C(O)=O Amb22731859 [0,2,0,0,0,0|0,0,1]=3 6802 B9R0.32 CCC(C)(O)C(C)C(O)=O Amb18990593 [0,2,0,0,0,0|0,0,0]=2 6803 B9R0.32 CCC(C)(O)[C@@H](N)C(O)=O Amb25147507 [0,2,0,0,0,0|0,0,0]=2 6804 B9R0.32 CCS(=O)(=O)[C@H](C)C(O)=O Amb25279556 [0,2,0,0,0,0|2,0,0]=4 6805 B9R0.32 CC[C@@](C)(O)[C@H](O)C(O)=O Amb25825540 [0,2,0,0,0,0|0,0,0]=2 6806 B9R0.32 CC[C@@](C)(S)[C@@H](N)C(O)=O Amb24482392 [0,2,0,0,0,0|0,0,0]=2 6807 B9R0.32 CC[C@](C)(O)[C@H](C)C(O)=O Amb24480440 [0,2,0,0,0,0|0,0,0]=2 6808 B9R0.32 COC(C(C(=O)O)Br)(C)C Amb10070092 [0,2,0,0,0,0|1,0,0]=3 6809 B9R0.32 COC(C(C(=O)O)N)(C)C Amb10070091 [0,2,0,0,0,0|1,0,0]=3 6810 B9R0.32 COC(C)(C)C(Br)C(C)=O Amb24505279 [0,2,0,0,0,0|2,0,0]=4 6811 B9R0.32 COC(C)(C)C(C)C(C)=O Amb24524649 [0,2,0,0,0,0|2,0,0]=4 6812 B9R0.32 COC(C)(C)[C@H](N)C(O)=O Amb22229351 [0,2,0,0,0,0|1,0,0]=3 6813 B9R0.32 CSC(C)(C)C(Cl)C(=O)Cl Amb25289010 [0,2,0,0,0,0|2,0,0]=4 6814 B9R0.32 CSC(C)(C)[C@@H](N)C(O)=O Amb24482204 [0,2,0,0,0,0|1,0,0]=3 6815 B9R0.32 CSC(C)(C)[C@H](N)C(O)=O Amb24355892 [0,2,0,0,0,0|1,0,0]=3 6816 B9R0.32 C[C@@](O)(CF)[C@@H](N)C(O)=O Amb24627279 [0,2,0,0,0,0|1,0,0]=3 6817 B9R0.32 C[C@@](O)(CO)[C@H](N)C(O)=O Amb25251068 [0,2,0,0,0,0|1,0,0]=3 6818 B9R0.32 C[C@](O)(CN)[C@@H](O)C(O)=O Amb25727684 [0,2,0,0,0,0|1,0,0]=3 6819 B9R0.32 C[C@](O)(CN)[C@H](O)C(O)=O Amb25701236 [0,2,0,0,0,0|1,0,0]=3 6820 B9R0.32 NC(C(O)=O)C(F)(F)CS Amb25351360 [0,2,0,0,0,0|2,0,0]=4 6821 B9R0.32 OCC(C(C(=O)O)N)(C)C Amb17593671 [0,2,0,0,0,0|1,0,0]=3 6822 B9R0.41 CC(=C)C(O)C(CC)OC Amb24662183 [0,2,0,0,0,0|2,0,0]=4 6823 B9R0.41 CC(=C)[C@@H](O)[C@@H](CC)NC Amb25249091 [0,2,0,0,0,0|2,0,0]=4 6824 B9R0.41 CC(=C)[C@@H](O)[C@H](CC)NC Amb25025666 [0,2,0,0,0,0|2,0,0]=4 6825 B9R0.41 CC(=O)C(Br)C(CC)OC Amb24666723 [0,2,0,0,0,0|1,0,0]=3 6826 B9R0.41 CC(=O)C(O)C(CC)CC Amb25357541 [0,2,0,0,0,0|1,0,0]=3 6827 B9R0.41 CC(=O)C(O)C(OC)OC Amb24364071 [0,2,0,0,0,0|2,0,0]=4 6828 B9R0.41 CC(=O)[C@H](O)[C@H](CC)C=O Amb25142665 [0,2,0,0,0,0|1,0,1]=4 6829 B9R0.41 CC(C(C)=O)P(CC)CC Amb25205441 [0,2,0,0,0,0|2,0,0]=4 6830 B9R0.41 CC(C(C=C)OC)C(O)=O Amb25340446 [0,2,0,0,0,0|0,0,2]=4 6831 B9R0.41 CC(C(CC)C#N)C(C)=O Amb18643452 [0,2,0,0,0,0|1,0,1]=4 6832 B9R0.41 CC(C(CC)CC)C(C)=O Amb24732964 [0,2,0,0,0,0|1,0,0]=3 6833 B9R0.41 CC(C(CC)CC)C(N)=O Amb25318247 [0,2,0,0,0,0|1,0,0]=3 6834 B9R0.41 CC(C(CC)CC)C(O)=O Amb18831490 [0,2,0,0,0,0|0,0,0]=2 6835 B9R0.41 CC(C(CC)NC)S(C)=O Amb25123621 [0,2,0,0,0,0|2,0,0]=4 6836 B9R0.41 CC(C(CCl)CCl)C(O)=O Amb25800661 [0,2,0,0,0,0|1,0,0]=3 6837 B9R0.41 CC(C(OC)OC)C(C)=O Amb19650817 [0,2,0,0,0,0|2,0,0]=4 6838 B9R0.41 CC(C(OC)OC)C(O)=O Amb24401121 [0,2,0,0,0,0|1,0,0]=3 6839 B9R0.41 CC(C(SC)SC)C(C)=O Amb25073418 [0,2,0,0,0,0|2,0,0]=4 6840 B9R0.41 CC(O)C(O)C(CC)CC Amb24439880 [0,2,0,0,0,0|1,0,1]=4 6841 B9R0.41 CCC(=CC)C(C)C(O)=O Amb25259508 [0,2,0,0,0,0|0,0,1]=3 6842 B9R0.41 CCC(=CC)C(N)C(O)=O Amb25701826 [0,2,0,0,0,0|0,0,1]=3 6843 B9R0.41 CCC(=CC)[C@@H](N)C(O)=O Amb24616440 [0,2,0,0,0,0|0,0,1]=3 6844 B9R0.41 CCC(C#N)C(O)C(O)=O Amb24386131 [0,2,0,0,0,0|0,0,1]=3 6845 B9R0.41 CCC(CBr)N(C)C(C)=O Amb25319745 [0,2,0,0,0,0|2,0,0]=4 6846 B9R0.41 CCC(CC)C(=O)C(N)=O Amb25368392 [0,2,0,0,0,0|1,0,1]=4 6847 B9R0.41 CCC(CC)C(=O)C(O)=O Amb25085109 [0,2,0,0,0,0|0,0,1]=3 6848 B9R0.41 CCC(CC)C(Br)C(O)=O Amb24574692 [0,2,0,0,0,0|0,0,0]=2 6849 B9R0.41 CCC(CC)C(Cl)C(N)=O Amb18800737 [0,2,0,0,0,0|1,0,0]=3 6850 B9R0.41 CCC(CC)C(F)C(O)=O Amb25823402 [0,2,0,0,0,0|0,0,0]=2 6851 B9R0.41 CCC(CC)C(N)C(N)=O Amb18307119 [0,2,0,0,0,0|1,0,0]=3 6852 B9R0.41 CCC(CC)C(N)C(O)=O Amb19375421 [0,2,0,0,0,0|0,0,0]=2 6853 B9R0.41 CCC(CC)C(O)C(N)=O Amb24123036 [0,2,0,0,0,0|1,0,0]=3 6854 B9R0.41 CCC(CC)C(O)C(O)=O Amb19013419 [0,2,0,0,0,0|0,0,0]=2 6855 B9R0.41 CCC(CCl)C(N)C(O)=O Amb25104857 [0,2,0,0,0,0|0,0,0]=2 6856 B9R0.41 CCC(CN)C(O)C(O)=O Amb24700895 [0,2,0,0,0,0|0,0,0]=2 6857 B9R0.41 CCC(CN)N(C)C(C)=O Amb18908385 [0,2,0,0,0,0|2,0,0]=4 6858 B9R0.41 CCC(CN)N(C)C(N)=O Amb18251290 [0,2,0,0,0,0|2,0,0]=4 6859 B9R0.41 CCC(CO)N(C)C(N)=O Amb24632095 [0,2,0,0,0,0|2,0,0]=4 6860 B9R0.41 CCC(OC)C(=C)C(O)=O Amb25757932 [0,2,0,0,0,0|0,0,1]=3 6861 B9R0.41 CCC(OC)C(Br)C(O)=O Amb25224428 [0,2,0,0,0,0|0,0,0]=2 6862 B9R0.41 CCC(OC)C(N)C(O)=O Amb24381341 [0,2,0,0,0,0|0,0,0]=2 6863 B9R0.41 CCC(OC)C(O)C(N)=O Amb25348258 [0,2,0,0,0,0|1,0,0]=3 6864 B9R0.41 CCC(OC)C(O)C(O)=O Amb25695288 [0,2,0,0,0,0|0,0,0]=2 6865 B9R0.41 CCC([C@@H](C(=O)O)N)CC Amb17612761 [0,2,0,0,0,0|0,0,0]=2 6866 B9R0.41 CCC([C@H](C(=O)O)N)CC Amb17612760 [0,2,0,0,0,0|0,0,0]=2 6867 B9R0.41 CCN(N=O)C(C)C(O)=O Amb24445502 [0,2,0,0,0,0|2,0,0]=4 6868 B9R0.41 CC[C@@H](CO)[C@H](O)C(C)=C Amb25345066 [0,2,0,0,0,0|2,0,0]=4 6869 B9R0.41 CC[C@@H](OC)[C@H](N)C(O)=O Amb24745671 [0,2,0,0,0,0|0,0,0]=2 6870 B9R0.41 CC\C(=C/C)\C(C)C(O)=O Amb18643898 [0,2,0,0,0,0|0,0,1]=3 6871 B9R0.41 CC\C(=C\C)\[C@@H](N)C(O)=O Amb25147301 [0,2,0,0,0,0|0,0,1]=3 6872 B9R0.41 CN(C(CC)CC)C(=O)Cl Amb24466143 [0,2,0,0,0,0|2,0,0]=4 6873 B9R0.41 COC(C(C(=O)C)Cl)OC Amb17594151 [0,2,0,0,0,0|2,0,0]=4 6874 B9R0.41 COC(OC)C(Cl)C(O)=O Amb25349475 [0,2,0,0,0,0|1,0,0]=3 6875 B9R0.41 COC(OC)[C@@H](N)C(O)=O Amb24120392 [0,2,0,0,0,0|1,0,0]=3 6876 B9R0.41 COC(OC)[C@H](N)C(O)=O Amb24658204 [0,2,0,0,0,0|1,0,0]=3 6877 B9R0.41 CO[C@@H](CO)[C@@H](O)C(N)=O Amb25147298 [0,2,0,0,0,0|2,0,0]=4 6878 B9R0.41 C[C@@H](C(CC)CC)C(O)=O Amb25255941 [0,2,0,0,0,0|0,0,0]=2 6879 B9R0.41 C[C@@H](C(O)=O)N(CC)CC Amb24599977 [0,2,0,0,0,0|1,0,0]=3 6880 B9R0.41 C[C@@H](C(OC)OC)C(O)=O Amb25694344 [0,2,0,0,0,0|1,0,0]=3 6881 B9R0.41 C[C@@H]([C@@H](C=C)OC)C(O)=O Amb25840435 [0,2,0,0,0,0|0,0,2]=4 6882 B9R0.41 C[C@@H]([C@@H](CC)C#N)C(C)=O Amb25145585 [0,2,0,0,0,0|1,0,1]=4 6883 B9R0.41 C[C@@H]([C@@H](CC)C=C)C(O)=O Amb24479222 [0,2,0,0,0,0|0,0,1]=3 6884 B9R0.41 C[C@@H]([C@H](CC)C#C)C(O)=O Amb24402902 [0,2,0,0,0,0|0,0,1]=3 6885 B9R0.41 C[C@H](C(O)=O)N(CC)CC Amb24671303 [0,2,0,0,0,0|1,0,0]=3 6886 B9R0.41 C[C@H]([C@@H](CC)C#C)C(O)=O Amb24671284 [0,2,0,0,0,0|0,0,1]=3 6887 B9R0.41 C[C@H]([C@H](CC)C=C)C(O)=O Amb25703518 [0,2,0,0,0,0|0,0,1]=3 6888 B9R0.41 NC(C(CF)CF)C(O)=O Amb25088384 [0,2,0,0,0,0|1,0,0]=3 6889 B9R0.41 NC(C(CO)CO)C(O)=O Amb24436950 [0,2,0,0,0,0|1,0,0]=3 6890 B9R0.41 N[C@H](C(CO)CO)C(O)=O Amb25757902 [0,2,0,0,0,0|1,0,0]=3 6891 B9R0.79 CC(=C)C(O)C(C)C(O)=O Amb18644101 [0,2,0,0,0,0|1,0,1]=4 6892 B9R0.79 CC(=C)[C@@H](C)[C@H](C)C(O)=O Amb24480381 [0,2,0,0,0,0|0,0,1]=3 6893 B9R0.79 CC(=C)[C@@H](O)[C@H](C)C(O)=O Amb24599978 [0,2,0,0,0,0|1,0,1]=4 6894 B9R0.79 CC(=C)[C@H](C)[C@H](C)C(O)=O Amb25122106 [0,2,0,0,0,0|0,0,1]=3 6895 B9R0.79 CC(=C)[C@H](O)[C@@H](C)C(O)=O Amb25111582 [0,2,0,0,0,0|1,0,1]=4 6896 B9R0.79 CC(=O)C(C)C(C)C(O)=O Amb24401092 [0,2,0,0,0,0|0,0,1]=3 6897 B9R0.79 CC(=O)C(C)C(C)N(C)C Amb24597999 [0,2,0,0,0,0|2,0,0]=4 6898 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,2,0,0,0,0|0,0,1]=3 6899 B9R0.79 CC(=O)C(C)C(O)C(O)=O Amb25341155 [0,2,0,0,0,0|0,0,1]=3 6900 B9R0.79 CC(=O)C(O)C(C)C(O)=O Amb25255327 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.79 CC(=O)C(O)C(O)C(O)=O Amb25292189 [0,2,0,0,0,0|1,0,1]=4 6902 B9R0.79 CC(=O)N(C)C(C)C(O)=O Amb18288022 [0,2,0,0,0,0|1,0,1]=4 6903 B9R0.79 CC(=O)N(C)[C@@H](C)C(O)=O Amb25709201 [0,2,0,0,0,0|1,0,1]=4 6904 B9R0.79 CC(=O)[C@@H](C)[C@@H](C)C(C)=O Amb25146730 [0,2,0,0,0,0|1,0,1]=4 6905 B9R0.79 CC(=O)[C@@H](C)[C@H](C)C(O)=O Amb25771163 [0,2,0,0,0,0|0,0,1]=3 6906 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,2,0,0,0,0|0,0,1]=3 6907 B9R0.79 CC(=O)[C@@H](O)[C@H](C)C(O)=O Amb25077192 [0,2,0,0,0,0|1,0,1]=4 6908 B9R0.79 CC(=O)[C@H](C)[C@H](C)C(O)=O Amb25805859 [0,2,0,0,0,0|0,0,1]=3 6909 B9R0.79 CC(=O)[C@H](C)[C@H](O)C(O)=O Amb24376865 [0,2,0,0,0,0|0,0,1]=3 6910 B9R0.79 CC(C(C)C)=C(Cl)C(O)=O Amb25138708 [0,2,0,0,0,0|0,0,2]=4 6911 B9R0.79 CC(C(C)F)=C(Br)C(O)=O Amb24742917 [0,2,0,0,0,0|0,0,2]=4 6912 B9R0.79 CC(C(C)O)C(=O)C(O)=O Amb24454984 [0,2,0,0,0,0|0,0,1]=3 6913 B9R0.79 CC(C(Cl)C(C)=O)C(C)=O Amb24357432 [0,2,0,0,0,0|1,0,1]=4 6914 B9R0.79 CC(C(N)C(O)=O)C(Cl)Cl Amb24412209 [0,2,0,0,0,0|1,0,0]=3 6915 B9R0.79 CC(C(O)=O)N(C)S(C)=O Amb25177141 [0,2,0,0,0,0|2,0,0]=4 6916 B9R0.79 CC(C(O)C(O)=O)N(C)C Amb25274735 [0,2,0,0,0,0|1,0,0]=3 6917 B9R0.79 CC(C)C(=C)C(C)C(O)=O Amb24581229 [0,2,0,0,0,0|0,0,2]=4 6918 B9R0.79 CC(C)C(Br)C(=O)C(O)=O Amb18131027 [0,2,0,0,0,0|1,0,1]=4 6919 B9R0.79 CC(C)C(C)=C(C)C(O)=O Amb25111837 [0,2,0,0,0,0|0,0,2]=4 6920 B9R0.79 CC(C)C(C)C(C)C(C)=O Amb24432176 [0,2,0,0,0,0|1,0,0]=3 6921 B9R0.79 CC(C)C(C)C(C)C(N)=O Amb24650558 [0,2,0,0,0,0|1,0,0]=3 6922 B9R0.79 CC(C)C(C)C(C)C(O)=O Amb18124692 [0,2,0,0,0,0|0,0,0]=2 6923 B9R0.79 CC(C)C(C)C(Cl)C(N)=O Amb25117886 [0,2,0,0,0,0|1,0,0]=3 6924 B9R0.79 CC(C)C(C)C(F)C(O)=O Amb25853148 [0,2,0,0,0,0|0,0,0]=2 6925 B9R0.79 CC(C)C(C)C(N)C(C)=C Amb24718751 [0,2,0,0,0,0|2,0,0]=4 6926 B9R0.79 CC(C)C(C)C(O)C(C)=C Amb25260008 [0,2,0,0,0,0|2,0,0]=4 6927 B9R0.79 CC(C)C(C)C(O)C(C)O Amb24672656 [0,2,0,0,0,0|1,0,1]=4 6928 B9R0.79 CC(C)C(C)C(O)C(N)=O Amb25099713 [0,2,0,0,0,0|1,0,0]=3 6929 B9R0.79 CC(C)C(C)N(C)C(C)=O Amb25338435 [0,2,0,0,0,0|2,0,0]=4 6930 B9R0.79 CC(C)C(C)[C@H](O)[C@H](C)O Amb24475831 [0,2,0,0,0,0|1,0,1]=4 6931 B9R0.79 CC(C)C(Cl)C(=O)C(O)=O Amb18646182 [0,2,0,0,0,0|1,0,1]=4 6932 B9R0.79 CC(C)C(Cl)C(N)C(O)=O Amb25779528 [0,2,0,0,0,0|1,0,0]=3 6933 B9R0.79 CC(C)C(O)C(Br)C(O)=O Amb25313138 [0,2,0,0,0,0|1,0,0]=3 6934 B9R0.79 CC(C)C(O)C(C)C(=O)Cl Amb24555045 [0,2,0,0,0,0|2,0,0]=4 6935 B9R0.79 CC(C)C(O)C(C)C(O)=O Amb18990636 [0,2,0,0,0,0|1,0,0]=3 6936 B9R0.79 CC(C)C(O)C(Cl)C(O)=O Amb25275308 [0,2,0,0,0,0|1,0,0]=3 6937 B9R0.79 CC(C)C(O)C(N)C(O)=O Amb23399656 [0,2,0,0,0,0|1,0,0]=3 6938 B9R0.79 CC(C)C(O)C(O)C(C)=O Amb25834304 [0,2,0,0,0,0|2,0,0]=4 6939 B9R0.79 CC(C)C(O)[C@@H](N)C(O)=O Amb19130451 [0,2,0,0,0,0|1,0,0]=3 6940 B9R0.79 CC(C)C(O)[C@H](N)C(O)=O Amb24509492 [0,2,0,0,0,0|1,0,0]=3 6941 B9R0.79 CC(C)N(C)[C@H](C)C(N)=O Amb25822771 [0,2,0,0,0,0|2,0,0]=4 6942 B9R0.79 CC(C)S(=O)C(C)C(O)=O Amb18289811 [0,2,0,0,0,0|2,0,0]=4 6943 B9R0.79 CC(C)[C@@H](C)[C@@H](C)C(C)=O Amb25146697 [0,2,0,0,0,0|1,0,0]=3 6944 B9R0.79 CC(C)[C@@H](C)[C@@H](N)C(O)=O Amb24670804 [0,2,0,0,0,0|0,0,0]=2 6945 B9R0.79 CC(C)[C@@H](C)[C@H](N)C(O)=O Amb25061907 [0,2,0,0,0,0|0,0,0]=2 6946 B9R0.79 CC(C)[C@@H](C)[C@H](O)C(O)=O Amb24447350 [0,2,0,0,0,0|0,0,0]=2 6947 B9R0.79 CC(C)[C@@H](F)[C@@H](N)C(O)=O Amb22802115 [0,2,0,0,0,0|1,0,0]=3 6948 B9R0.79 CC(C)[C@@H](N)C(O)C(O)=O Amb25258947 [0,2,0,0,0,0|1,0,0]=3 6949 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(N)=O Amb25202092 [0,2,0,0,0,0|2,0,0]=4 6950 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(O)=O Amb22224932 [0,2,0,0,0,0|1,0,0]=3 6951 B9R0.79 CC(C)[C@@H](O)[C@@H](O)C(O)=O Amb25222321 [0,2,0,0,0,0|1,0,0]=3 6952 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(N)=O Amb24383930 [0,2,0,0,0,0|2,0,0]=4 6953 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(C)=O Amb24378529 [0,2,0,0,0,0|2,0,0]=4 6954 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(O)=O Amb24550312 [0,2,0,0,0,0|1,0,0]=3 6955 B9R0.79 CC(C)[C@@H](S)[C@H](N)C(O)=O Amb25302326 [0,2,0,0,0,0|1,0,0]=3 6956 B9R0.79 CC(C)[C@H](C)[C@@H](N)C(O)=O Amb25147401 [0,2,0,0,0,0|0,0,0]=2 6957 B9R0.79 CC(C)[C@H](C)[C@H](C)C(N)=O Amb24746183 [0,2,0,0,0,0|1,0,0]=3 6958 B9R0.79 CC(C)[C@H](C)[C@H](O)C(O)=O Amb24548143 [0,2,0,0,0,0|0,0,0]=2 6959 B9R0.79 CC(C)[C@H](N)C(O)C(O)=O Amb24744520 [0,2,0,0,0,0|1,0,0]=3 6960 B9R0.79 CC(C)[C@H](N)[C@@H](F)C(O)=O Amb24629885 [0,2,0,0,0,0|1,0,0]=3 6961 B9R0.79 CC(C)[C@H](N)[C@@H](O)C(O)=O Amb24428177 [0,2,0,0,0,0|1,0,0]=3 6962 B9R0.79 CC(C)[C@H](N)[C@H](O)C(O)=O Amb25147282 [0,2,0,0,0,0|1,0,0]=3 6963 B9R0.79 CC(C)[C@H](O)[C@@H](Br)C(O)=O Amb24598278 [0,2,0,0,0,0|1,0,0]=3 6964 B9R0.79 CC(Cl)C(Cl)C(C)C(C)=O Amb24649937 [0,2,0,0,0,0|2,0,0]=4 6965 B9R0.79 CC(N)C(C)C(C)C(O)=O Amb25828384 [0,2,0,0,0,0|0,0,0]=2 6966 B9R0.79 CC(O)C(C)C(C)C(C)O Amb25839405 [0,2,0,0,0,0|1,0,1]=4 6967 B9R0.79 CC(O)C(C)C(N)C(O)=O Amb21953714 [0,2,0,0,0,0|0,0,0]=2 6968 B9R0.79 CC(O)C(C)C(O)C(C)=C Amb24648192 [0,2,0,0,0,0|2,0,0]=4 6969 B9R0.79 CC(O)C(C)[C@@H](N)C(O)=O Amb22800202 [0,2,0,0,0,0|0,0,0]=2 6970 B9R0.79 CC(O)C(O)C(O)C(C)=O Amb25145498 [0,2,0,0,0,0|2,0,0]=4 6971 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(O)=O Amb24052812 [0,2,0,0,0,0|0,0,0]=2 6972 B9R0.79 CC([C@@H](N)C(O)=O)C(O)=O Amb22745450 [0,2,0,0,0,0|1,0,1]=4 6973 B9R0.79 CC([C@@H]([C@@H](C(=O)O)N)C)O Amb10603785 [0,2,0,0,0,0|0,0,0]=2 6974 B9R0.79 CC([C@@H]([C@H](C(=O)O)C)O)C Amb10844253 [0,2,0,0,0,0|1,0,0]=3 6975 B9R0.79 CC([C@@H]([C@H](C(=O)O)N)O)C Amb10807407 [0,2,0,0,0,0|1,0,0]=3 6976 B9R0.79 CN(O)C(C)C(C)C(O)=O Amb24540667 [0,2,0,0,0,0|1,0,0]=3 6977 B9R0.79 C[C@@H](O)C(O)[C@H](N)C(O)=O Amb24435507 [0,2,0,0,0,0|1,0,0]=3 6978 B9R0.79 C[C@@H](O)[C@@H](C)[C@@H](N)C(O)=O Amb25693814 [0,2,0,0,0,0|0,0,0]=2 6979 B9R0.79 C[C@@H](O)[C@@H](C)[C@H](N)C(O)=O Amb24340188 [0,2,0,0,0,0|0,0,0]=2 6980 B9R0.79 C[C@@H](O)[C@@H](O)[C@@H](O)C(C)=O Amb24661092 [0,2,0,0,0,0|2,0,0]=4 6981 B9R0.79 C[C@@H](O)[C@H](O)[C@@H](O)C(O)=O Amb24482345 [0,2,0,0,0,0|1,0,0]=3 6982 B9R0.79 C[C@@H](O)[C@H](O)[C@H](O)C(O)=O Amb24711187 [0,2,0,0,0,0|1,0,0]=3 6983 B9R0.79 C[C@@H]([C@@H](C)C(O)=O)C(O)=O Amb22801175 [0,2,0,0,0,0|1,0,1]=4 6984 B9R0.79 C[C@@H]([C@H](N)C(O)=O)C(O)=O Amb22756698 [0,2,0,0,0,0|1,0,1]=4 6985 B9R0.79 C[C@@H]([C@H](O)C(O)=O)N(C)C Amb24480709 [0,2,0,0,0,0|1,0,0]=3 6986 B9R0.79 C[C@@H]([C@H](O)[C@H](C)N)C(O)=O Amb24563136 [0,2,0,0,0,0|1,0,0]=3 6987 B9R0.79 C[C@H](O)C(C)[C@H](N)C(O)=O Amb22735316 [0,2,0,0,0,0|0,0,0]=2 6988 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(N)=O Amb24712923 [0,2,0,0,0,0|2,0,0]=4 6989 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(O)=O Amb25374422 [0,2,0,0,0,0|1,0,0]=3 6990 B9R0.79 C[C@H]([C@@H](C)C(O)=O)C(N)=O Amb25113911 [0,2,0,0,0,0|1,0,1]=4 6991 B9R0.79 C[C@H]([C@@H]([C@@H](C(=O)O)N)C)O Amb17615448 [0,2,0,0,0,0|0,0,0]=2 6992 B9R0.79 C[C@H]([C@H](Cl)C(O)=O)C(O)=O Amb25684803 [0,2,0,0,0,0|1,0,1]=4 6993 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(C)Cl Amb25363328 [0,2,0,0,0,0|0,0,0]=2 6994 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(O)=O Amb25324829 [0,2,0,0,0,0|1,0,1]=4 6995 B9R0.79 NC(C(Cl)C(Cl)Cl)C(O)=O Amb24375729 [0,2,0,0,0,0|2,0,0]=4 6996 B9R0.79 NC(C(F)C(O)=O)C(F)F Amb24482391 [0,2,0,0,0,0|2,0,0]=4 6997 B9R0.79 NC(C(O)C(F)F)C(O)=O Amb19148422 [0,2,0,0,0,0|2,0,0]=4 6998 B9R0.79 OC(=O)C(C(C(=O)O)C)Cl Amb17594150 [0,2,0,0,0,0|1,0,1]=4 6999 B9R0.79 OC(=O)C(C(C(=O)O)C)N Amb2099482 [0,2,0,0,0,0|1,0,1]=4 7000 B9R0.79 OC(=O)C(C(C(=O)O)C)O Amb17593680 [0,2,0,0,0,0|1,0,1]=4 7001 B9R0.79 OC(=O)[C@H](C(C(=O)O)C)N Amb16232531 [0,2,0,0,0,0|1,0,1]=4 7002 B9R0.79 OC(C(O)C(F)F)C(O)=O Amb24639614 [0,2,0,0,0,0|2,0,0]=4 7003 B9R0.4 C=CCCC(N)CC(N)=O Amb25367476 [0,2,0,0,0,0|2,0,0]=4 7004 B9R0.4 C=CCCC(N)CC(O)=O Amb22641959 [0,2,0,0,0,0|1,0,0]=3 7005 B9R0.4 C=CCCC(O)CC(O)=O Amb24763775 [0,2,0,0,0,0|1,0,0]=3 7006 B9R0.4 C=CCC[C@@H](CC(=O)O)N Amb10066917 [0,2,0,0,0,0|1,0,0]=3 7007 B9R0.4 C=CCC[C@H](CC(=O)O)N Amb10066925 [0,2,0,0,0,0|1,0,0]=3 7008 B9R0.4 C=CCNC(CC(=O)N)C Amb17231945 [0,2,0,0,0,0|1,0,1]=4 7009 B9R0.4 CC#CCC(C)CC(O)=O Amb24350965 [0,2,0,0,0,0|0,0,0]=2 7010 B9R0.4 CC#CCN(C)CC(O)=O Amb19026772 [0,2,0,0,0,0|1,0,0]=3 7011 B9R0.4 CC#CC[C@@H](C)CC(O)=O Amb24616270 [0,2,0,0,0,0|0,0,0]=2 7012 B9R0.4 CC(=CC(O)=O)OCCC Amb24629232 [0,2,0,0,0,0|0,0,2]=4 7013 B9R0.4 CC(=CC(O)=O)SCCC Amb25362094 [0,2,0,0,0,0|0,0,2]=4 7014 B9R0.4 CC(=O)CC(O)CCC#N Amb18643718 [0,2,0,0,0,0|2,0,0]=4 7015 B9R0.4 CC(=O)CC(O)CCC=C Amb25735760 [0,2,0,0,0,0|2,0,0]=4 7016 B9R0.4 CC(=O)CC(O)CCCCl Amb24502163 [0,2,0,0,0,0|2,0,0]=4 7017 B9R0.4 CC(=O)CN(C)CCCO Amb25281520 [0,2,0,0,0,0|2,0,0]=4 7018 B9R0.4 CC(=O)C[C@@H](O)CCC=C Amb25723265 [0,2,0,0,0,0|2,0,0]=4 7019 B9R0.4 CC(CC(C)=O)=NCCO Amb24662323 [0,2,0,0,0,0|1,0,1]=4 7020 B9R0.4 CC(CC(C)=O)CCC#C Amb24685891 [0,2,0,0,0,0|1,0,0]=3 7021 B9R0.4 CC(CC(C)=O)CCC=C Amb24738371 [0,2,0,0,0,0|1,0,0]=3 7022 B9R0.4 CC(CC(C)=O)SCCO Amb25777590 [0,2,0,0,0,0|1,0,0]=3 7023 B9R0.4 CC(CC(C)O)NCCN Amb25361586 [0,2,0,0,0,0|1,0,1]=4 7024 B9R0.4 CC(CC(N)=N)SCCO Amb18792443 [0,2,0,0,0,0|2,0,0]=4 7025 B9R0.4 CC(CC(N)=O)NCCBr Amb24482960 [0,2,0,0,0,0|1,0,0]=3 7026 B9R0.4 CC(CC(N)=O)NCCF Amb25225173 [0,2,0,0,0,0|1,0,0]=3 7027 B9R0.4 CC(CC(N)=O)NCCO Amb19981205 [0,2,0,0,0,0|1,0,0]=3 7028 B9R0.4 CC(CC(O)=O)=NCC#N Amb25844075 [0,2,0,0,0,0|0,0,2]=4 7029 B9R0.4 CC(CC(O)=O)CCC#N Amb25789692 [0,2,0,0,0,0|0,0,0]=2 7030 B9R0.4 CC(CC(O)=O)CCC=C Amb18643923 [0,2,0,0,0,0|0,0,0]=2 7031 B9R0.4 CC(CC(O)=O)NCC#N Amb24376473 [0,2,0,0,0,0|0,0,1]=3 7032 B9R0.4 CC(CC(O)=O)NCCCl Amb25806095 [0,2,0,0,0,0|0,0,0]=2 7033 B9R0.4 CC(CC(O)=O)SCCF Amb24399399 [0,2,0,0,0,0|0,0,0]=2 7034 B9R0.4 CC(CC(O)=O)SCCN Amb18788220 [0,2,0,0,0,0|0,0,0]=2 7035 B9R0.4 CC(CCC=C)C[C@H](C)O Amb25853908 [0,2,0,0,0,0|1,0,1]=4 7036 B9R0.4 CC(CCC=C)NC(C)=O Amb24478962 [0,2,0,0,0,0|2,0,0]=4 7037 B9R0.4 CC(CCC=C)OC(C)=O Amb24412700 [0,2,0,0,0,0|2,0,0]=4 7038 B9R0.4 CC(CCCBr)=CC(O)=O Amb24654967 [0,2,0,0,0,0|0,0,2]=4 7039 B9R0.4 CC(CCCBr)OC(C)=O Amb24415699 [0,2,0,0,0,0|2,0,0]=4 7040 B9R0.4 CC(CCCCl)CC(O)=O Amb18646190 [0,2,0,0,0,0|0,0,0]=2 7041 B9R0.4 CC(CCCCl)OC(=O)Cl Amb24563810 [0,2,0,0,0,0|2,0,0]=4 7042 B9R0.4 CC(CCCCl)OC(C)=O Amb24470649 [0,2,0,0,0,0|2,0,0]=4 7043 B9R0.4 CC(CCCN)CC(O)=O Amb24761313 [0,2,0,0,0,0|0,0,0]=2 7044 B9R0.4 CC(CCCN)NC(C)=O Amb25765187 [0,2,0,0,0,0|2,0,0]=4 7045 B9R0.4 CC(CCCN)NC(N)=O Amb25084805 [0,2,0,0,0,0|2,0,0]=4 7046 B9R0.4 CC(CCCO)NC(N)=O Amb25197805 [0,2,0,0,0,0|2,0,0]=4 7047 B9R0.4 CC(CCCO)OC(C)=O Amb24387041 [0,2,0,0,0,0|2,0,0]=4 7048 B9R0.4 CC(CCOC)=CC(O)=O Amb25309097 [0,2,0,0,0,0|0,0,2]=4 7049 B9R0.4 CC(CCSC)CC(C)O Amb25662534 [0,2,0,0,0,0|1,0,1]=4 7050 B9R0.4 CC(CNCC)=CC(O)=O Amb24643336 [0,2,0,0,0,0|0,0,2]=4 7051 B9R0.4 CC(COCC)=CC(O)=O Amb25348858 [0,2,0,0,0,0|0,0,2]=4 7052 B9R0.4 CC(CS(C)=O)NCCF Amb24725028 [0,2,0,0,0,0|2,0,0]=4 7053 B9R0.4 CC(CS(C)=O)NCCO Amb24524661 [0,2,0,0,0,0|2,0,0]=4 7054 B9R0.4 CC(OCCCl)OC(C)=O Amb24480651 [0,2,0,0,0,0|2,0,0]=4 7055 B9R0.4 CC=C=CC(C)CC(O)=O Amb24480691 [0,2,0,0,0,0|0,0,1]=3 7056 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [0,2,0,0,0,0|0,0,2]=4 7057 B9R0.4 CCCCC(C)CC(C)=O Amb25051695 [0,2,0,0,0,0|1,0,0]=3 7058 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [0,2,0,0,0,0|1,0,0]=3 7059 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [0,2,0,0,0,0|1,0,0]=3 7060 B9R0.4 CCCCC(Cl)CC(=O)Cl Amb24563246 [0,2,0,0,0,0|2,0,0]=4 7061 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [0,2,0,0,0,0|2,0,0]=4 7062 B9R0.4 CCCCC(O)CC(N)=O Amb24563459 [0,2,0,0,0,0|2,0,0]=4 7063 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [0,2,0,0,0,0|1,0,0]=3 7064 B9R0.4 CCCCN(CC(=O)Cl)C Amb17142904 [0,2,0,0,0,0|2,0,0]=4 7065 B9R0.4 CCCCN(CC(=O)N)C Amb17142865 [0,2,0,0,0,0|2,0,0]=4 7066 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [0,2,0,0,0,0|2,0,0]=4 7067 B9R0.4 CCCC[C@@H](C)NC(C)=O Amb24681561 [0,2,0,0,0,0|2,0,0]=4 7068 B9R0.4 CCCC[C@@H](O)CC(N)=O Amb24549040 [0,2,0,0,0,0|2,0,0]=4 7069 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [0,2,0,0,0,0|1,0,0]=3 7070 B9R0.4 CCCC[C@H](N)CC(N)=O Amb25147366 [0,2,0,0,0,0|2,0,0]=4 7071 B9R0.4 CCCC[C@H](O)CC(C)=O Amb25245692 [0,2,0,0,0,0|2,0,0]=4 7072 B9R0.4 CCCN=C(C)CC(C)=O Amb24707162 [0,2,0,0,0,0|1,0,1]=4 7073 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [0,2,0,0,0,0|1,0,1]=4 7074 B9R0.4 CCCNC(C)CC(C)=C Amb24442467 [0,2,0,0,0,0|2,0,0]=4 7075 B9R0.4 CCCNC(C)CC(C)O Amb24365066 [0,2,0,0,0,0|1,0,1]=4 7076 B9R0.4 CCCNC(C)CS(C)=O Amb25205194 [0,2,0,0,0,0|2,0,0]=4 7077 B9R0.4 CCCNC(CC(=O)N)C Amb17231986 [0,2,0,0,0,0|1,0,0]=3 7078 B9R0.4 CCCOC(C)CC(C)O Amb24423186 [0,2,0,0,0,0|1,0,1]=4 7079 B9R0.4 CCCOC(C)NC(N)=O Amb25060078 [0,2,0,0,0,0|2,0,0]=4 7080 B9R0.4 CCCO[C@H](C)CC(O)=O Amb24450437 [0,2,0,0,0,0|0,0,0]=2 7081 B9R0.4 CCCSC(C)CC(C)=O Amb24456282 [0,2,0,0,0,0|1,0,0]=3 7082 B9R0.4 CCCSC(C)CC(N)=N Amb18792300 [0,2,0,0,0,0|2,0,0]=4 7083 B9R0.4 CCC\C=C(/C)\CC(C)=O Amb25146596 [0,2,0,0,0,0|1,0,1]=4 7084 B9R0.4 CCOCC(C)CC(C)=O Amb25144963 [0,2,0,0,0,0|1,0,0]=3 7085 B9R0.4 CCOCC(C)CC(O)=O Amb18202330 [0,2,0,0,0,0|0,0,0]=2 7086 B9R0.4 CCOCC(C)NC(N)=O Amb25253424 [0,2,0,0,0,0|2,0,0]=4 7087 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,2,0,0,0,0|2,0,0]=4 7088 B9R0.4 CCOCC(Cl)CC(O)=O Amb24426131 [0,2,0,0,0,0|1,0,0]=3 7089 B9R0.4 CCOC[C@@H](C)OC(C)=O Amb24369884 [0,2,0,0,0,0|2,0,0]=4 7090 B9R0.4 CCOC[C@H](C)NC(C)=O Amb25086188 [0,2,0,0,0,0|2,0,0]=4 7091 B9R0.4 CCON=C(C)CC(C)=O Amb25371763 [0,2,0,0,0,0|1,0,1]=4 7092 B9R0.4 CCSCC(C)NC(C)=O Amb24697310 [0,2,0,0,0,0|2,0,0]=4 7093 B9R0.4 CC\C=C\C(C)CC(O)=O Amb18643922 [0,2,0,0,0,0|0,0,0]=2 7094 B9R0.4 CC\C=C\C(N)CC(N)=O Amb25241346 [0,2,0,0,0,0|2,0,0]=4 7095 B9R0.4 CC\C=C\C(N)CC(O)=O Amb25843767 [0,2,0,0,0,0|1,0,0]=3 7096 B9R0.4 CC\C=C\C(O)CC(O)=O Amb22831930 [0,2,0,0,0,0|1,0,0]=3 7097 B9R0.4 CN(CC(N)=O)CCC=O Amb24476851 [0,2,0,0,0,0|2,0,0]=4 7098 B9R0.4 CN(CC(O)=O)CCC#C Amb19373375 [0,2,0,0,0,0|1,0,0]=3 7099 B9R0.4 CN(CC(O)=O)CCC=C Amb25683888 [0,2,0,0,0,0|1,0,0]=3 7100 B9R0.4 CN(CCCF)CC(O)=O Amb24340278 [0,2,0,0,0,0|1,0,0]=3 7101 B9R0.4 CN(CCCI)CC(N)=O Amb25305970 [0,2,0,0,0,0|2,0,0]=4 7102 B9R0.4 CN(CCCN)CC(O)=O Amb25794990 [0,2,0,0,0,0|1,0,0]=3 7103 B9R0.4 CN(CCCO)CC(N)=O Amb25853093 [0,2,0,0,0,0|2,0,0]=4 7104 B9R0.4 CNCCC(C)CC(C)=C Amb25332578 [0,2,0,0,0,0|2,0,0]=4 7105 B9R0.4 CNCCC(C)CC(O)=O Amb24694269 [0,2,0,0,0,0|0,0,0]=2 7106 B9R0.4 CNCCN(C)CC(C)=O Amb25853560 [0,2,0,0,0,0|2,0,0]=4 7107 B9R0.4 CNCC[C@@H](N)CC(O)=O Amb24117036 [0,2,0,0,0,0|1,0,0]=3 7108 B9R0.4 CNCC[C@H](N)CC(O)=O Amb25789535 [0,2,0,0,0,0|1,0,0]=3 7109 B9R0.4 COCCC(C)CC(N)=O Amb25842751 [0,2,0,0,0,0|1,0,0]=3 7110 B9R0.4 COCCC(C)OC(C)=O Amb24482618 [0,2,0,0,0,0|2,0,0]=4 7111 B9R0.4 COCCC(N)CC(C)=O Amb25147726 [0,2,0,0,0,0|2,0,0]=4 7112 B9R0.4 COCCN(C)CC(C)=O Amb24642711 [0,2,0,0,0,0|2,0,0]=4 7113 B9R0.4 COCCN(C)CC(O)=O Amb22587006 [0,2,0,0,0,0|1,0,0]=3 7114 B9R0.4 COCCN(C)CC(O)=O Amb22587626 [0,2,0,0,0,0|1,0,0]=3 7115 B9R0.4 COCCS(=O)CC(O)=O Amb18792760 [0,2,0,0,0,0|2,0,0]=4 7116 B9R0.4 COCOC(C)CC(C)=O Amb25146513 [0,2,0,0,0,0|1,0,0]=3 7117 B9R0.4 COCOC(C)CC(C)O Amb25721585 [0,2,0,0,0,0|1,0,1]=4 7118 B9R0.4 COCO[C@H](C)CC(C)=O Amb25320140 [0,2,0,0,0,0|1,0,0]=3 7119 B9R0.4 COCO[C@H](C)CC(O)=O Amb24715879 [0,2,0,0,0,0|0,0,0]=2 7120 B9R0.4 CSCCC(N)CC(O)=O Amb22353181 [0,2,0,0,0,0|1,0,0]=3 7121 B9R0.4 CSCCC(O)CC(O)=O Amb18798349 [0,2,0,0,0,0|1,0,0]=3 7122 B9R0.4 CSCC[C@@H](CC(=O)O)N Amb16184019 [0,2,0,0,0,0|1,0,0]=3 7123 B9R0.4 CSCC[C@H](N)CC(O)=O Amb22352993 [0,2,0,0,0,0|1,0,0]=3 7124 B9R0.4 C[C@@H](CCCN)CC(O)=O Amb24744945 [0,2,0,0,0,0|0,0,0]=2 7125 B9R0.4 C[C@H](CC(C)=O)CCC=O Amb25131149 [0,2,0,0,0,0|1,0,0]=3 7126 B9R0.4 C[C@H](CC(O)=O)CCC#C Amb25064050 [0,2,0,0,0,0|0,0,0]=2 7127 B9R0.4 C[C@H](CC(O)=O)CCC=C Amb24674116 [0,2,0,0,0,0|0,0,0]=2 7128 B9R0.4 C[C@H](CC(O)=O)OCC=C Amb25697767 [0,2,0,0,0,0|0,0,1]=3 7129 B9R0.4 C[C@H](CC(O)=O)OCCO Amb24713383 [0,2,0,0,0,0|0,0,0]=2 7130 B9R0.4 C[C@H](CCCN)CC(O)=O Amb24715301 [0,2,0,0,0,0|0,0,0]=2 7131 B9R0.4 C[C@H](CCCS)CC(O)=O Amb24358051 [0,2,0,0,0,0|0,0,0]=2 7132 B9R0.4 C\C(=C/C(O)=O)\OCOC Amb24505156 [0,2,0,0,0,0|0,0,2]=4 7133 B9R0.4 C\C(=C/C(O)=O)\SCCC Amb25032478 [0,2,0,0,0,0|0,0,2]=4 7134 B9R0.4 C\C(\CC(C)=O)=N\CCS Amb25073348 [0,2,0,0,0,0|1,0,1]=4 7135 B9R0.4 C\C(\CC(O)=O)=C\CSC Amb24726319 [0,2,0,0,0,0|0,0,1]=3 7136 B9R0.4 C\C(\CCC=C)=C/C(O)=O Amb18643565 [0,2,0,0,0,0|0,0,2]=4 7137 B9R0.4 C\C(\CCC=C)=C\C(O)=O Amb25242614 [0,2,0,0,0,0|0,0,2]=4 7138 B9R0.4 C\C(\CCCCl)=C\C(O)=O Amb18126354 [0,2,0,0,0,0|0,0,2]=4 7139 B9R0.4 C\C=C/CC(C)CC(C)=O Amb25146817 [0,2,0,0,0,0|1,0,0]=3 7140 B9R0.4 C\C=C/OC(C)CC(C)=O Amb24415259 [0,2,0,0,0,0|1,0,1]=4 7141 B9R0.4 C\C=C\CN(C)CC(N)=O Amb24464864 [0,2,0,0,0,0|2,0,0]=4 7142 B9R0.4 C\C=C\OC(C)CC(C)=O Amb24518461 [0,2,0,0,0,0|1,0,1]=4 7143 B9R0.4 NC(CCCS)CC(O)=O Amb24524306 [0,2,0,0,0,0|1,0,0]=3 7144 B9R0.4 NCCCC(N)CC(O)=O Amb18644278 [0,2,0,0,0,0|1,0,0]=3 7145 B9R0.4 NCCC[C@@H](N)CC(N)=O Amb25794069 [0,2,0,0,0,0|2,0,0]=4 7146 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117039 [0,2,0,0,0,0|1,0,0]=3 7147 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117927 [0,2,0,0,0,0|1,0,0]=3 7148 B9R0.4 NCCC[C@H](N)CC(O)=O Amb25757485 [0,2,0,0,0,0|1,0,0]=3 7149 B9R0.4 OC(=O)CC(=O)NCCO Amb25683950 [0,2,0,0,0,0|1,0,1]=4 7150 B9R0.4 OC(=O)CC(=O)OCCBr Amb24477342 [0,2,0,0,0,0|1,0,1]=4 7151 B9R0.4 OC(=O)CS(=O)CCCF Amb25117795 [0,2,0,0,0,0|2,0,0]=4 7152 B9R0.4 O[C@@H](CCCBr)CC(O)=O Amb24605609 [0,2,0,0,0,0|1,0,0]=3 7153 B9R0.4 [N-]=[N+]=NCC(O)CC(O)=O Amb25222983 [0,2,0,0,0,0|2,0,0]=4 7154 B9R0.4 [N-]=[N+]=NC[C@H](O)CC(O)=O Amb24356370 [0,2,0,0,0,0|2,0,0]=4 7155 B9R0.14 C=CC(CC=O)CC(O)=O Amb18643819 [0,2,0,0,0,0|0,0,2]=4 7156 B9R0.14 C=CC(CCO)CC(O)=O Amb24595877 [0,2,0,0,0,0|0,0,1]=3 7157 B9R0.14 C=CCC(CC(O)=O)C=C Amb18643594 [0,2,0,0,0,0|0,0,2]=4 7158 B9R0.14 C=C[C@H](CCO)CC(O)=O Amb24674139 [0,2,0,0,0,0|0,0,1]=3 7159 B9R0.14 CC(=O)CC(CCO)CO Amb24586786 [0,2,0,0,0,0|1,0,0]=3 7160 B9R0.14 CC(=O)CC(CO)CC=C Amb25142660 [0,2,0,0,0,0|1,0,1]=4 7161 B9R0.14 CC(=O)OC(CBr)CCO Amb24616879 [0,2,0,0,0,0|2,0,0]=4 7162 B9R0.14 CC(=O)OC(CCBr)CBr Amb24561129 [0,2,0,0,0,0|2,0,0]=4 7163 B9R0.14 CC(=O)OC(CCCl)CCl Amb22359668 [0,2,0,0,0,0|2,0,0]=4 7164 B9R0.14 CC(O)CC(CCC)SC Amb25723606 [0,2,0,0,0,0|1,0,1]=4 7165 B9R0.14 CC(O)CC(CO)CCC Amb25847449 [0,2,0,0,0,0|1,0,1]=4 7166 B9R0.14 CCC(CC#C)NC(C)=O Amb25727977 [0,2,0,0,0,0|2,0,0]=4 7167 B9R0.14 CCC(CC#C)NC(N)=O Amb25698437 [0,2,0,0,0,0|2,0,0]=4 7168 B9R0.14 CCC(CC#C)OC(N)=O Amb24670993 [0,2,0,0,0,0|2,0,0]=4 7169 B9R0.14 CCC(CC#N)CC(C)=O Amb24698909 [0,2,0,0,0,0|1,0,0]=3 7170 B9R0.14 CCC(CC#N)CC(O)=O Amb24746759 [0,2,0,0,0,0|0,0,0]=2 7171 B9R0.14 CCC(CC#N)NC(C)=O Amb24476940 [0,2,0,0,0,0|2,0,0]=4 7172 B9R0.14 CCC(CC(N)=O)NCC Amb24682966 [0,2,0,0,0,0|1,0,0]=3 7173 B9R0.14 CCC(CC(N)=O)OCC Amb24502290 [0,2,0,0,0,0|1,0,0]=3 7174 B9R0.14 CCC(CC(O)=O)N=[N+]=[N-] Amb24419941 [0,2,0,0,0,0|1,0,0]=3 7175 B9R0.14 CCC(CC(O)=O)SCC Amb18788141 [0,2,0,0,0,0|0,0,0]=2 7176 B9R0.14 CCC(CC=C)CC(C)=O Amb24478304 [0,2,0,0,0,0|1,0,0]=3 7177 B9R0.14 CCC(CC=C)NC(N)=O Amb25227860 [0,2,0,0,0,0|2,0,0]=4 7178 B9R0.14 CCC(CC=O)SC(C)=O Amb25707475 [0,2,0,0,0,0|2,0,0]=4 7179 B9R0.14 CCC(CCBr)NC(C)=O Amb24375542 [0,2,0,0,0,0|2,0,0]=4 7180 B9R0.14 CCC(CCC)NC(C)=O Amb25327258 [0,2,0,0,0,0|2,0,0]=4 7181 B9R0.14 CCC(CCC)OC(N)=O Amb25848639 [0,2,0,0,0,0|2,0,0]=4 7182 B9R0.14 CCC(CCCl)NC(C)=O Amb25248606 [0,2,0,0,0,0|2,0,0]=4 7183 B9R0.14 CCC(CCCl)OC(=O)Cl Amb24650425 [0,2,0,0,0,0|2,0,0]=4 7184 B9R0.14 CCC(CCCl)OC(C)=O Amb25744059 [0,2,0,0,0,0|2,0,0]=4 7185 B9R0.14 CCC(CCCl)OC(N)=O Amb24568892 [0,2,0,0,0,0|2,0,0]=4 7186 B9R0.14 CCC(CCN)NC(C)=O Amb19028043 [0,2,0,0,0,0|2,0,0]=4 7187 B9R0.14 CCC(CCN)NC(N)=O Amb18313188 [0,2,0,0,0,0|2,0,0]=4 7188 B9R0.14 CCC(CCO)NC(C)=O Amb25265131 [0,2,0,0,0,0|2,0,0]=4 7189 B9R0.14 CCC(COC)=CC(O)=O Amb24640892 [0,2,0,0,0,0|0,0,2]=4 7190 B9R0.14 CCC(COC)CC(O)=O Amb18202336 [0,2,0,0,0,0|0,0,0]=2 7191 B9R0.14 CCC(COC)NC(C)=O Amb25799274 [0,2,0,0,0,0|2,0,0]=4 7192 B9R0.14 CCCC(CB(O)O)CC Amb24504826 [0,2,0,0,0,0|1,0,1]=4 7193 B9R0.14 CCCC(CBr)OC(C)=O Amb24399943 [0,2,0,0,0,0|2,0,0]=4 7194 B9R0.14 CCCC(CC(=O)Cl)CC Amb25090544 [0,2,0,0,0,0|1,0,0]=3 7195 B9R0.14 CCCC(CC(C)=O)C#N Amb25714287 [0,2,0,0,0,0|1,0,1]=4 7196 B9R0.14 CCCC(CC(C)=O)C=C Amb24478388 [0,2,0,0,0,0|1,0,1]=4 7197 B9R0.14 CCCC(CC(C)=O)OC Amb25076204 [0,2,0,0,0,0|1,0,0]=3 7198 B9R0.14 CCCC(CC(N)=O)C=C Amb24712938 [0,2,0,0,0,0|1,0,1]=4 7199 B9R0.14 CCCC(CC(N)=O)NC Amb25069096 [0,2,0,0,0,0|1,0,0]=3 7200 B9R0.14 CCCC(CC(O)=O)C#C Amb25330154 [0,2,0,0,0,0|0,0,1]=3 7201 B9R0.14 CCCC(CC(O)=O)CC Amb18124694 [0,2,0,0,0,0|0,0,0]=2 7202 B9R0.14 CCCC(CC(O)=O)CO Amb24509175 [0,2,0,0,0,0|0,0,0]=2 7203 B9R0.14 CCCC(CC(O)=O)OC Amb25844554 [0,2,0,0,0,0|0,0,0]=2 7204 B9R0.14 CCCC(CCl)CC(C)=C Amb25132141 [0,2,0,0,0,0|2,0,0]=4 7205 B9R0.14 CCCC(CCl)OC(C)=O Amb24480605 [0,2,0,0,0,0|2,0,0]=4 7206 B9R0.14 CCCC(CN)CC(O)=O Amb24587738 [0,2,0,0,0,0|0,0,0]=2 7207 B9R0.14 CCCC(CN)NC(N)=O Amb24357472 [0,2,0,0,0,0|2,0,0]=4 7208 B9R0.14 CCCC(CO)CC(C)=O Amb24708488 [0,2,0,0,0,0|1,0,0]=3 7209 B9R0.14 CCCC(CS(C)=O)NC Amb25806877 [0,2,0,0,0,0|2,0,0]=4 7210 B9R0.14 CCCN(CC(N)=O)CC Amb25849535 [0,2,0,0,0,0|2,0,0]=4 7211 B9R0.14 CCCN(CC(O)=O)C=O Amb18307978 [0,2,0,0,0,0|1,0,1]=4 7212 B9R0.14 CCC[C@@H](CC(C)=O)C#N Amb25358879 [0,2,0,0,0,0|1,0,1]=4 7213 B9R0.14 CCC[C@@H](CN)CC(O)=O Amb25835673 [0,2,0,0,0,0|0,0,0]=2 7214 B9R0.14 CCC[C@@H](CO)OC(C)=O Amb25307611 [0,2,0,0,0,0|2,0,0]=4 7215 B9R0.14 CCC[C@H](CC(C)=O)CC Amb24646153 [0,2,0,0,0,0|1,0,0]=3 7216 B9R0.14 CCC[C@H](CC(O)=O)CC Amb24480703 [0,2,0,0,0,0|0,0,0]=2 7217 B9R0.14 CCN(CC#C)CC(N)=O Amb24407693 [0,2,0,0,0,0|2,0,0]=4 7218 B9R0.14 CCN(CC#C)CC(O)=O Amb19008131 [0,2,0,0,0,0|1,0,0]=3 7219 B9R0.14 CCN(CC#N)CC(O)=O Amb19008132 [0,2,0,0,0,0|1,0,0]=3 7220 B9R0.14 CCN(CC=C)CC(N)=O Amb25027847 [0,2,0,0,0,0|2,0,0]=4 7221 B9R0.14 CCN(CC=O)CC(N)=O Amb24479631 [0,2,0,0,0,0|2,0,0]=4 7222 B9R0.14 CCN(CCF)CC(N)=O Amb24520941 [0,2,0,0,0,0|2,0,0]=4 7223 B9R0.14 CCN(CCI)CC(N)=O Amb24482973 [0,2,0,0,0,0|2,0,0]=4 7224 B9R0.14 CCN(CCN)CC(O)=O Amb25280640 [0,2,0,0,0,0|1,0,0]=3 7225 B9R0.14 CCNC(CC(N)=O)C#N Amb25306677 [0,2,0,0,0,0|1,0,1]=4 7226 B9R0.14 CCOC(CBr)OC(C)=O Amb25141497 [0,2,0,0,0,0|2,0,0]=4 7227 B9R0.14 CCOC(CC(N)=O)CN Amb24505233 [0,2,0,0,0,0|1,0,0]=3 7228 B9R0.14 CCOC(CC(O)=O)C#N Amb24480747 [0,2,0,0,0,0|0,0,1]=3 7229 B9R0.14 CCOC(CCl)OC(C)=O Amb25129465 [0,2,0,0,0,0|2,0,0]=4 7230 B9R0.14 CCOC(CN)CC(O)=O Amb24672836 [0,2,0,0,0,0|0,0,0]=2 7231 B9R0.14 CCOC(CN)CS(C)=O Amb24669032 [0,2,0,0,0,0|2,0,0]=4 7232 B9R0.14 CCOC(CO)=CC(O)=O Amb25175015 [0,2,0,0,0,0|0,0,2]=4 7233 B9R0.14 CCO[C@@H](CC(O)=O)C#N Amb24383647 [0,2,0,0,0,0|0,0,1]=3 7234 B9R0.14 CCO\C(=C\C(=O)O)\CO Amb17593652 [0,2,0,0,0,0|0,0,2]=4 7235 B9R0.14 CCO\C(\CC)=C\C(O)=O Amb18644142 [0,2,0,0,0,0|0,0,2]=4 7236 B9R0.14 CCS(CC(O)=O)OCC Amb24449991 [0,2,0,0,0,0|1,0,0]=3 7237 B9R0.14 CC[C@@H](CC#N)CC(O)=O Amb25213966 [0,2,0,0,0,0|0,0,0]=2 7238 B9R0.14 CC[C@@H](CC=O)CC(C)=O Amb25768389 [0,2,0,0,0,0|1,0,0]=3 7239 B9R0.14 CC[C@@H](CC=O)NC(C)=O Amb25279311 [0,2,0,0,0,0|2,0,0]=4 7240 B9R0.14 CC[C@H](CC=O)CC(C)=O Amb25299211 [0,2,0,0,0,0|1,0,0]=3 7241 B9R0.14 COC(CC#N)CC(O)=O Amb24669607 [0,2,0,0,0,0|0,0,1]=3 7242 B9R0.14 COC(CC(O)=O)OCC Amb24682697 [0,2,0,0,0,0|0,0,0]=2 7243 B9R0.14 COC(CCO)=CC(O)=O Amb24759166 [0,2,0,0,0,0|0,0,2]=4 7244 B9R0.14 COCC(CBr)NC(C)=O Amb25725579 [0,2,0,0,0,0|2,0,0]=4 7245 B9R0.14 COCC(CCl)NC(N)=O Amb25709611 [0,2,0,0,0,0|2,0,0]=4 7246 B9R0.14 COCC(CCl)OC(N)=O Amb24505274 [0,2,0,0,0,0|2,0,0]=4 7247 B9R0.14 COCC(CN)NC(C)=O Amb24475242 [0,2,0,0,0,0|2,0,0]=4 7248 B9R0.14 COCC(CO)NC(C)=O Amb25324512 [0,2,0,0,0,0|2,0,0]=4 7249 B9R0.14 COCC(CO)OC(C)=O Amb25098534 [0,2,0,0,0,0|2,0,0]=4 7250 B9R0.14 COC[C@@H](CO)OC(C)=O Amb24430030 [0,2,0,0,0,0|2,0,0]=4 7251 B9R0.14 COC\C(=C\C(O)=O)\OC Amb24648711 [0,2,0,0,0,0|0,0,2]=4 7252 B9R0.14 CO[C@@H](CC=C)CC(O)=O Amb24642527 [0,2,0,0,0,0|0,0,1]=3 7253 B9R0.14 CS(=O)CC(CC)NCC Amb25139771 [0,2,0,0,0,0|2,0,0]=4 7254 B9R0.14 CSCC(CC(O)=O)SC Amb25201534 [0,2,0,0,0,0|0,0,0]=2 7255 B9R0.14 C\C=C/C(CC(O)=O)CN Amb24479019 [0,2,0,0,0,0|0,0,1]=3 7256 B9R0.14 C\C=C\C(CC(C)=O)CC Amb24454326 [0,2,0,0,0,0|1,0,0]=3 7257 B9R0.14 C\C=C\C(CC(C)=O)OC Amb25091874 [0,2,0,0,0,0|1,0,1]=4 7258 B9R0.14 C\C=C\C(CC(O)=O)CC Amb18643921 [0,2,0,0,0,0|0,0,0]=2 7259 B9R0.14 C\C=C\C(CC(O)=O)CN Amb25259204 [0,2,0,0,0,0|0,0,1]=3 7260 B9R0.14 C\C=C\[C@@H](CC(O)=O)CC Amb25251887 [0,2,0,0,0,0|0,0,0]=2 7261 B9R0.14 NC(=O)N[C@H](CCO)CO Amb25739354 [0,2,0,0,0,0|2,0,0]=4 7262 B9R0.14 NCCN(CC(O)=O)C=O Amb24598749 [0,2,0,0,0,0|1,0,1]=4 7263 B9R0.14 OCCN(CC(=O)Cl)CC Amb17142905 [0,2,0,0,0,0|2,0,0]=4 7264 B9R0.14 OCCN(CC(=O)N)CC Amb17142866 [0,2,0,0,0,0|2,0,0]=4 7265 B9R0.14 OCCN(CC(=O)O)N=O Amb17618586 [0,2,0,0,0,0|2,0,0]=4 7266 B9R0.14 OCCN(CC(O)=O)C=O Amb24636204 [0,2,0,0,0,0|1,0,1]=4 7267 B9R0.34 BrCCC(=O)NC(CC)C Amb17328291 [0,2,0,0,0,0|2,0,0]=4 7268 B9R0.34 CC#CC(=O)CC(O)CC Amb24534614 [0,2,0,0,0,0|2,0,0]=4 7269 B9R0.34 CC#CC(=O)NC(C)CC Amb25788311 [0,2,0,0,0,0|2,0,0]=4 7270 B9R0.34 CC#CC(C)CC(=O)C#N Amb25263179 [0,2,0,0,0,0|1,0,1]=4 7271 B9R0.34 CC#CC(O)CC(=O)OC Amb25094142 [0,2,0,0,0,0|1,0,1]=4 7272 B9R0.34 CC(CC#C)OC(=O)CO Amb24482607 [0,2,0,0,0,0|1,0,1]=4 7273 B9R0.34 CC(CC#N)NC(=O)CO Amb25056553 [0,2,0,0,0,0|1,0,1]=4 7274 B9R0.34 CC(CC(=C)CC)NCC Amb25032485 [0,2,0,0,0,0|2,0,0]=4 7275 B9R0.34 CC(CC(=O)C#N)CC#C Amb24725323 [0,2,0,0,0,0|1,0,1]=4 7276 B9R0.34 CC(CC(=O)CC)NCC Amb24480804 [0,2,0,0,0,0|1,0,0]=3 7277 B9R0.34 CC(CC(=O)CC)OCC Amb24631573 [0,2,0,0,0,0|1,0,0]=3 7278 B9R0.34 CC(CC(=O)NCC)CC Amb24480695 [0,2,0,0,0,0|1,0,0]=3 7279 B9R0.34 CC(CC(=O)OCCl)CCl Amb24739499 [0,2,0,0,0,0|1,0,0]=3 7280 B9R0.34 CC(CC(O)C#CC)CC Amb24595047 [0,2,0,0,0,0|1,0,1]=4 7281 B9R0.34 CC(CC(O)C=C)OCC Amb24466149 [0,2,0,0,0,0|1,0,1]=4 7282 B9R0.34 CC(CC(O)CC)OCC Amb25284250 [0,2,0,0,0,0|1,0,1]=4 7283 B9R0.34 CC(CC(O)CC=O)CC Amb24636242 [0,2,0,0,0,0|0,0,1]=3 7284 B9R0.34 CC(CC(O)CCN)CC Amb25127021 [0,2,0,0,0,0|1,0,1]=4 7285 B9R0.34 CC(CC(O)CO)CCO Amb25739814 [0,2,0,0,0,0|0,0,2]=4 7286 B9R0.34 CC(CC(O)CSC)CC Amb18798164 [0,2,0,0,0,0|0,1,1]=4 7287 B9R0.34 CC(CC)NC(=O)C#CBr Amb25694496 [0,2,0,0,0,0|2,0,0]=4 7288 B9R0.34 CC(CC)NC(=S)OCC Amb25702230 [0,2,0,0,0,0|1,1,0]=4 7289 B9R0.34 CC(CC)OC(=O)NCC Amb25239324 [0,2,0,0,0,0|2,0,0]=4 7290 B9R0.34 CC(CCC)=CC(=O)OC Amb25347310 [0,2,0,0,0,0|0,0,2]=4 7291 B9R0.34 CC(CCC)CC(O)C=O Amb25778304 [0,2,0,0,0,0|0,0,1]=3 7292 B9R0.34 CC(CCC)CC(O)CCl Amb24418324 [0,2,0,0,0,0|1,0,1]=4 7293 B9R0.34 CC(CCC)CC(O)CN Amb24718688 [0,2,0,0,0,0|1,0,1]=4 7294 B9R0.34 CC(CCN)CC(=O)NO Amb25210106 [0,2,0,0,0,0|0,0,0]=2 7295 B9R0.34 CC(CCN)NC(=O)C#C Amb18908340 [0,2,0,0,0,0|2,0,0]=4 7296 B9R0.34 CC(CCO)NC(=O)CN Amb24375622 [0,2,0,0,0,0|2,0,0]=4 7297 B9R0.34 CC(CCO)NC(=O)CS Amb24479315 [0,2,0,0,0,0|1,1,0]=4 7298 B9R0.34 CC(CCO)OC(=O)C=C Amb25220523 [0,2,0,0,0,0|2,0,0]=4 7299 B9R0.34 CC(CCO)OC(=O)CS Amb25345165 [0,2,0,0,0,0|1,1,0]=4 7300 B9R0.34 CC(CN)CC(=O)CC=C Amb25119242 [0,2,0,0,0,0|2,0,0]=4 7301 B9R0.34 CC(CN)CC(=O)NC#N Amb25065050 [0,2,0,0,0,0|2,0,0]=4 7302 B9R0.34 CC(CN)CS(=O)CCO Amb24690012 [0,2,0,0,0,0|2,0,0]=4 7303 B9R0.34 CC(CO)OC(=O)NCO Amb25757901 [0,2,0,0,0,0|2,0,0]=4 7304 B9R0.34 CC(COC)CC(O)C#C Amb24674479 [0,2,0,0,0,0|1,0,1]=4 7305 B9R0.34 CC(COC)CC(O)CC Amb25204410 [0,2,0,0,0,0|1,0,1]=4 7306 B9R0.34 CC(CS(=O)CC)NCC Amb25730346 [0,2,0,0,0,0|2,0,0]=4 7307 B9R0.34 CC(NC(=O)CBr)COC Amb17327377 [0,2,0,0,0,0|2,0,0]=4 7308 B9R0.34 CC(NC(=O)CCl)COC Amb1204382 [0,2,0,0,0,0|2,0,0]=4 7309 B9R0.34 CC(OC(=O)CC#N)CC Amb17210521 [0,2,0,0,0,0|2,0,0]=4 7310 B9R0.34 CCC(=O)CC(=O)OCF Amb24383775 [0,2,0,0,0,0|1,0,1]=4 7311 B9R0.34 CCC(=O)CC(C)CC=C Amb25712973 [0,2,0,0,0,0|1,0,1]=4 7312 B9R0.34 CCC(=O)CC(C)COC Amb25315701 [0,2,0,0,0,0|1,0,0]=3 7313 B9R0.34 CCC(=O)CC(O)CCO Amb24662474 [0,2,0,0,0,0|2,0,0]=4 7314 B9R0.34 CCC(=O)C[C@H](C)CC=C Amb24620054 [0,2,0,0,0,0|1,0,1]=4 7315 B9R0.34 CCC(=O)NC(C)CCBr Amb25247063 [0,2,0,0,0,0|2,0,0]=4 7316 B9R0.34 CCC(=O)NC(C)CCN Amb25809430 [0,2,0,0,0,0|2,0,0]=4 7317 B9R0.34 CCC(=O)NC(C)CCO Amb24479310 [0,2,0,0,0,0|2,0,0]=4 7318 B9R0.34 CCC(=O)N[C@@H](C)CCO Amb24482920 [0,2,0,0,0,0|2,0,0]=4 7319 B9R0.34 CCC(=O)N[C@H](C)COC Amb25120535 [0,2,0,0,0,0|2,0,0]=4 7320 B9R0.34 CCC(=O)OC(C)CCC Amb25044387 [0,2,0,0,0,0|2,0,0]=4 7321 B9R0.34 CCC(Br)CC(=O)OCC Amb24695293 [0,2,0,0,0,0|1,0,0]=3 7322 B9R0.34 CCC(C)CC(=O)CC#N Amb24723211 [0,2,0,0,0,0|1,0,0]=3 7323 B9R0.34 CCC(C)CC(=O)CC=C Amb25737376 [0,2,0,0,0,0|1,0,0]=3 7324 B9R0.34 CCC(C)CC(=O)CCO Amb24676908 [0,2,0,0,0,0|0,0,0]=2 7325 B9R0.34 CCC(C)CC(=O)COC Amb25084947 [0,2,0,0,0,0|0,0,0]=2 7326 B9R0.34 CCC(C)CC(=O)CSC Amb18797916 [0,2,0,0,0,0|0,1,0]=3 7327 B9R0.34 CCC(C)CC(=O)N=C=O Amb24524441 [0,2,0,0,0,0|0,0,1]=3 7328 B9R0.34 CCC(C)CC(=O)N=C=S Amb24504806 [0,2,0,0,0,0|0,1,0]=3 7329 B9R0.34 CCC(C)CC(=O)NOC Amb25347805 [0,2,0,0,0,0|0,0,0]=2 7330 B9R0.34 CCC(C)CC(=O)\C=C\Cl Amb24741086 [0,2,0,0,0,0|1,0,0]=3 7331 B9R0.34 CCC(C)CC(C)CCO Amb24082763 [0,2,0,0,0,0|1,0,1]=4 7332 B9R0.34 CCC(C)CC(C)NC=O Amb24742393 [0,2,0,0,0,0|1,0,1]=4 7333 B9R0.34 CCC(C)CN(C)CC=O Amb24362202 [0,2,0,0,0,0|2,0,0]=4 7334 B9R0.34 CCC(C)CS(=O)CC#N Amb24644089 [0,2,0,0,0,0|2,0,0]=4 7335 B9R0.34 CCC(C)CS(=O)CC=O Amb25846516 [0,2,0,0,0,0|1,0,1]=4 7336 B9R0.34 CCC(C)NC(=O)COC Amb23247499 [0,2,0,0,0,0|1,0,0]=3 7337 B9R0.34 CCC(C)NC(=O)CSC Amb25693187 [0,2,0,0,0,0|1,1,0]=4 7338 B9R0.34 CCC(C)NC(=O)NOC Amb24482615 [0,2,0,0,0,0|1,0,0]=3 7339 B9R0.34 CCC(C)NC(=S)NOC Amb24482064 [0,2,0,0,0,0|1,1,0]=4 7340 B9R0.34 CCC(C)OC(=O)CCC Amb22732903 [0,2,0,0,0,0|2,0,0]=4 7341 B9R0.34 CCC(C)OC(=O)CCN Amb24426264 [0,2,0,0,0,0|2,0,0]=4 7342 B9R0.34 CCC(C)OC(=O)CCS Amb24384724 [0,2,0,0,0,0|1,1,0]=4 7343 B9R0.34 CCC(C)OC(=O)CNC Amb25325782 [0,2,0,0,0,0|2,0,0]=4 7344 B9R0.34 CCC(C)OC(=O)CON Amb25799708 [0,2,0,0,0,0|1,0,0]=3 7345 B9R0.34 CCC(C)OC(=O)CSC Amb25763680 [0,2,0,0,0,0|1,1,0]=4 7346 B9R0.34 CCC(C)OC(=S)OCCl Amb24693886 [0,2,0,0,0,0|1,1,0]=4 7347 B9R0.34 CCC(N)CC(=O)CC=C Amb24569297 [0,2,0,0,0,0|2,0,0]=4 7348 B9R0.34 CCC(N)CC(=O)NC#N Amb25145593 [0,2,0,0,0,0|2,0,0]=4 7349 B9R0.34 CCC(N)CC(=O)NCC Amb25798371 [0,2,0,0,0,0|2,0,0]=4 7350 B9R0.34 CCC(N)CC(=O)NOC Amb24711012 [0,2,0,0,0,0|1,0,0]=3 7351 B9R0.34 CCC(N)CC(=O)OCC Amb18644203 [0,2,0,0,0,0|1,0,0]=3 7352 B9R0.34 CCC(O)CC(=O)OCC Amb24476858 [0,2,0,0,0,0|1,0,0]=3 7353 B9R0.34 CCCC(=O)CC(C)CC Amb25806879 [0,2,0,0,0,0|1,0,0]=3 7354 B9R0.34 CCCC(=O)CC(C)CN Amb24444411 [0,2,0,0,0,0|2,0,0]=4 7355 B9R0.34 CCCC(=O)CC(C)OC Amb25304496 [0,2,0,0,0,0|2,0,0]=4 7356 B9R0.34 CCCC(Br)CC(=O)OC Amb25278221 [0,2,0,0,0,0|1,0,0]=3 7357 B9R0.34 CCCC(C)CC(=O)C=C Amb24432206 [0,2,0,0,0,0|1,0,0]=3 7358 B9R0.34 CCCC(C)CC(=O)CC Amb25363636 [0,2,0,0,0,0|1,0,0]=3 7359 B9R0.34 CCCC(C)CC(=O)NC Amb24478965 [0,2,0,0,0,0|1,0,0]=3 7360 B9R0.34 CCCC(C)CC(=O)OC Amb25125122 [0,2,0,0,0,0|0,0,0]=2 7361 B9R0.34 CCCC(C)CC(C)C=O Amb25375062 [0,2,0,0,0,0|1,0,1]=4 7362 B9R0.34 CCCC(C)C[C@@H](C)CO Amb24588411 [0,2,0,0,0,0|1,0,1]=4 7363 B9R0.34 CCCC(C)NC(=O)C#C Amb25344377 [0,2,0,0,0,0|2,0,0]=4 7364 B9R0.34 CCCC(C)NC(=O)CBr Amb24395881 [0,2,0,0,0,0|2,0,0]=4 7365 B9R0.34 CCCC(C)NC(=O)CF Amb24538004 [0,2,0,0,0,0|2,0,0]=4 7366 B9R0.34 CCCC(C)NC(=O)CS Amb24529304 [0,2,0,0,0,0|1,1,0]=4 7367 B9R0.34 CCCC(C)NC(N)=NO Amb25742869 [0,2,0,0,0,0|2,0,0]=4 7368 B9R0.34 CCCC(C)OC(=O)CS Amb25710936 [0,2,0,0,0,0|1,1,0]=4 7369 B9R0.34 CCCC(C)SC(=S)OC Amb25343465 [0,2,0,0,0,0|1,1,0]=4 7370 B9R0.34 CCCC(C)\C=C(/C)\C=O Amb24381942 [0,2,0,0,0,0|1,0,1]=4 7371 B9R0.34 CCCC(N)CC(=O)CC Amb24504347 [0,2,0,0,0,0|2,0,0]=4 7372 B9R0.34 CCCC(N)CC(=O)NC Amb24650708 [0,2,0,0,0,0|2,0,0]=4 7373 B9R0.34 CCCC(N)CC(=O)NN Amb25232933 [0,2,0,0,0,0|2,0,0]=4 7374 B9R0.34 CCCC(N)CC(=O)OC Amb22059489 [0,2,0,0,0,0|1,0,0]=3 7375 B9R0.34 CCCC(NC(=O)OC)C Amb16205053 [0,2,0,0,0,0|1,0,0]=3 7376 B9R0.34 CCCC(O)CC(=O)C=C Amb25706988 [0,2,0,0,0,0|2,0,0]=4 7377 B9R0.34 CCCC(O)CC(=O)NC Amb25766510 [0,2,0,0,0,0|2,0,0]=4 7378 B9R0.34 CCCC(O)CC(=O)NN Amb25702693 [0,2,0,0,0,0|2,0,0]=4 7379 B9R0.34 CCCC(O)CC(=O)OC Amb21928831 [0,2,0,0,0,0|1,0,0]=3 7380 B9R0.34 CCCC(O)CC(C)=NO Amb24509368 [0,2,0,0,0,0|2,0,0]=4 7381 B9R0.34 CCCN(C)CC(=O)NC Amb24482927 [0,2,0,0,0,0|2,0,0]=4 7382 B9R0.34 CCCN(C)CC(=O)NN Amb24476956 [0,2,0,0,0,0|2,0,0]=4 7383 B9R0.34 CCCN(C)CC(=O)NO Amb24643894 [0,2,0,0,0,0|1,0,0]=3 7384 B9R0.34 CCCS(=O)CC(=O)OC Amb18788303 [0,2,0,0,0,0|2,0,0]=4 7385 B9R0.34 CCC[C@@H](C)\C=C(\C)/CO Amb25762036 [0,2,0,0,0,0|1,0,1]=4 7386 B9R0.34 CCC[C@@H](O)CC(=O)C=C Amb24448964 [0,2,0,0,0,0|2,0,0]=4 7387 B9R0.34 CCC[C@@H](O)CC(=O)NN Amb24419272 [0,2,0,0,0,0|2,0,0]=4 7388 B9R0.34 CCC[C@H](C)C[C@H](C)C=O Amb25717745 [0,2,0,0,0,0|1,0,1]=4 7389 B9R0.34 CCC[C@H](C)C[C@H](C)CO Amb25781733 [0,2,0,0,0,0|1,0,1]=4 7390 B9R0.34 CCC[C@H](N)CC(=O)OC Amb25147500 [0,2,0,0,0,0|1,0,0]=3 7391 B9R0.34 CCN(C)CC(=O)COC Amb24413531 [0,2,0,0,0,0|1,0,0]=3 7392 B9R0.34 CCN(C)CC(=O)NOC Amb24722338 [0,2,0,0,0,0|1,0,0]=3 7393 B9R0.34 CCNC(=O)CC(=O)NO Amb24529208 [0,2,0,0,0,0|1,0,1]=4 7394 B9R0.34 CCNC(=O)CC(=O)OC Amb17399890 [0,2,0,0,0,0|1,0,1]=4 7395 B9R0.34 CCNC(=O)CC(C)SC Amb25296031 [0,2,0,0,0,0|2,0,0]=4 7396 B9R0.34 CCNC(C)CC(=O)C#C Amb25378395 [0,2,0,0,0,0|1,0,0]=3 7397 B9R0.34 CCNC(C)CC(=O)C=C Amb24586663 [0,2,0,0,0,0|1,0,0]=3 7398 B9R0.34 CCNC(C)CC(=O)NN Amb25146440 [0,2,0,0,0,0|1,0,0]=3 7399 B9R0.34 CCNC(C)CC(=O)NO Amb25146433 [0,2,0,0,0,0|0,0,0]=2 7400 B9R0.34 CCNC(C)CC(C)OC Amb24720976 [0,2,0,0,0,0|1,0,1]=4 7401 B9R0.34 CCOC(=O)CC(=O)CO Amb25759916 [0,2,0,0,0,0|1,0,1]=4 7402 B9R0.34 CCOC(=O)CC(C)C=O Amb18644116 [0,2,0,0,0,0|1,0,1]=4 7403 B9R0.34 CCOC(=O)CC(C)CN Amb22059484 [0,2,0,0,0,0|1,0,0]=3 7404 B9R0.34 CCOC(=O)CC(C)CO Amb25770626 [0,2,0,0,0,0|1,0,0]=3 7405 B9R0.34 CCOC(=O)CC(C)SC Amb18798150 [0,2,0,0,0,0|1,0,0]=3 7406 B9R0.34 CCOC(=O)CC(CC)C Amb10807395 [0,2,0,0,0,0|0,0,0]=2 7407 B9R0.34 CCOC(=O)CC(CCl)O Amb17594152 [0,2,0,0,0,0|2,0,0]=4 7408 B9R0.34 CCOC(=O)CC(Cl)CCl Amb25111029 [0,2,0,0,0,0|2,0,0]=4 7409 B9R0.34 CCOC(=O)CC(Cl)CO Amb25241335 [0,2,0,0,0,0|2,0,0]=4 7410 B9R0.34 CCOC(=O)CC(F)CI Amb22738582 [0,2,0,0,0,0|2,0,0]=4 7411 B9R0.34 CCOC(=O)CC(N)CN Amb24681015 [0,2,0,0,0,0|2,0,0]=4 7412 B9R0.34 CCOC(=O)CC(N)CO Amb24477090 [0,2,0,0,0,0|2,0,0]=4 7413 B9R0.34 CCOC(=O)CC(O)CBr Amb22733258 [0,2,0,0,0,0|2,0,0]=4 7414 B9R0.34 CCOC(=O)CC(O)CI Amb22736620 [0,2,0,0,0,0|2,0,0]=4 7415 B9R0.34 CCOC(=O)CC(O)CN Amb25095715 [0,2,0,0,0,0|2,0,0]=4 7416 B9R0.34 CCOC(=O)CC(O)CO Amb25199318 [0,2,0,0,0,0|2,0,0]=4 7417 B9R0.34 CCOC(=O)C[C@@H](C)C=O Amb25780070 [0,2,0,0,0,0|1,0,1]=4 7418 B9R0.34 CCOC(=O)C[C@@H](O)CN Amb25224575 [0,2,0,0,0,0|2,0,0]=4 7419 B9R0.34 CCOC(=O)C[C@H](C)CBr Amb24477273 [0,2,0,0,0,0|1,0,0]=3 7420 B9R0.34 CCOC(=O)C[C@H](N)CO Amb24334216 [0,2,0,0,0,0|2,0,0]=4 7421 B9R0.34 CCOC(=O)NC(C)CC Amb17858944 [0,2,0,0,0,0|1,0,0]=3 7422 B9R0.34 CCOC(=O)NC(C)CF Amb24397855 [0,2,0,0,0,0|2,0,0]=4 7423 B9R0.34 CCOC(=O)N[C@@H](C)CO Amb25836094 [0,2,0,0,0,0|2,0,0]=4 7424 B9R0.34 CCOC(=O)N[C@H](C)CN Amb25340808 [0,2,0,0,0,0|2,0,0]=4 7425 B9R0.34 CCOC(=O)N[C@H](C)CO Amb24763624 [0,2,0,0,0,0|2,0,0]=4 7426 B9R0.34 CCOC(=O)OC(C)CBr Amb24361312 [0,2,0,0,0,0|2,0,0]=4 7427 B9R0.34 CCOC(=O)OC(C)SC Amb25091560 [0,2,0,0,0,0|2,0,0]=4 7428 B9R0.34 CCOC(=O)O[C@H](C)CO Amb24625151 [0,2,0,0,0,0|2,0,0]=4 7429 B9R0.34 CCOC(C)OC(=O)CCl Amb24480498 [0,2,0,0,0,0|2,0,0]=4 7430 B9R0.34 CCO[C@@H](O)CC(=O)CCl Amb25141554 [0,2,0,0,0,0|2,0,0]=4 7431 B9R0.34 CCO[C@@H](O)CC(=O)CO Amb25129047 [0,2,0,0,0,0|1,0,0]=3 7432 B9R0.34 CCO[C@H](O)CC(=O)CCl Amb24585158 [0,2,0,0,0,0|2,0,0]=4 7433 B9R0.34 CCS(=O)CC(=O)OCC Amb18788301 [0,2,0,0,0,0|2,0,0]=4 7434 B9R0.34 CCSC(C)CC(=O)NN Amb24411866 [0,2,0,0,0,0|1,0,0]=3 7435 B9R0.34 CCSC(C)CC(N)=NO Amb18792444 [0,2,0,0,0,0|1,0,0]=3 7436 B9R0.34 CC[C@@H](C)NC(=O)CCC Amb24401089 [0,2,0,0,0,0|2,0,0]=4 7437 B9R0.34 CC[C@@H](N)CC(=O)OCC Amb24351614 [0,2,0,0,0,0|1,0,0]=3 7438 B9R0.34 CC[C@@H](O)CC(=O)OCC Amb20241603 [0,2,0,0,0,0|1,0,0]=3 7439 B9R0.34 CC[C@H](C)CC(=O)\C=C\Cl Amb24482164 [0,2,0,0,0,0|1,0,0]=3 7440 B9R0.34 CC[C@H](C)NC(=O)CCC Amb24446190 [0,2,0,0,0,0|2,0,0]=4 7441 B9R0.34 CN(CC(=O)NCC)CC Amb25145226 [0,2,0,0,0,0|2,0,0]=4 7442 B9R0.34 CN(CCO)CC(=O)NN Amb24477910 [0,2,0,0,0,0|2,0,0]=4 7443 B9R0.34 CN(CCO)CC(N)=NO Amb25683823 [0,2,0,0,0,0|2,0,0]=4 7444 B9R0.34 CNC(=O)CC(C)NCC Amb18314891 [0,2,0,0,0,0|1,0,0]=3 7445 B9R0.34 CNC(=O)CN(C)CCF Amb24459070 [0,2,0,0,0,0|2,0,0]=4 7446 B9R0.34 CNC(=O)CN(C)CCO Amb24502264 [0,2,0,0,0,0|2,0,0]=4 7447 B9R0.34 CNC(=O)NC(C)CCC Amb24749519 [0,2,0,0,0,0|2,0,0]=4 7448 B9R0.34 CNC(=O)NC(C)CCN Amb18251285 [0,2,0,0,0,0|2,0,0]=4 7449 B9R0.34 CNC(=O)NC(C)CCO Amb25853732 [0,2,0,0,0,0|2,0,0]=4 7450 B9R0.34 CNC(=O)NC(C)COC Amb25788874 [0,2,0,0,0,0|2,0,0]=4 7451 B9R0.34 CNC(=O)N[C@H](C)CCO Amb25318045 [0,2,0,0,0,0|2,0,0]=4 7452 B9R0.34 CNC(=O)OC(C)CNC Amb24720954 [0,2,0,0,0,0|2,0,0]=4 7453 B9R0.34 CNCC(=O)NC(C)CC Amb21958751 [0,2,0,0,0,0|2,0,0]=4 7454 B9R0.34 CNCC(C)NC(=O)CC Amb24730299 [0,2,0,0,0,0|2,0,0]=4 7455 B9R0.34 COC(=O)CC(=O)CCO Amb25833665 [0,2,0,0,0,0|1,0,1]=4 7456 B9R0.34 COC(=O)CC(=O)CSC Amb24441248 [0,2,0,0,0,0|1,0,1]=4 7457 B9R0.34 COC(=O)CC(C)CC=O Amb18644136 [0,2,0,0,0,0|0,0,1]=3 7458 B9R0.34 COC(=O)CC(C)CCBr Amb24477385 [0,2,0,0,0,0|0,0,0]=2 7459 B9R0.34 COC(=O)CC(C)CCN Amb24546678 [0,2,0,0,0,0|0,0,0]=2 7460 B9R0.34 COC(=O)CC(C)N=[N+]=[N-] Amb25325715 [0,2,0,0,0,0|2,0,0]=4 7461 B9R0.34 COC(=O)CC(N)CC=C Amb25799423 [0,2,0,0,0,0|1,0,1]=4 7462 B9R0.34 COC(=O)CC(O)CC#C Amb25136248 [0,2,0,0,0,0|1,0,1]=4 7463 B9R0.34 COC(=O)CC(O)CC#N Amb24391893 [0,2,0,0,0,0|1,0,1]=4 7464 B9R0.34 COC(=O)CC(O)CCBr Amb25760946 [0,2,0,0,0,0|1,0,0]=3 7465 B9R0.34 COC(=O)CC(O)CSC Amb24412887 [0,2,0,0,0,0|1,0,0]=3 7466 B9R0.34 COC(=O)CN(C)CC#N Amb24478119 [0,2,0,0,0,0|1,0,1]=4 7467 B9R0.34 COC(=O)CN(C)CCI Amb25807165 [0,2,0,0,0,0|1,0,0]=3 7468 B9R0.34 COC(=O)CN(C)CCN Amb22059127 [0,2,0,0,0,0|1,0,0]=3 7469 B9R0.34 COC(=O)CS(=O)CCCl Amb25277573 [0,2,0,0,0,0|2,0,0]=4 7470 B9R0.34 COC(=O)C[C@@H](C)CC=O Amb24365488 [0,2,0,0,0,0|0,0,1]=3 7471 B9R0.34 COC(=O)C[C@@H](C)N=[N+]=[N-] Amb24753916 [0,2,0,0,0,0|2,0,0]=4 7472 B9R0.34 COC(=O)C[C@@H](N)CC=C Amb25259760 [0,2,0,0,0,0|1,0,1]=4 7473 B9R0.34 COC(=O)C[C@@H](N)CCO Amb25132686 [0,2,0,0,0,0|1,0,0]=3 7474 B9R0.34 COC(=O)C[C@@H](O)CSC Amb25266160 [0,2,0,0,0,0|1,0,0]=3 7475 B9R0.34 COC(=O)C[C@H](C)CC=O Amb25799016 [0,2,0,0,0,0|0,0,1]=3 7476 B9R0.34 COC(=O)C[C@H](C)CCO Amb24449995 [0,2,0,0,0,0|0,0,0]=2 7477 B9R0.34 COC(=O)C[C@H](N)CC#N Amb24367695 [0,2,0,0,0,0|1,0,1]=4 7478 B9R0.34 COC(=O)C[C@H](N)CC=C Amb25294467 [0,2,0,0,0,0|1,0,1]=4 7479 B9R0.34 COC(=O)C[C@H](N)CCO Amb25776064 [0,2,0,0,0,0|1,0,0]=3 7480 B9R0.34 COC(=O)C[C@H](O)CC#C Amb24457417 [0,2,0,0,0,0|1,0,1]=4 7481 B9R0.34 COC(=O)C[C@H](O)CC=C Amb24672394 [0,2,0,0,0,0|1,0,1]=4 7482 B9R0.34 COC(=O)NC(C)CC#C Amb24480802 [0,2,0,0,0,0|1,0,1]=4 7483 B9R0.34 COC(=O)NC(C)CC=C Amb25790033 [0,2,0,0,0,0|1,0,1]=4 7484 B9R0.34 COC(=O)NC(C)CCO Amb24479314 [0,2,0,0,0,0|1,0,0]=3 7485 B9R0.34 COC(=O)NC(C)OCC Amb25068640 [0,2,0,0,0,0|1,0,0]=3 7486 B9R0.34 COC(=O)N[C@@H](C)CCO Amb24676467 [0,2,0,0,0,0|1,0,0]=3 7487 B9R0.34 COC(=O)N[C@H](C)COC Amb25686727 [0,2,0,0,0,0|1,0,0]=3 7488 B9R0.34 COC(=O)OC(C)CCCl Amb25724505 [0,2,0,0,0,0|1,0,0]=3 7489 B9R0.34 COC(C)CC(=O)CC=C Amb25329299 [0,2,0,0,0,0|2,0,0]=4 7490 B9R0.34 COC(C)CC(Cl)=CCO Amb25847834 [0,2,0,0,0,0|2,0,0]=4 7491 B9R0.34 COC(C)NC(=O)OCC Amb25327169 [0,2,0,0,0,0|2,0,0]=4 7492 B9R0.34 COCC(=O)CC(C)C=C Amb24422782 [0,2,0,0,0,0|0,0,2]=4 7493 B9R0.34 COCC(=O)CC(C)CO Amb24529163 [0,2,0,0,0,0|1,0,0]=3 7494 B9R0.34 COCC(=O)NC(C)CF Amb25769134 [0,2,0,0,0,0|2,0,0]=4 7495 B9R0.34 COCC(=O)NC(C)CO Amb24478046 [0,2,0,0,0,0|2,0,0]=4 7496 B9R0.34 COCC(=O)N[C@@H](C)CN Amb24483982 [0,2,0,0,0,0|2,0,0]=4 7497 B9R0.34 COCC(=O)OC(C)CC Amb20620616 [0,2,0,0,0,0|1,0,0]=3 7498 B9R0.34 COCC(C)CC(=O)C#C Amb25686303 [0,2,0,0,0,0|1,0,0]=3 7499 B9R0.34 COCC(C)CC(N)=NN Amb25115378 [0,2,0,0,0,0|2,0,0]=4 7500 B9R0.34 COCC(C)NC(N)=NO Amb24651537 [0,2,0,0,0,0|2,0,0]=4 7501 B9R0.34 COCC(C)OC(=O)CBr Amb18602730 [0,2,0,0,0,0|2,0,0]=4 7502 B9R0.34 COCC(C)OC(=O)CC Amb22167298 [0,2,0,0,0,0|2,0,0]=4 7503 B9R0.34 COCC(C)OC(=O)CN Amb18114762 [0,2,0,0,0,0|2,0,0]=4 7504 B9R0.34 COCC(C)OC(=O)CO Amb24632862 [0,2,0,0,0,0|1,0,0]=3 7505 B9R0.34 COCC(C)OC(=O)CS Amb24700867 [0,2,0,0,0,0|1,1,0]=4 7506 B9R0.34 COCC(N)CC(=O)OC Amb24393406 [0,2,0,0,0,0|1,0,0]=3 7507 B9R0.34 COCS(=O)CC(C)CN Amb25081134 [0,2,0,0,0,0|2,0,0]=4 7508 B9R0.34 COC[C@@H](C)NC(=O)CO Amb24482690 [0,2,0,0,0,0|1,0,0]=3 7509 B9R0.34 COC[C@@H](N)CC(=O)OC Amb25118860 [0,2,0,0,0,0|1,0,0]=3 7510 B9R0.34 COC[C@H](N)CC(=O)OC Amb24518573 [0,2,0,0,0,0|1,0,0]=3 7511 B9R0.34 CON(C)CC(=O)OCC Amb25134510 [0,2,0,0,0,0|2,0,0]=4 7512 B9R0.34 CON(C)CC(C)CCN Amb25079213 [0,2,0,0,0,0|2,0,0]=4 7513 B9R0.34 CONC(=O)NC(C)CO Amb25855681 [0,2,0,0,0,0|2,0,0]=4 7514 B9R0.34 CONC(=O)N[C@@H](C)CF Amb24715819 [0,2,0,0,0,0|2,0,0]=4 7515 B9R0.34 CSCC(C)NC(=O)C=C Amb25210407 [0,2,0,0,0,0|2,0,0]=4 7516 B9R0.34 CSCC(C)NC(=O)CS Amb24469962 [0,2,0,0,0,0|1,1,0]=4 7517 B9R0.34 CSCC(C)NC(N)=NO Amb25147801 [0,2,0,0,0,0|2,0,0]=4 7518 B9R0.34 C[C@@H](CCO)NC(=O)C#C Amb24459019 [0,2,0,0,0,0|2,0,0]=4 7519 B9R0.34 C[C@H](CCO)C[C@@H](C)C=O Amb24686545 [0,2,0,0,0,0|1,0,1]=4 7520 B9R0.34 C[C@H](CCO)C[C@@H](C)CO Amb24397963 [0,2,0,0,0,0|1,0,1]=4 7521 B9R0.34 C\C(\CC)=C\C(=O)OCC Amb24479412 [0,2,0,0,0,0|0,0,2]=4 7522 B9R0.34 C\C=C\C(=O)CC(C)CO Amb24691750 [0,2,0,0,0,0|2,0,0]=4 7523 B9R0.34 C\C=C\C(=O)CC(Cl)CC Amb25101667 [0,2,0,0,0,0|2,0,0]=4 7524 B9R0.34 C\C=C\C(=O)CC(O)CC Amb24647753 [0,2,0,0,0,0|2,0,0]=4 7525 B9R0.34 C\C=C\C(=O)C[C@@H](O)CC Amb24362834 [0,2,0,0,0,0|2,0,0]=4 7526 B9R0.34 C\C=C\C(=O)NC(C)CC Amb24716146 [0,2,0,0,0,0|2,0,0]=4 7527 B9R0.34 C\C=C\C(=O)N[C@H](C)CC Amb24761513 [0,2,0,0,0,0|2,0,0]=4 7528 B9R0.34 C\C=C\C(=O)OC(CC)C Amb15693451 [0,2,0,0,0,0|2,0,0]=4 7529 B9R0.34 C\C=C\C(C)CC(=O)CC Amb25347493 [0,2,0,0,0,0|1,0,1]=4 7530 B9R0.34 C\C=C\C(N)CC(=O)OC Amb24746604 [0,2,0,0,0,0|1,0,1]=4 7531 B9R0.34 C\C=C\[C@@H](C)OC(=O)CO Amb25129805 [0,2,0,0,0,0|1,0,1]=4 7532 B9R0.34 C\C=C\[C@H](C)OC(=O)CO Amb25332110 [0,2,0,0,0,0|1,0,1]=4 7533 B9R0.34 C\C=C\[C@H](N)CC(=O)OC Amb25147608 [0,2,0,0,0,0|1,0,1]=4 7534 B9R0.34 ClCCC(=O)NC(CC)C Amb1141567 [0,2,0,0,0,0|2,0,0]=4 7535 B9R0.34 NCCC(=O)NC(CC)C Amb10609171 [0,2,0,0,0,0|2,0,0]=4 7536 B9R0.34 NCCC(=O)NC(CC)C Amb1129019 [0,2,0,0,0,0|2,0,0]=4 7537 B9R0.34 OCCC(=O)NC(CC)C Amb17334240 [0,2,0,0,0,0|1,0,0]=3 7538 B9R0.44 CC(CCCl)CS(=O)(=O)Cl Amb25791628 [0,2,0,0,0,0|1,0,1]=4 7539 B9R0.44 CC(CCN)OP(O)(O)=O Amb25279469 [0,2,0,0,0,0|2,0,0]=4 7540 B9R0.44 CC(CCN)OS(O)(=O)=O Amb24400652 [0,2,0,0,0,0|2,0,0]=4 7541 B9R0.44 CC(CCO)CP(C)(C)=O Amb25763876 [0,2,0,0,0,0|2,0,0]=4 7542 B9R0.44 CC(CCO)OP(O)(O)=O Amb25676634 [0,2,0,0,0,0|2,0,0]=4 7543 B9R0.44 CCCC(C)CS(=O)(=O)Cl Amb18325512 [0,2,0,0,0,0|1,0,1]=4 7544 B9R0.44 CCCC(C)CS(=O)(=O)F Amb19515127 [0,2,0,0,0,0|1,0,1]=4 7545 B9R0.44 CCCC(C)CS(N)(=O)=O Amb18800966 [0,2,0,0,0,0|1,0,1]=4 7546 B9R0.44 CCCC(C)OP(O)(O)=O Amb25366416 [0,2,0,0,0,0|2,0,0]=4 7547 B9R0.44 CCCC(Cl)CP(O)(O)=O Amb24433873 [0,2,0,0,0,0|2,0,0]=4 7548 B9R0.44 CCNC(C)CC(C)(C)O Amb24724931 [0,2,0,0,0,0|1,0,1]=4 7549 B9R0.44 CCNC(C)CS(C)(=O)=O Amb19029792 [0,2,0,0,0,0|1,0,1]=4 7550 B9R0.44 CN(CCO)CP(O)(O)=O Amb24557213 [0,2,0,0,0,0|2,0,0]=4 7551 B9R0.44 CNCC(C)OS(O)(=O)=O Amb25684742 [0,2,0,0,0,0|2,0,0]=4 7552 B9R0.44 CNCC(O)CS(O)(=O)=O Amb24693950 [0,2,0,0,0,0|2,0,0]=4 7553 B9R0.44 CSCC(C)CS(C)(=O)=O Amb24590860 [0,2,0,0,0,0|1,0,1]=4 7554 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [0,2,0,0,0,0|0,0,0]=2 7555 B9R0.53 CC(=C)CN(C)CC(N)=O Amb24721334 [0,2,0,0,0,0|2,0,0]=4 7556 B9R0.53 CC(=CC(O)=O)NC(C)C Amb25360223 [0,2,0,0,0,0|0,0,2]=4 7557 B9R0.53 CC(=N)NC(C)CC(N)=O Amb24444187 [0,2,0,0,0,0|1,0,1]=4 7558 B9R0.53 CC(=O)CC(=O)CC(O)=O Amb18644062 [0,2,0,0,0,0|1,0,1]=4 7559 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [0,2,0,0,0,0|0,0,0]=2 7560 B9R0.53 CC(=O)CN(C)CC(F)F Amb25041242 [0,2,0,0,0,0|2,0,0]=4 7561 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [0,2,0,0,0,0|0,0,0]=2 7562 B9R0.53 CC(=O)C[C@H](O)CC(C)=C Amb25318972 [0,2,0,0,0,0|2,0,0]=4 7563 B9R0.53 CC(=O)C\C(\C)=C\C(O)=O Amb25833580 [0,2,0,0,0,0|0,0,2]=4 7564 B9R0.53 CC(=O)NC(C)CC(C)=O Amb24096345 [0,2,0,0,0,0|1,0,1]=4 7565 B9R0.53 CC(=O)NN(C)CC(O)=O Amb24430379 [0,2,0,0,0,0|1,0,1]=4 7566 B9R0.53 CC(=O)N[C@H](C)CC(C)=O Amb24478882 [0,2,0,0,0,0|1,0,1]=4 7567 B9R0.53 CC(=O)OC(C)CC(C)=O Amb25690313 [0,2,0,0,0,0|1,0,1]=4 7568 B9R0.53 CC(=O)OC(C)CC(O)=O Amb18644244 [0,2,0,0,0,0|0,0,1]=3 7569 B9R0.53 CC(=O)O[C@H](C)CC(O)=O Amb25062672 [0,2,0,0,0,0|0,0,1]=3 7570 B9R0.53 CC(=O)\C=C(/C)\CC(O)=O Amb25838743 [0,2,0,0,0,0|0,0,2]=4 7571 B9R0.53 CC(=O)\C=C(\C)/CC(O)=O Amb24446679 [0,2,0,0,0,0|0,0,2]=4 7572 B9R0.53 CC(=S)NC(C)CC(C)=O Amb25329355 [0,2,0,0,0,0|1,0,1]=4 7573 B9R0.53 CC(C)=CC(C)CC(C)=O Amb25093185 [0,2,0,0,0,0|1,0,1]=4 7574 B9R0.53 CC(C)=CC(C)CC(O)=O Amb24480766 [0,2,0,0,0,0|0,0,1]=3 7575 B9R0.53 CC(C)=CC(O)CC(O)=O Amb18644102 [0,2,0,0,0,0|1,0,1]=4 7576 B9R0.53 CC(C)=C[C@@H](O)CC(O)=O Amb24393168 [0,2,0,0,0,0|1,0,1]=4 7577 B9R0.53 CC(C)CC(=C)CC(O)=O Amb18643897 [0,2,0,0,0,0|0,0,2]=4 7578 B9R0.53 CC(C)CC(C)CC(C)=O Amb20621119 [0,2,0,0,0,0|1,0,0]=3 7579 B9R0.53 CC(C)CC(C)CC(C)O Amb24271139 [0,2,0,0,0,0|1,0,1]=4 7580 B9R0.53 CC(C)CC(C)CC(N)=N Amb24479387 [0,2,0,0,0,0|2,0,0]=4 7581 B9R0.53 CC(C)CC(C)CC(N)=S Amb24565637 [0,2,0,0,0,0|1,1,0]=4 7582 B9R0.53 CC(C)CC(C)NC(C)=O Amb25824393 [0,2,0,0,0,0|2,0,0]=4 7583 B9R0.53 CC(C)CC(C)OC(C)=O Amb22733405 [0,2,0,0,0,0|2,0,0]=4 7584 B9R0.53 CC(C)CC(Cl)CC(=O)Cl Amb25241016 [0,2,0,0,0,0|2,0,0]=4 7585 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,2,0,0,0,0|2,0,0]=4 7586 B9R0.53 CC(C)CC(O)CC(C)=O Amb25054426 [0,2,0,0,0,0|2,0,0]=4 7587 B9R0.53 CC(C)CS(=O)CC(O)=O Amb18792576 [0,2,0,0,0,0|2,0,0]=4 7588 B9R0.53 CC(C)C[C@@H](C)CC(C)=O Amb24480437 [0,2,0,0,0,0|1,0,0]=3 7589 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [0,2,0,0,0,0|0,0,0]=2 7590 B9R0.53 CC(C)C[C@@H](O)CC(C)=O Amb24480617 [0,2,0,0,0,0|2,0,0]=4 7591 B9R0.53 CC(C)C[C@H](C)CC(C)=O Amb25707831 [0,2,0,0,0,0|1,0,0]=3 7592 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [0,2,0,0,0,0|1,0,0]=3 7593 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [0,2,0,0,0,0|1,0,0]=3 7594 B9R0.53 CC(C)NC(C)CC(C)O Amb24587728 [0,2,0,0,0,0|1,0,1]=4 7595 B9R0.53 CC(C)NC(C)NC(C)=O Amb24553224 [0,2,0,0,0,0|2,0,0]=4 7596 B9R0.53 CC(C)N[C@H](C)C[C@@H](C)O Amb24695074 [0,2,0,0,0,0|1,0,1]=4 7597 B9R0.53 CC(C)N[C@H](C)C[C@H](C)O Amb24742191 [0,2,0,0,0,0|1,0,1]=4 7598 B9R0.53 CC(C)OC(C)NC(C)=O Amb22729317 [0,2,0,0,0,0|2,0,0]=4 7599 B9R0.53 CC(C)O[C@H](C)CC(O)=O Amb24463494 [0,2,0,0,0,0|0,0,0]=2 7600 B9R0.53 CC(C)SC(=O)CC(O)=O Amb25743447 [0,2,0,0,0,0|1,0,1]=4 7601 B9R0.53 CC(C)SC(C)CC(C)=O Amb25126446 [0,2,0,0,0,0|1,0,0]=3 7602 B9R0.53 CC(C)SC(C)CC(N)=N Amb18792301 [0,2,0,0,0,0|2,0,0]=4 7603 B9R0.53 CC(C)SC(C)CC(O)=O Amb18303284 [0,2,0,0,0,0|0,0,0]=2 7604 B9R0.53 CC(CC(=O)N)NC(C)C Amb17231987 [0,2,0,0,0,0|1,0,0]=3 7605 B9R0.53 CC(CC(C)Br)CC(C)=C Amb24583898 [0,2,0,0,0,0|2,0,0]=4 7606 B9R0.53 CC(CC(C)Cl)CC(C)=C Amb24581835 [0,2,0,0,0,0|2,0,0]=4 7607 B9R0.53 CC(CC(C)N)CC(C)=C Amb24688721 [0,2,0,0,0,0|2,0,0]=4 7608 B9R0.53 CC(CC(C)O)NC(C)=O Amb25211368 [0,2,0,0,0,0|2,0,0]=4 7609 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [0,2,0,0,0,0|1,0,0]=3 7610 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [0,2,0,0,0,0|1,0,0]=3 7611 B9R0.53 CC(CC(F)F)NC(C)=O Amb25257113 [0,2,0,0,0,0|2,0,0]=4 7612 B9R0.53 CC(CC(O)=O)CC(N)=O Amb19034796 [0,2,0,0,0,0|0,0,1]=3 7613 B9R0.53 CC(CC(O)=O)C[N+]([O-])=O Amb25142280 [0,2,0,0,0,0|1,0,0]=3 7614 B9R0.53 CC(CC(O)=O)NC(N)=N Amb25696242 [0,2,0,0,0,0|1,0,1]=4 7615 B9R0.53 CC(CC(O)=O)NS(C)=O Amb25347318 [0,2,0,0,0,0|1,0,0]=3 7616 B9R0.53 CC(CC(O)=O)OC(F)F Amb24536176 [0,2,0,0,0,0|1,0,0]=3 7617 B9R0.53 CC(CC(O)=O)SC(N)=N Amb24429158 [0,2,0,0,0,0|1,0,1]=4 7618 B9R0.53 CC(CC(O)=O)SC(N)=S Amb24391550 [0,2,0,0,0,0|1,0,1]=4 7619 B9R0.53 CC(CN(C)C)=CC(O)=O Amb24390419 [0,2,0,0,0,0|0,0,2]=4 7620 B9R0.53 CC(CN(C)C)NC(C)=O Amb25127012 [0,2,0,0,0,0|2,0,0]=4 7621 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [0,2,0,0,0,0|0,0,0]=2 7622 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [0,2,0,0,0,0|1,0,0]=3 7623 B9R0.53 CC(N)CC(C)NC(N)=O Amb25828986 [0,2,0,0,0,0|2,0,0]=4 7624 B9R0.53 CC(N)CN(C)CC(N)=O Amb25060268 [0,2,0,0,0,0|2,0,0]=4 7625 B9R0.53 CC(N)CN(C)CC(O)=O Amb25140627 [0,2,0,0,0,0|1,0,0]=3 7626 B9R0.53 CC(NC(=O)CC(=O)O)C Amb17399889 [0,2,0,0,0,0|1,0,1]=4 7627 B9R0.53 CC(O)CN(C)CC(C)=O Amb24441836 [0,2,0,0,0,0|2,0,0]=4 7628 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [0,2,0,0,0,0|1,0,0]=3 7629 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [0,2,0,0,0,0|1,0,0]=3 7630 B9R0.53 CN(C)CC(O)CC(N)=O Amb24744547 [0,2,0,0,0,0|2,0,0]=4 7631 B9R0.53 CN(C)C[C@@H](O)CC(O)=O Amb25084529 [0,2,0,0,0,0|1,0,0]=3 7632 B9R0.53 CN(CC(=O)C)CC(=O)C Amb10604213 [0,2,0,0,0,0|2,0,0]=4 7633 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,2,0,0,0,0|1,0,1]=4 7634 B9R0.53 CN(CC(F)F)CC(O)=O Amb18177927 [0,2,0,0,0,0|1,0,0]=3 7635 B9R0.53 CN(CC(O)=O)CC(=C)Br Amb19015553 [0,2,0,0,0,0|1,0,1]=4 7636 B9R0.53 CN(C[C@@H](CC(=O)O)O)C Amb10069803 [0,2,0,0,0,0|1,0,0]=3 7637 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [0,2,0,0,0,0|1,0,0]=3 7638 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [0,2,0,0,0,0|1,0,0]=3 7639 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [0,2,0,0,0,0|1,0,0]=3 7640 B9R0.53 C[C@@H](CN(C)C)NC(N)=O Amb25129953 [0,2,0,0,0,0|2,0,0]=4 7641 B9R0.53 C[C@@H](CN(C)C)OC(N)=O Amb24678456 [0,2,0,0,0,0|2,0,0]=4 7642 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,2,0,0,0,0|2,0,0]=4 7643 B9R0.53 C[C@H](CN(C)C)NC(N)=O Amb24734199 [0,2,0,0,0,0|2,0,0]=4 7644 B9R0.53 C[C@H](C[C@@H](C)O)NC(C)=O Amb24597644 [0,2,0,0,0,0|2,0,0]=4 7645 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,2,0,0,0,0|2,0,0]=4 7646 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,2,0,0,0,0|2,0,0]=4 7647 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [0,2,0,0,0,0|1,0,0]=3 7648 B9R0.53 C\C(\CC(C)=O)=C\C(C)C Amb24614276 [0,2,0,0,0,0|1,0,1]=4 7649 B9R0.53 C\C(\CC(C)=O)=N/C(C)C Amb25833982 [0,2,0,0,0,0|1,0,1]=4 7650 B9R0.53 C\C(\CC(C)=O)=N/C(C)O Amb25730154 [0,2,0,0,0,0|1,0,1]=4 7651 B9R0.53 NC(=O)CC(O)CC(O)=O Amb25147276 [0,2,0,0,0,0|1,0,1]=4 7652 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,2,0,0,0,0|1,0,1]=4 7653 B9R0.53 OC(=O)CC(Cl)CC(O)=O Amb18126464 [0,2,0,0,0,0|1,0,1]=4 7654 B9R0.53 OC(=O)CS(=O)CC(F)F Amb18180309 [0,2,0,0,0,0|2,0,0]=4 7655 B9R0.53 OC(=O)C[C@@H](NC(=O)C)C Amb2372568 [0,2,0,0,0,0|0,0,1]=3 7656 B9R0.53 OC(=O)C[C@H](NC(=O)C)C Amb2372567 [0,2,0,0,0,0|0,0,1]=3 7657 B9R0.53 OC(CC(=O)O)CC(=O)O Amb17615401 [0,2,0,0,0,0|1,0,1]=4 7658 B9R0.58 C#CCC(CC(=O)C)(C)C Amb17593505 [0,2,0,0,0,0|1,0,1]=4 7659 B9R0.58 CC#CC(C)(C)CC(N)=O Amb24427304 [0,2,0,0,0,0|1,0,1]=4 7660 B9R0.58 CC#CC(C)(C)CC(O)=O Amb24568886 [0,2,0,0,0,0|0,0,1]=3 7661 B9R0.58 CC(=C)CC(C)(C)CCO Amb25318561 [0,2,0,0,0,0|2,0,0]=4 7662 B9R0.58 CC(=O)CC(C)(C)CC=C Amb24475264 [0,2,0,0,0,0|1,0,1]=4 7663 B9R0.58 CC(=O)CC(C)(C)CC=O Amb18643928 [0,2,0,0,0,0|1,0,1]=4 7664 B9R0.58 CC(=O)CC(C)(O)CC#N Amb25319900 [0,2,0,0,0,0|1,0,1]=4 7665 B9R0.58 CC(=O)CC(C)(O)CC=C Amb24712053 [0,2,0,0,0,0|1,0,1]=4 7666 B9R0.58 CC(=O)C[C@@](C)(O)CC=C Amb24633653 [0,2,0,0,0,0|1,0,1]=4 7667 B9R0.58 CC(=O)NC(C)(C)CCN Amb25223376 [0,2,0,0,0,0|2,0,0]=4 7668 B9R0.58 CC(=O)OC(C)(C)CCO Amb25796231 [0,2,0,0,0,0|2,0,0]=4 7669 B9R0.58 CC(C)(CC#N)CC(O)=O Amb25239942 [0,2,0,0,0,0|0,0,1]=3 7670 B9R0.58 CC(C)(CC(O)=O)N=C=O Amb25840671 [0,2,0,0,0,0|1,0,1]=4 7671 B9R0.58 CC(C)(CC=C)CC(O)=O Amb18643902 [0,2,0,0,0,0|0,0,1]=3 7672 B9R0.58 CC(C)(CC=O)CC(O)=O Amb18644096 [0,2,0,0,0,0|0,0,1]=3 7673 B9R0.58 CC(C)(CCCl)CC(O)=O Amb18646188 [0,2,0,0,0,0|0,0,0]=2 7674 B9R0.58 CC(C)(CCN)CC(O)=O Amb24637226 [0,2,0,0,0,0|0,0,0]=2 7675 B9R0.58 CC(C)(CCN)NC(N)=O Amb25130000 [0,2,0,0,0,0|2,0,0]=4 7676 B9R0.58 CC(C)(CCO)CC(O)=O Amb24682986 [0,2,0,0,0,0|0,0,0]=2 7677 B9R0.58 CC(O)(CC#N)CC(N)=O Amb18643863 [0,2,0,0,0,0|1,0,1]=4 7678 B9R0.58 CC(O)(CC=C)CC(O)=O Amb18644103 [0,2,0,0,0,0|0,0,1]=3 7679 B9R0.58 CC(O)(CC=O)CC(O)=O Amb25770615 [0,2,0,0,0,0|0,0,1]=3 7680 B9R0.58 CC(O)(CCO)CC(O)=O Amb18644354 [0,2,0,0,0,0|0,0,0]=2 7681 B9R0.58 CCCC(C)(C)CC(C)=O Amb24413025 [0,2,0,0,0,0|1,0,0]=3 7682 B9R0.58 CCCC(C)(C)CC(N)=O Amb25051244 [0,2,0,0,0,0|1,0,0]=3 7683 B9R0.58 CCCC(C)(C)CC(O)=O Amb22229019 [0,2,0,0,0,0|0,0,0]=2 7684 B9R0.58 CCCC(C)(O)CC(O)=O Amb18310709 [0,2,0,0,0,0|0,0,0]=2 7685 B9R0.58 CCCC(F)(F)CC(O)=O Amb24482478 [0,2,0,0,0,0|1,0,0]=3 7686 B9R0.58 CCNC(C)(C)CC(C)=O Amb25147479 [0,2,0,0,0,0|1,0,0]=3 7687 B9R0.58 CCNC(C)(C)CC(C)O Amb25147347 [0,2,0,0,0,0|1,0,1]=4 7688 B9R0.58 CCOC(C)(C)CC(C)O Amb24686645 [0,2,0,0,0,0|1,0,1]=4 7689 B9R0.58 CCOP(C)(=O)CC(O)=O Amb25374552 [0,2,0,0,0,0|1,0,0]=3 7690 B9R0.58 CCOP(O)(=O)CC(O)=O Amb25303550 [0,2,0,0,0,0|2,0,0]=4 7691 B9R0.58 CCOS(=O)(=O)CC(O)=O Amb24423881 [0,2,0,0,0,0|2,0,0]=4 7692 B9R0.58 CCSC(C)(C)CC(C)=O Amb24456707 [0,2,0,0,0,0|1,0,0]=3 7693 B9R0.58 CNCC(C)(C)CC(C)=C Amb25124246 [0,2,0,0,0,0|2,0,0]=4 7694 B9R0.58 CNCC(C)(C)CC(O)=O Amb24116872 [0,2,0,0,0,0|0,0,0]=2 7695 B9R0.58 CNCC(C)(C)NC(C)=O Amb24552111 [0,2,0,0,0,0|2,0,0]=4 7696 B9R0.58 CNCC(C)(C)NC(N)=O Amb24552155 [0,2,0,0,0,0|2,0,0]=4 7697 B9R0.58 CNNC(C)(O)CC(C)=O Amb24647850 [0,2,0,0,0,0|2,0,0]=4 7698 B9R0.58 COCC(C)(C)CC(O)=O Amb24116871 [0,2,0,0,0,0|0,0,0]=2 7699 B9R0.58 C[C@@](O)(CCO)CC(O)=O Amb21856037 [0,2,0,0,0,0|0,0,0]=2 7700 B9R0.58 C[C@](N)(CC=C)CC(O)=O Amb24504958 [0,2,0,0,0,0|0,0,1]=3 7701 B9R0.58 C[N+](C)(CCO)CC([O-])=O Amb24390421 [0,2,0,0,0,0|1,0,1]=4 7702 B9R0.58 C\C=C\C(C)(C)CC(C)=O Amb24378948 [0,2,0,0,0,0|1,0,1]=4 7703 B9R0.58 C\C=C\[C@](C)(O)CC(O)=O Amb25084485 [0,2,0,0,0,0|0,0,1]=3 7704 B9R0.58 NCCS(=O)(=O)CC(=O)O Amb17500548 [0,2,0,0,0,0|2,0,0]=4 7705 B9R0.58 OC(=O)CS(=O)(=O)CCF Amb25040440 [0,2,0,0,0,0|2,0,0]=4 7706 B9R0.58 OCCS(=O)(=O)CC(=O)O Amb17502670 [0,2,0,0,0,0|2,0,0]=4 7707 B9R0.26 CC(CC(CBr)CC)OC Amb25352429 [0,2,0,0,0,0|1,0,1]=4 7708 B9R0.26 CC(CC(CC)=NN)CC Amb25676316 [0,2,0,0,0,0|2,0,0]=4 7709 B9R0.26 CC(CC(CC)=NO)CC Amb24556233 [0,2,0,0,0,0|1,0,0]=3 7710 B9R0.26 CC(CC(CC)CC)C=O Amb24513817 [0,2,0,0,0,0|1,0,1]=4 7711 B9R0.26 CC(CC(CO)CS)CC Amb24405791 [0,2,0,0,0,0|0,1,1]=4 7712 B9R0.26 CC(CC)\C=C(/CC)\C=O Amb24596622 [0,2,0,0,0,0|1,0,1]=4 7713 B9R0.26 CC(CC)\C=C(/CO)\CC Amb25226317 [0,2,0,0,0,0|1,0,1]=4 7714 B9R0.26 CCC(=CC(=O)OC)NC Amb25340218 [0,2,0,0,0,0|0,0,2]=4 7715 B9R0.26 CCC(=O)CC(CC)=CC Amb24721699 [0,2,0,0,0,0|1,0,1]=4 7716 B9R0.26 CCC(=O)CC(CC)C#N Amb18124542 [0,2,0,0,0,0|1,0,1]=4 7717 B9R0.26 CCC(=O)CC(CC)C=O Amb24381498 [0,2,0,0,0,0|1,0,1]=4 7718 B9R0.26 CCC(=O)CC(OC)OC Amb22893502 [0,2,0,0,0,0|2,0,0]=4 7719 B9R0.26 CCC(=O)CC(SC)SC Amb25286758 [0,2,0,0,0,0|2,0,0]=4 7720 B9R0.26 CCC(=O)CN(CC)CC Amb25330249 [0,2,0,0,0,0|2,0,0]=4 7721 B9R0.26 CCC(=O)CP(CC)CC Amb25677620 [0,2,0,0,0,0|2,0,0]=4 7722 B9R0.26 CCC(=O)NC(CN)CC Amb18112591 [0,2,0,0,0,0|2,0,0]=4 7723 B9R0.26 CCC(C#C)NC(=O)OC Amb25323053 [0,2,0,0,0,0|1,0,1]=4 7724 B9R0.26 CCC(C#C)OC(=O)CO Amb24529209 [0,2,0,0,0,0|1,0,1]=4 7725 B9R0.26 CCC(C#N)NC(=O)OC Amb24418273 [0,2,0,0,0,0|1,0,1]=4 7726 B9R0.26 CCC(C=C)OC(=O)CO Amb24362344 [0,2,0,0,0,0|1,0,1]=4 7727 B9R0.26 CCC(C=O)NC(=O)OC Amb24666422 [0,2,0,0,0,0|1,0,1]=4 7728 B9R0.26 CCC(CC(=O)CN)CC Amb24351344 [0,2,0,0,0,0|1,0,0]=3 7729 B9R0.26 CCC(CC(=O)NC)C#N Amb24504791 [0,2,0,0,0,0|1,0,1]=4 7730 B9R0.26 CCC(CC(=O)NN)CN Amb25299102 [0,2,0,0,0,0|1,0,0]=3 7731 B9R0.26 CCC(CC(=O)NO)CC Amb24362522 [0,2,0,0,0,0|0,0,0]=2 7732 B9R0.26 CCC(CC(=O)NO)SC Amb25080774 [0,2,0,0,0,0|0,0,0]=2 7733 B9R0.26 CCC(CC(=O)OC)C=O Amb18644131 [0,2,0,0,0,0|0,0,1]=3 7734 B9R0.26 CCC(CC(=O)OC)SC Amb25787832 [0,2,0,0,0,0|0,0,0]=2 7735 B9R0.26 CCC(CC(O)C=O)CC Amb24737351 [0,2,0,0,0,0|0,0,1]=3 7736 B9R0.26 CCC(CC(O)CC)CO Amb24614905 [0,2,0,0,0,0|1,0,1]=4 7737 B9R0.26 CCC(CC(O)CCl)CC Amb24502307 [0,2,0,0,0,0|1,0,1]=4 7738 B9R0.26 CCC(CC(O)CN)CC Amb24351477 [0,2,0,0,0,0|1,0,1]=4 7739 B9R0.26 CCC(CC(O)CO)CC Amb24396451 [0,2,0,0,0,0|0,0,2]=4 7740 B9R0.26 CCC(CC)NC(=O)CI Amb24476106 [0,2,0,0,0,0|2,0,0]=4 7741 B9R0.26 CCC(CC)NC(=O)CO Amb24478047 [0,2,0,0,0,0|1,0,0]=3 7742 B9R0.26 CCC(CC)SC(=C)CO Amb24421615 [0,2,0,0,0,0|2,0,0]=4 7743 B9R0.26 CCC(CN)CN(C)OC Amb25825562 [0,2,0,0,0,0|2,0,0]=4 7744 B9R0.26 CCC(CN)NC(=O)C#C Amb18251202 [0,2,0,0,0,0|2,0,0]=4 7745 B9R0.26 CCC(CN)NC(=O)C=C Amb24558032 [0,2,0,0,0,0|2,0,0]=4 7746 B9R0.26 CCC(CO)NC(=O)CO Amb24377617 [0,2,0,0,0,0|1,0,0]=3 7747 B9R0.26 CCC(CO)OC(=O)CCl Amb24674207 [0,2,0,0,0,0|2,0,0]=4 7748 B9R0.26 CCC(CO)\C=C(\C)/C=O Amb24735030 [0,2,0,0,0,0|1,0,1]=4 7749 B9R0.26 CCC(CS)NC(=O)CS Amb25840348 [0,2,0,0,0,0|1,1,0]=4 7750 B9R0.26 CCC(C\C(\N)=N\O)SC Amb18792445 [0,2,0,0,0,0|1,0,0]=3 7751 B9R0.26 CCC(NC(=O)CBr)CO Amb17329184 [0,2,0,0,0,0|2,0,0]=4 7752 B9R0.26 CCC(NC(=O)CCl)CC Amb1150999 [0,2,0,0,0,0|2,0,0]=4 7753 B9R0.26 CCC(NC(=O)CCl)CO Amb17325439 [0,2,0,0,0,0|2,0,0]=4 7754 B9R0.26 CCC(NC(=O)OC)OC Amb25694298 [0,2,0,0,0,0|1,0,0]=3 7755 B9R0.26 CCC(O)CC(CC)CC Amb24386267 [0,2,0,0,0,0|1,0,1]=4 7756 B9R0.26 CCN(CC(=O)C=C)CC Amb25697757 [0,2,0,0,0,0|2,0,0]=4 7757 B9R0.26 CCN(CC(=O)CN)CC Amb24482542 [0,2,0,0,0,0|2,0,0]=4 7758 B9R0.26 CCN(CC(=O)NO)CC Amb24073451 [0,2,0,0,0,0|1,0,0]=3 7759 B9R0.26 CCN(CC(=O)OC)C#N Amb25147810 [0,2,0,0,0,0|1,0,1]=4 7760 B9R0.26 CCN(C\C(=N\O)\C)CC Amb1935216 [0,2,0,0,0,0|2,0,0]=4 7761 B9R0.26 CCN(C\C(=N\O)\N)CC Amb1121017 [0,2,0,0,0,0|2,0,0]=4 7762 B9R0.26 CC[C@@H](C#N)NC(=O)CO Amb24448687 [0,2,0,0,0,0|1,0,1]=4 7763 B9R0.26 CC[C@@H](CC(O)C=C)OC Amb25058589 [0,2,0,0,0,0|1,0,1]=4 7764 B9R0.26 CC[C@@H](CO)NC(=O)C#C Amb25044440 [0,2,0,0,0,0|2,0,0]=4 7765 B9R0.26 CC[C@@H](CO)NC(=O)C=C Amb25350303 [0,2,0,0,0,0|2,0,0]=4 7766 B9R0.26 CC[C@@H](CO)NC(=O)CBr Amb24463211 [0,2,0,0,0,0|2,0,0]=4 7767 B9R0.26 CC[C@@H](CO)NC(=O)CN Amb24718723 [0,2,0,0,0,0|2,0,0]=4 7768 B9R0.26 CC[C@@H](CO)NC(=O)CO Amb24524473 [0,2,0,0,0,0|1,0,0]=3 7769 B9R0.26 CC[C@@H](CO)NC(=O)OC Amb25090263 [0,2,0,0,0,0|1,0,0]=3 7770 B9R0.26 CC[C@H](C#C)NC(=O)OC Amb24478940 [0,2,0,0,0,0|1,0,1]=4 7771 B9R0.26 CC[C@H](C#N)NC(=O)OC Amb25189236 [0,2,0,0,0,0|1,0,1]=4 7772 B9R0.26 CC[C@H](CC(O)C=C)OC Amb24354567 [0,2,0,0,0,0|1,0,1]=4 7773 B9R0.26 CC[C@H](CO)NC(=O)CCl Amb24447032 [0,2,0,0,0,0|2,0,0]=4 7774 B9R0.26 CC[C@H](C[C@@H](O)CC)CO Amb25058571 [0,2,0,0,0,0|1,0,1]=4 7775 B9R0.26 CC[C@H](C[C@H](O)CC)CO Amb25852919 [0,2,0,0,0,0|1,0,1]=4 7776 B9R0.26 CNC(=O)CC(CN)NC Amb25357849 [0,2,0,0,0,0|2,0,0]=4 7777 B9R0.26 CNC(=O)CC(CN)OC Amb25047215 [0,2,0,0,0,0|2,0,0]=4 7778 B9R0.26 CNC(=O)CN(CC)CC Amb20140863 [0,2,0,0,0,0|2,0,0]=4 7779 B9R0.26 CNC(=O)NC(CN)CC Amb18251286 [0,2,0,0,0,0|2,0,0]=4 7780 B9R0.26 CNC(CC(=C)CC)CC Amb25854748 [0,2,0,0,0,0|2,0,0]=4 7781 B9R0.26 CNC(CO)CC(=O)OC Amb25352354 [0,2,0,0,0,0|1,0,0]=3 7782 B9R0.26 CNC(CS(=O)CC)CC Amb25065748 [0,2,0,0,0,0|2,0,0]=4 7783 B9R0.26 COC(=O)C=C(CC)CC Amb24513727 [0,2,0,0,0,0|0,0,2]=4 7784 B9R0.26 COC(=O)CC(C=O)OC Amb18644250 [0,2,0,0,0,0|1,0,1]=4 7785 B9R0.26 COC(=O)CC(CC)CC Amb25028016 [0,2,0,0,0,0|0,0,0]=2 7786 B9R0.26 COC(=O)CC(CCl)SC Amb24711347 [0,2,0,0,0,0|1,0,0]=3 7787 B9R0.26 COC(=O)CC(CF)CBr Amb24477175 [0,2,0,0,0,0|1,0,0]=3 7788 B9R0.26 COC(=O)CC(CN)OC Amb25742371 [0,2,0,0,0,0|1,0,0]=3 7789 B9R0.26 COC(=O)CC(CO)OC Amb24648310 [0,2,0,0,0,0|1,0,0]=3 7790 B9R0.26 COC(=O)CN(CCl)CCl Amb24358030 [0,2,0,0,0,0|2,0,0]=4 7791 B9R0.26 COC(=O)C[C@@H](C=O)OC Amb25093838 [0,2,0,0,0,0|1,0,1]=4 7792 B9R0.26 COC(=O)C[C@H](CF)CBr Amb24477161 [0,2,0,0,0,0|1,0,0]=3 7793 B9R0.26 COC(=O)NC(CF)OC Amb24478311 [0,2,0,0,0,0|2,0,0]=4 7794 B9R0.26 COC(=O)NC(CO)CO Amb25739290 [0,2,0,0,0,0|2,0,0]=4 7795 B9R0.26 COC(=S)SC(CC)CC Amb24482806 [0,2,0,0,0,0|1,1,0]=4 7796 B9R0.26 COC(CC(=C)C=O)OC Amb24478333 [0,2,0,0,0,0|2,0,0]=4 7797 B9R0.26 COC(CC(=O)NN)CN Amb24638624 [0,2,0,0,0,0|2,0,0]=4 7798 B9R0.26 COC(CC(O)C=O)OC Amb25371744 [0,2,0,0,0,0|1,0,1]=4 7799 B9R0.26 ONC(=O)OC(CCl)CCl Amb24477080 [0,2,0,0,0,0|2,0,0]=4 7800 B9R0.39 CC(=O)C(CC(O)=O)CC Amb24410015 [0,2,0,0,0,0|0,0,0]=2 7801 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,2,0,0,0,0|0,0,1]=3 7802 B9R0.39 CC(=O)CC(CC)C(O)=O Amb18644109 [0,2,0,0,0,0|1,0,1]=4 7803 B9R0.39 CC(=O)C\C(=C\C)\C(C)C Amb25265231 [0,2,0,0,0,0|1,0,1]=4 7804 B9R0.39 CC(=O)N(CC(N)=O)CC Amb24719895 [0,2,0,0,0,0|2,0,0]=4 7805 B9R0.39 CC(Br)C(CC)NC(C)=O Amb24564998 [0,2,0,0,0,0|2,0,0]=4 7806 B9R0.39 CC(C)C(CC(C)=O)CC Amb25041005 [0,2,0,0,0,0|1,0,0]=3 7807 B9R0.39 CC(C)C(CC(C)=O)OC Amb24478344 [0,2,0,0,0,0|1,0,0]=3 7808 B9R0.39 CC(C)C(CC(C)O)CO Amb25051409 [0,2,0,0,0,0|1,0,1]=4 7809 B9R0.39 CC(C)C(CC(C)O)NC Amb24445614 [0,2,0,0,0,0|1,0,1]=4 7810 B9R0.39 CC(C)C(CC(N)=N)OC Amb24671878 [0,2,0,0,0,0|2,0,0]=4 7811 B9R0.39 CC(C)C(CC(N)=O)CN Amb25177753 [0,2,0,0,0,0|1,0,0]=3 7812 B9R0.39 CC(C)C(CC(N)=O)NC Amb25738895 [0,2,0,0,0,0|1,0,0]=3 7813 B9R0.39 CC(C)C(CC(N)=S)OC Amb25094283 [0,2,0,0,0,0|1,1,0]=4 7814 B9R0.39 CC(C)C(CC(O)=O)C#N Amb25818234 [0,2,0,0,0,0|0,0,1]=3 7815 B9R0.39 CC(C)C(CC(O)=O)C=C Amb18643903 [0,2,0,0,0,0|0,0,1]=3 7816 B9R0.39 CC(C)C(CC(O)=O)CC Amb18304202 [0,2,0,0,0,0|0,0,0]=2 7817 B9R0.39 CC(C)C(CC(O)=O)SC Amb25858344 [0,2,0,0,0,0|0,0,0]=2 7818 B9R0.39 CC(C)C(CC([O-])=O)C=O Amb25094387 [0,2,0,0,0,0|0,0,2]=4 7819 B9R0.39 CC(C)C(CC)NC(C)=O Amb24382327 [0,2,0,0,0,0|2,0,0]=4 7820 B9R0.39 CC(C)C(CC)NC(N)=O Amb24478066 [0,2,0,0,0,0|2,0,0]=4 7821 B9R0.39 CC(C)C(CC)OC(N)=O Amb25793071 [0,2,0,0,0,0|2,0,0]=4 7822 B9R0.39 CC(C)C(CN)CC(C)O Amb25709727 [0,2,0,0,0,0|1,0,1]=4 7823 B9R0.39 CC(C)C(CN)NC(C)=O Amb18251274 [0,2,0,0,0,0|2,0,0]=4 7824 B9R0.39 CC(C)C(CN)NC(N)=O Amb18251283 [0,2,0,0,0,0|2,0,0]=4 7825 B9R0.39 CC(C)C(CO)NC(N)=O Amb24479041 [0,2,0,0,0,0|2,0,0]=4 7826 B9R0.39 CC(C)C(CS)NC(C)=O Amb24624696 [0,2,0,0,0,0|2,0,0]=4 7827 B9R0.39 CC(C)N(CC(O)=O)C=O Amb18972732 [0,2,0,0,0,0|1,0,1]=4 7828 B9R0.39 CC(C)[C@@H](CBr)OC(C)=O Amb24505068 [0,2,0,0,0,0|2,0,0]=4 7829 B9R0.39 CC(C)[C@@H](CC(C)=O)CC Amb24758695 [0,2,0,0,0,0|1,0,0]=3 7830 B9R0.39 CC(C)[C@@H](CS)NC(C)=O Amb25260420 [0,2,0,0,0,0|2,0,0]=4 7831 B9R0.39 CC(Cl)C(CC)NC(C)=O Amb25335628 [0,2,0,0,0,0|2,0,0]=4 7832 B9R0.39 CC(Cl)C(CC)OC(C)=O Amb24524553 [0,2,0,0,0,0|2,0,0]=4 7833 B9R0.39 CC(Cl)C(CCl)OC(C)=O Amb25691700 [0,2,0,0,0,0|2,0,0]=4 7834 B9R0.39 CC(N)C(CC(O)=O)CC Amb23536772 [0,2,0,0,0,0|0,0,0]=2 7835 B9R0.39 CC(N)C(CC)NC(C)=O Amb25286894 [0,2,0,0,0,0|2,0,0]=4 7836 B9R0.39 CC(N)C(CC)NC(N)=O Amb24725531 [0,2,0,0,0,0|2,0,0]=4 7837 B9R0.39 CC(O)C(CC(O)=O)CC Amb18831453 [0,2,0,0,0,0|0,0,0]=2 7838 B9R0.39 CC(O)C(CC(O)=O)NC Amb24400678 [0,2,0,0,0,0|0,0,0]=2 7839 B9R0.39 CC(O)C(CC)OC(C)=O Amb25769425 [0,2,0,0,0,0|2,0,0]=4 7840 B9R0.39 CC(O)C(CC)OC(N)=O Amb25339455 [0,2,0,0,0,0|2,0,0]=4 7841 B9R0.39 CCC(=CC(O)=O)C(C)O Amb24568884 [0,2,0,0,0,0|0,0,2]=4 7842 B9R0.39 CCC(C(=O)O)CC(=O)O Amb10071696 [0,2,0,0,0,0|0,0,1]=3 7843 B9R0.39 CCC(CC(O)=O)=C(F)F Amb24482233 [0,2,0,0,0,0|0,0,2]=4 7844 B9R0.39 CCC(CC(O)=O)N(C)C Amb18316272 [0,2,0,0,0,0|0,0,0]=2 7845 B9R0.39 CCC(CP(O)=O)C(O)=O Amb24482481 [0,2,0,0,0,0|1,0,1]=4 7846 B9R0.39 CCC(OC(C)=O)C(C)=O Amb25276388 [0,2,0,0,0,0|2,0,0]=4 7847 B9R0.39 CCN(C(=O)C)CC(=O)O Amb17399887 [0,2,0,0,0,0|1,0,0]=3 7848 B9R0.39 CCN(CC(C)=O)C(C)=O Amb24096587 [0,2,0,0,0,0|2,0,0]=4 7849 B9R0.39 CCN(CC(N)=O)C(C)C Amb24455864 [0,2,0,0,0,0|2,0,0]=4 7850 B9R0.39 CCN(CC(O)=O)C(N)=O Amb18999255 [0,2,0,0,0,0|1,0,1]=4 7851 B9R0.39 CCN(CC(O)=O)S(C)=O Amb25177156 [0,2,0,0,0,0|1,0,0]=3 7852 B9R0.39 CC[C@@H](OC(C)=O)C(C)=O Amb24504997 [0,2,0,0,0,0|2,0,0]=4 7853 B9R0.39 CC[C@H](CC(O)=O)C(O)=O Amb24643194 [0,2,0,0,0,0|0,0,1]=3 7854 B9R0.39 CC[C@H](OC(C)=O)C(C)=O Amb24571835 [0,2,0,0,0,0|2,0,0]=4 7855 B9R0.39 CC\C(=C/C(O)=O)\C(C)C Amb18967765 [0,2,0,0,0,0|0,0,2]=4 7856 B9R0.39 CC\C(=C\C(O)=O)\C(C)O Amb24654751 [0,2,0,0,0,0|0,0,2]=4 7857 B9R0.39 CN(C)C(CC(N)=O)CN Amb25718298 [0,2,0,0,0,0|2,0,0]=4 7858 B9R0.39 CN(C)C(CC(O)=O)CO Amb18202308 [0,2,0,0,0,0|1,0,0]=3 7859 B9R0.39 CNC(C(=O)O)CC(=O)O Amb1905634 [0,2,0,0,0,0|1,0,1]=4 7860 B9R0.39 CN[C@@H](CC(O)=O)C(O)=O Amb22748003 [0,2,0,0,0,0|1,0,1]=4 7861 B9R0.39 COC(CC(O)=O)C(N)=O Amb23536075 [0,2,0,0,0,0|1,0,1]=4 7862 B9R0.39 COC(CC(O)=O)C(O)=O Amb18124863 [0,2,0,0,0,0|1,0,1]=4 7863 B9R0.39 CO[C@@H](CC(O)=O)C(O)=O Amb25122107 [0,2,0,0,0,0|1,0,1]=4 7864 B9R0.39 CSC(CC(O)=O)C(O)=O Amb18646024 [0,2,0,0,0,0|1,0,1]=4 7865 B9R0.39 CS[C@@H](CC(O)=O)C(O)=O Amb25191487 [0,2,0,0,0,0|1,0,1]=4 7866 B9R0.39 CS[C@H](CC(O)=O)C(O)=O Amb24423669 [0,2,0,0,0,0|1,0,1]=4 7867 B9R0.39 C[C@@H](O)[C@@H](CO)NC(C)=O Amb25232080 [0,2,0,0,0,0|2,0,0]=4 7868 B9R0.39 C[C@@H](O)[C@H](CO)NC(C)=O Amb24479138 [0,2,0,0,0,0|2,0,0]=4 7869 B9R0.39 C[C@H](O)[C@@H](CC(O)=O)NC Amb24460369 [0,2,0,0,0,0|0,0,0]=2 7870 B9R0.39 NCC(CC(O)=O)C(O)=O Amb22546423 [0,2,0,0,0,0|1,0,1]=4 7871 B9R0.39 NCC(CC(O)=O)C(O)=O Amb24538047 [0,2,0,0,0,0|1,0,1]=4 7872 B9R0.39 NC[C@H](CC(O)=O)C(O)=O Amb25147272 [0,2,0,0,0,0|1,0,1]=4 7873 B9R0.39 OC(=O)C(CBr)CC(O)=O Amb22752144 [0,2,0,0,0,0|1,0,1]=4 7874 B9R0.39 OC(=O)C(CCl)CC(O)=O Amb25840030 [0,2,0,0,0,0|1,0,1]=4 7875 B9R0.39 OC(=O)CC(CF)C(F)F Amb24513956 [0,2,0,0,0,0|1,0,0]=3 7876 B9R0.39 OCC(C(C)C)NC(=O)C Amb17102545 [0,2,0,0,0,0|2,0,0]=4 7877 B9R0.39 OCC(CC(O)=O)C(O)=O Amb24629722 [0,2,0,0,0,0|1,0,1]=4 7878 B9R0.52 CCC(CBr)CS(=O)(=O)Cl Amb24392350 [0,2,0,0,0,0|1,0,1]=4 7879 B9R0.52 CCC(CBr)CS(C)(=O)=O Amb24588108 [0,2,0,0,0,0|1,0,1]=4 7880 B9R0.52 CCC(CN)OS(O)(=O)=O Amb25322032 [0,2,0,0,0,0|2,0,0]=4 7881 B9R0.52 CCC(CP(O)(O)=O)NC Amb24399323 [0,2,0,0,0,0|1,0,0]=3 7882 B9R0.52 CCC(CS(=O)(=O)Cl)CC Amb18325496 [0,2,0,0,0,0|1,0,1]=4 7883 B9R0.52 CCC(CS(=O)(=O)F)CC Amb19373181 [0,2,0,0,0,0|1,0,1]=4 7884 B9R0.52 CCC(CS(C)(=O)=O)NC Amb19023216 [0,2,0,0,0,0|1,0,1]=4 7885 B9R0.52 CCC(CS(N)(=O)=O)CC Amb18800873 [0,2,0,0,0,0|1,0,1]=4 7886 B9R0.52 COC(CP(O)(O)=O)OC Amb25328955 [0,2,0,0,0,0|2,0,0]=4 7887 B9R0.63 CC(=O)CP(=O)(CC)CC Amb25348605 [0,2,0,0,0,0|2,0,0]=4 7888 B9R0.63 CC(=O)CP(=S)(CC)CC Amb24509329 [0,2,0,0,0,0|2,0,0]=4 7889 B9R0.63 CC(CC(O)=O)(CC)CC Amb18124690 [0,2,0,0,0,0|0,0,0]=2 7890 B9R0.63 CC(CC(O)=O)(CO)C#N Amb24116881 [0,2,0,0,0,0|1,0,0]=3 7891 B9R0.63 CC(CC)(CC)NC(N)=O Amb24568297 [0,2,0,0,0,0|2,0,0]=4 7892 B9R0.63 CC(CC)(CC)OC(N)=O Amb25763263 [0,2,0,0,0,0|2,0,0]=4 7893 B9R0.63 CC(CC)(CC)SC(N)=O Amb25708434 [0,2,0,0,0,0|2,0,0]=4 7894 B9R0.63 CC(CN)(CC(O)=O)CO Amb22546425 [0,2,0,0,0,0|1,0,0]=3 7895 B9R0.63 CC(CN)(CC(O)=O)CO Amb24116882 [0,2,0,0,0,0|1,0,0]=3 7896 B9R0.63 CCC(C)(C#N)NC(N)=O Amb24505081 [0,2,0,0,0,0|2,0,0]=4 7897 B9R0.63 CCC(C)(CBr)NC(C)=O Amb25162811 [0,2,0,0,0,0|2,0,0]=4 7898 B9R0.63 CCC(C)(CC(C)=C)C#N Amb25363703 [0,2,0,0,0,0|2,0,0]=4 7899 B9R0.63 CCC(C)(CC(C)=O)C=O Amb18643895 [0,2,0,0,0,0|1,0,0]=3 7900 B9R0.63 CCC(C)(CC(C)O)C#N Amb18643765 [0,2,0,0,0,0|1,0,1]=4 7901 B9R0.63 CCC(C)(CC(O)=O)C#N Amb18643707 [0,2,0,0,0,0|0,0,0]=2 7902 B9R0.63 CCC(C)(CO)NC(C)=O Amb25852770 [0,2,0,0,0,0|2,0,0]=4 7903 B9R0.63 CCP(=O)(CC(N)=O)CC Amb25201540 [0,2,0,0,0,0|2,0,0]=4 7904 B9R0.63 CCP(=O)(CC(O)=O)OC Amb25325013 [0,2,0,0,0,0|1,0,0]=3 7905 B9R0.63 CC[P@](=O)(CC(O)=O)OC Amb24442037 [0,2,0,0,0,0|1,0,0]=3 7906 B9R0.63 COC(C)(CC(C)=O)C#C Amb24467715 [0,2,0,0,0,0|2,0,0]=4 7907 B9R0.63 COP(=O)(CC(O)=O)OC Amb22388809 [0,2,0,0,0,0|2,0,0]=4 7908 B9R0.63 COP(=O)(CC(O)=O)SC Amb24448281 [0,2,0,0,0,0|2,0,0]=4 7909 B9R0.63 C[N+](CC(O)=O)(CC)CC Amb25138707 [0,2,0,0,0,0|1,0,0]=3 7910 B9R0.63 C[Si](CC(O)=O)(CC)CC Amb24710101 [0,2,0,0,0,0|0,1,0]=3 7911 B9R0.63 ClCC(CC(=O)C)(CCl)C Amb17594712 [0,2,0,0,0,0|2,0,0]=4 7912 B9R0.63 N#CC(O)(CCl)CC(O)=O Amb24400526 [0,2,0,0,0,0|1,0,1]=4 7913 B9R0.22 CC(C)(CC(=O)NC)NC Amb24664702 [0,2,0,0,0,0|2,0,0]=4 7914 B9R0.22 CC(C)(CC(=O)NO)C#N Amb25741839 [0,2,0,0,0,0|1,0,1]=4 7915 B9R0.22 CC(C)(CC(=O)OC)OC Amb25707746 [0,2,0,0,0,0|1,0,0]=3 7916 B9R0.22 CC(C)(CC(N)=NO)CN Amb25061546 [0,2,0,0,0,0|2,0,0]=4 7917 B9R0.22 CC(C)(CC(N)=NO)CO Amb25120141 [0,2,0,0,0,0|2,0,0]=4 7918 B9R0.22 CC(C)(CC)NC(=O)NCl Amb24757577 [0,2,0,0,0,0|2,0,0]=4 7919 B9R0.22 CC(C)(CF)NC(=O)CO Amb25801777 [0,2,0,0,0,0|2,0,0]=4 7920 B9R0.22 CC(C)(CO)NC(=O)CO Amb24477363 [0,2,0,0,0,0|2,0,0]=4 7921 B9R0.22 CC(C)(NC(=O)OC)OC Amb25229562 [0,2,0,0,0,0|2,0,0]=4 7922 B9R0.22 CC(CS(=O)(=O)CC)CC Amb25856257 [0,2,0,0,0,0|1,0,1]=4 7923 B9R0.22 CC(O)(CC(=O)NO)C=C Amb24439206 [0,2,0,0,0,0|0,0,2]=4 7924 B9R0.22 CC(S)(CC(=O)CC)CC Amb25792933 [0,2,0,0,0,0|1,0,0]=3 7925 B9R0.22 CCC(=O)CC(C)(Cl)CCl Amb24726755 [0,2,0,0,0,0|2,0,0]=4 7926 B9R0.22 CCC(C)(C)CC(=O)CO Amb24621280 [0,2,0,0,0,0|0,0,0]=2 7927 B9R0.22 CCC(C)(C)CC(=O)NC Amb24618648 [0,2,0,0,0,0|1,0,0]=3 7928 B9R0.22 CCC(C)(C)CC(=O)NN Amb24371662 [0,2,0,0,0,0|1,0,0]=3 7929 B9R0.22 CCC(C)(C)NC(=O)C#C Amb24594079 [0,2,0,0,0,0|2,0,0]=4 7930 B9R0.22 CCC(C)(C)NC(=O)CI Amb25334185 [0,2,0,0,0,0|2,0,0]=4 7931 B9R0.22 CCC(C)(C)NC(=O)CS Amb24482094 [0,2,0,0,0,0|1,1,0]=4 7932 B9R0.22 CCC(C)(C)OC(=O)CCl Amb25074102 [0,2,0,0,0,0|2,0,0]=4 7933 B9R0.22 CCC(C)(C)OC(=O)NN Amb24501404 [0,2,0,0,0,0|2,0,0]=4 7934 B9R0.22 CCC(C)(C)SC(=O)NC Amb25835064 [0,2,0,0,0,0|2,0,0]=4 7935 B9R0.22 CCC(C)(N)CC(=O)OC Amb20623801 [0,2,0,0,0,0|0,0,0]=2 7936 B9R0.22 CCC(C)(N)CC(C)OC Amb25719804 [0,2,0,0,0,0|1,0,1]=4 7937 B9R0.22 CCC(C)(O)CC(C)C=O Amb24648622 [0,2,0,0,0,0|1,0,1]=4 7938 B9R0.22 CCC(C)(O)CC(O)CO Amb25065485 [0,2,0,0,0,0|0,0,2]=4 7939 B9R0.22 CCC(C)CC(C)(C)C=O Amb25101819 [0,2,0,0,0,0|1,0,1]=4 7940 B9R0.22 CCC(C)CC(C)(C)CO Amb25778339 [0,2,0,0,0,0|1,0,1]=4 7941 B9R0.22 CCC(C)CS(=O)(=O)CCl Amb24632343 [0,2,0,0,0,0|1,0,1]=4 7942 B9R0.22 CCC(C)CS(=O)(=O)NC Amb24482969 [0,2,0,0,0,0|1,0,1]=4 7943 B9R0.22 CCC(CC(CC)(O)C)C Amb10807397 [0,2,0,0,0,0|1,0,1]=4 7944 B9R0.22 CNC(=O)CC(C)(C)OC Amb24594204 [0,2,0,0,0,0|2,0,0]=4 7945 B9R0.22 CNC(C)(C)CC(=O)OC Amb22059498 [0,2,0,0,0,0|1,0,0]=3 7946 B9R0.22 CNC(C)(C)CC(C)=NO Amb25359279 [0,2,0,0,0,0|2,0,0]=4 7947 B9R0.22 CNC(C)(C)C\C(\C)=N\O Amb24478917 [0,2,0,0,0,0|2,0,0]=4 7948 B9R0.22 COC(=O)CC(C)(C)C#N Amb25068084 [0,2,0,0,0,0|1,0,1]=4 7949 B9R0.22 COC(=O)CC(C)(C)C=O Amb18644110 [0,2,0,0,0,0|1,0,1]=4 7950 B9R0.22 COC(=O)CC(C)(Cl)C#N Amb25248555 [0,2,0,0,0,0|1,0,1]=4 7951 B9R0.22 COC(=O)CC(C)(N)CO Amb24701097 [0,2,0,0,0,0|1,0,0]=3 7952 B9R0.22 COC(=O)CC(C)(O)C#N Amb24597794 [0,2,0,0,0,0|1,0,1]=4 7953 B9R0.22 COC(=O)CC(C)(O)CCl Amb25340529 [0,2,0,0,0,0|1,0,0]=3 7954 B9R0.22 COC(=O)CC(C)(O)CN Amb25323362 [0,2,0,0,0,0|1,0,0]=3 7955 B9R0.22 COC(=O)CC(CC)(C)C Amb10572826 [0,2,0,0,0,0|0,0,0]=2 7956 B9R0.22 COC(=O)C[C@@](C)(N)CO Amb24504957 [0,2,0,0,0,0|1,0,0]=3 7957 B9R0.22 COC(=O)C[C@@](C)(O)CO Amb25344934 [0,2,0,0,0,0|1,0,0]=3 7958 B9R0.22 COC(=O)C[C@](C)(N)CO Amb24396006 [0,2,0,0,0,0|1,0,0]=3 7959 B9R0.22 COC(=O)NC(C)(C)CF Amb24388007 [0,2,0,0,0,0|2,0,0]=4 7960 B9R0.22 COC(=O)NC(C)(C)CN Amb18251296 [0,2,0,0,0,0|2,0,0]=4 7961 B9R0.22 COC(C)(C)CC(=O)CCl Amb24481071 [0,2,0,0,0,0|2,0,0]=4 7962 B9R0.22 COC(C)(C)CC(=O)NN Amb25276112 [0,2,0,0,0,0|2,0,0]=4 7963 B9R0.22 COC(C)(C)CC(=O)NO Amb24481043 [0,2,0,0,0,0|1,0,0]=3 7964 B9R0.22 COC(C)(C)CC(Cl)=NO Amb25804292 [0,2,0,0,0,0|2,0,0]=4 7965 B9R0.22 COC(C)(C)CC(N)=NO Amb24560992 [0,2,0,0,0,0|2,0,0]=4 7966 B9R0.22 ClCC(=O)NC(CC)(C)C Amb1158211 [0,2,0,0,0,0|2,0,0]=4 7967 B9R0.10 CC(=O)CC(N)C(C)(C)C Amb24465193 [0,2,0,0,0,0|2,0,0]=4 7968 B9R0.10 CC(=O)CN(C)C(C)(C)C Amb24619991 [0,2,0,0,0,0|2,0,0]=4 7969 B9R0.10 CC(C)(C)C(Br)CC(O)=O Amb25075478 [0,2,0,0,0,0|1,0,0]=3 7970 B9R0.10 CC(C)(C)C(F)CC(O)=O Amb25282886 [0,2,0,0,0,0|1,0,0]=3 7971 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,2,0,0,0,0|2,0,0]=4 7972 B9R0.10 CC(C)(C)N(O)CC(O)=O Amb25744258 [0,2,0,0,0,0|2,0,0]=4 7973 B9R0.10 CC(C)(C)S(=O)CC(O)=O Amb18974534 [0,2,0,0,0,0|2,0,0]=4 7974 B9R0.10 CC(C)(C)[C@@H](N)CC(O)=O Amb19888358 [0,2,0,0,0,0|1,0,0]=3 7975 B9R0.10 CC(C)(C)[C@@H](O)CC(O)=O Amb24505172 [0,2,0,0,0,0|1,0,0]=3 7976 B9R0.10 CC(C)(C)[C@H](N)CC(N)=O Amb24541681 [0,2,0,0,0,0|2,0,0]=4 7977 B9R0.10 CC(C)(C)[C@H](N)CC(O)=O Amb19887644 [0,2,0,0,0,0|1,0,0]=3 7978 B9R0.10 CC(C)(C)[C@H]([NH3+])CC([O-])=O Amb22224981 [0,2,0,0,0,0|1,0,1]=4 7979 B9R0.10 CC(C)(O)C(O)CC(O)=O Amb25808868 [0,2,0,0,0,0|1,0,0]=3 7980 B9R0.10 CC(CC(=O)Cl)C(F)(F)F Amb24471535 [0,2,0,0,0,0|2,0,0]=4 7981 B9R0.10 CC(CC(C)=O)S(C)(=O)=O Amb24576104 [0,2,0,0,0,0|2,0,0]=4 7982 B9R0.10 CC(CC(C)=O)[Si](C)(C)C Amb24577740 [0,2,0,0,0,0|1,1,0]=4 7983 B9R0.10 CC(CC(C)O)C(C)(C)C Amb24529284 [0,2,0,0,0,0|1,0,1]=4 7984 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb19651352 [0,2,0,0,0,0|0,0,0]=2 7985 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb21961488 [0,2,0,0,0,0|0,0,0]=2 7986 B9R0.10 CC(CC(O)=O)C(C)(F)F Amb25241872 [0,2,0,0,0,0|0,0,0]=2 7987 B9R0.10 CC(CC(O)=O)P(C)(O)=O Amb25059136 [0,2,0,0,0,0|1,0,0]=3 7988 B9R0.10 CC(CC(O)=O)S(C)(=O)=O Amb18971621 [0,2,0,0,0,0|1,0,0]=3 7989 B9R0.10 CC(NC(C)=O)C(C)(C)C Amb25082334 [0,2,0,0,0,0|2,0,0]=4 7990 B9R0.10 CC(NC(C)=O)C(C)(F)F Amb24620709 [0,2,0,0,0,0|2,0,0]=4 7991 B9R0.10 CC(NC(N)=O)C(C)(C)O Amb25120603 [0,2,0,0,0,0|2,0,0]=4 7992 B9R0.10 CN(C(C)(C)C)CC(=O)O Amb17334246 [0,2,0,0,0,0|1,0,0]=3 7993 B9R0.10 CN(CC(N)=O)C(C)(C)C Amb24482395 [0,2,0,0,0,0|2,0,0]=4 7994 B9R0.10 C[C@@H](CC(O)=O)C(F)(F)F Amb25238266 [0,2,0,0,0,0|1,0,0]=3 7995 B9R0.10 C[C@H](CC(O)=O)C(C)(C)C Amb24409482 [0,2,0,0,0,0|0,0,0]=2 7996 B9R0.10 C[C@H](CC(O)=O)C(Cl)(Cl)Cl Amb25075604 [0,2,0,0,0,0|1,0,0]=3 7997 B9R0.10 C[C@H](CC(O)=O)C(F)(F)F Amb24482309 [0,2,0,0,0,0|1,0,0]=3 7998 B9R0.10 C[C@H](CC(O)=O)S(O)(=O)=O Amb25210783 [0,2,0,0,0,0|2,0,0]=4 7999 B9R0.10 C[C@H](NC(C)=O)C(C)(C)C Amb24760244 [0,2,0,0,0,0|2,0,0]=4 8000 B9R0.10 C\C(=C/C(O)=O)\C(C)(C)C Amb24639757 [0,2,0,0,0,0|0,0,2]=4 8001 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1091770 [0,2,0,0,0,0|2,0,0]=4 8002 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1146904 [0,2,0,0,0,0|2,0,0]=4 8003 B9R0.10 N[C@@H](CC(O)=O)C(F)(F)F Amb22388421 [0,2,0,0,0,0|2,0,0]=4 8004 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb20670844 [0,2,0,0,0,0|2,0,0]=4 8005 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb22738680 [0,2,0,0,0,0|2,0,0]=4 8006 B9R0.10 OC(=O)CC(F)C(F)(F)F Amb24472441 [0,2,0,0,0,0|2,0,0]=4 8007 B9R0.10 OC(=O)CC(S)C(F)(F)F Amb18790270 [0,2,0,0,0,0|2,0,0]=4 8008 B9R0.10 OC(=O)CN(S(=O)(=O)C)C Amb1111612 [0,2,0,0,0,0|2,0,0]=4 8009 B9R0.10 OC(C(C)(C)C)CC(=O)O Amb17232006 [0,2,0,0,0,0|1,0,0]=3 8010 B9R0.10 O[C@@H](C(F)(F)F)CC(=O)O Amb10838309 [0,2,0,0,0,0|2,0,0]=4 8011 B9R0.10 O[C@@H](CC(O)=O)C(Cl)(Cl)Cl Amb24412058 [0,2,0,0,0,0|2,0,0]=4 8012 B9R0.10 O[C@H](C(F)(F)F)CC(=O)O Amb10838307 [0,2,0,0,0,0|2,0,0]=4 8013 B9R0.11 CC(=C)C(C)(C)CC(N)=O Amb24470518 [0,2,0,0,0,0|1,0,1]=4 8014 B9R0.11 CC(=C)C(C)(C)CC(O)=O Amb25703730 [0,2,0,0,0,0|0,0,1]=3 8015 B9R0.11 CC(=C)C(C)(N)CC(O)=O Amb22641962 [0,2,0,0,0,0|0,0,1]=3 8016 B9R0.11 CC(=O)C(C)(Br)CC(O)=O Amb24682759 [0,2,0,0,0,0|0,0,1]=3 8017 B9R0.11 CC(=O)C(C)(C)CC(=O)Cl Amb24690787 [0,2,0,0,0,0|1,0,1]=4 8018 B9R0.11 CC(=O)C(C)(C)CC(C)=O Amb25771077 [0,2,0,0,0,0|1,0,1]=4 8019 B9R0.11 CC(=O)C(C)(O)CC(O)=O Amb25733298 [0,2,0,0,0,0|0,0,1]=3 8020 B9R0.11 CC(=O)CC(C)(C)N(C)C Amb24480612 [0,2,0,0,0,0|2,0,0]=4 8021 B9R0.11 CC(=O)CC(C)(O)N(C)N Amb24378443 [0,2,0,0,0,0|2,0,0]=4 8022 B9R0.11 CC(=O)[C@](C)(O)CC(C)=O Amb25738871 [0,2,0,0,0,0|1,0,1]=4 8023 B9R0.11 CC(=S)C(C)(C)CC(O)=O Amb25227469 [0,2,0,0,0,0|0,0,1]=3 8024 B9R0.11 CC(Br)C(C)(C)NC(C)=O Amb24434118 [0,2,0,0,0,0|2,0,0]=4 8025 B9R0.11 CC(Br)C(C)(C)OC(C)=O Amb25185148 [0,2,0,0,0,0|2,0,0]=4 8026 B9R0.11 CC(C)(CC(O)=O)N(Cl)Cl Amb24384343 [0,2,0,0,0,0|2,0,0]=4 8027 B9R0.11 CC(C)C(C)(C)CC(C)=O Amb24387871 [0,2,0,0,0,0|1,0,0]=3 8028 B9R0.11 CC(C)C(C)(C)CC(O)=O Amb18124695 [0,2,0,0,0,0|0,0,0]=2 8029 B9R0.11 CC(C)C(C)(C)NC(C)=O Amb22723319 [0,2,0,0,0,0|2,0,0]=4 8030 B9R0.11 CC(C)C(C)(F)CC(O)=O Amb24665956 [0,2,0,0,0,0|0,0,0]=2 8031 B9R0.11 CC(C)C(C)(O)CC(N)=S Amb25129958 [0,2,0,0,0,0|1,1,0]=4 8032 B9R0.11 CC(C)C(C)(O)CC(O)=O Amb18991699 [0,2,0,0,0,0|0,0,0]=2 8033 B9R0.11 CC(C)[C@@](C)(N)CC(O)=O Amb19929555 [0,2,0,0,0,0|0,0,0]=2 8034 B9R0.11 CC(C)[C@](C)(N)CC(O)=O Amb19929556 [0,2,0,0,0,0|0,0,0]=2 8035 B9R0.11 CC(C)[N+](C)(C)CC(O)=O Amb24740673 [0,2,0,0,0,0|1,0,0]=3 8036 B9R0.11 CC(Cl)(CC(O)=O)C(O)=O Amb18126463 [0,2,0,0,0,0|1,0,1]=4 8037 B9R0.11 CC(Cl)C(C)(C)NC(C)=O Amb24509734 [0,2,0,0,0,0|2,0,0]=4 8038 B9R0.11 CC(N)(CC(O)=O)C(O)=O Amb22800383 [0,2,0,0,0,0|1,0,1]=4 8039 B9R0.11 CC(N)(CC(O)=O)P(O)=O Amb25701546 [0,2,0,0,0,0|2,0,0]=4 8040 B9R0.11 CC(N)C(C)(C)NC(C)=O Amb25187273 [0,2,0,0,0,0|2,0,0]=4 8041 B9R0.11 CC(N)C(C)(C)NC(N)=O Amb25361937 [0,2,0,0,0,0|2,0,0]=4 8042 B9R0.11 CC(O)(CC(O)=O)C(N)=O Amb24669300 [0,2,0,0,0,0|1,0,1]=4 8043 B9R0.11 CC(O)(CC(O)=O)C(O)=O Amb22352645 [0,2,0,0,0,0|1,0,1]=4 8044 B9R0.11 CC(O)C(C)(C)NC(C)=O Amb24425580 [0,2,0,0,0,0|2,0,0]=4 8045 B9R0.11 CC(O)C(C)(C)NC(N)=O Amb25274592 [0,2,0,0,0,0|2,0,0]=4 8046 B9R0.11 CC(O)CC(C)(C)C(C)N Amb23555789 [0,2,0,0,0,0|1,0,1]=4 8047 B9R0.11 CC(S)(CC(O)=O)C(O)=O Amb25053889 [0,2,0,0,0,0|1,0,1]=4 8048 B9R0.11 C[C@@](O)(CC(O)=O)C(O)=O Amb22336254 [0,2,0,0,0,0|1,0,1]=4 8049 B9R0.11 OC(=O)CC(C(=O)O)(N)C Amb10807406 [0,2,0,0,0,0|1,0,1]=4 8050 B9R0.11 OC(=O)CC(C(=S)N)(C)C Amb17466449 [0,2,0,0,0,0|1,0,1]=4 8051 B9R0.11 OC(=O)C[C@@](C(=O)O)(N)C Amb10601663 [0,2,0,0,0,0|1,0,1]=4 8052 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb10601664 [0,2,0,0,0,0|1,0,1]=4 8053 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb17608152 [0,2,0,0,0,0|1,0,1]=4 8054 B9R0.57 CC(C)C(C)CS(=O)(=O)Cl Amb25300919 [0,2,0,0,0,0|1,0,1]=4 8055 B9R0.57 CC(C)C(C)OP(C)(O)=O Amb25104688 [0,2,0,0,0,0|2,0,0]=4 8056 B9R0.57 CC(C)C(N)CP(C)(O)=O Amb24663118 [0,2,0,0,0,0|2,0,0]=4 8057 B9R0.57 CC(C)[C@@H](N)CP(O)(O)=O Amb24626120 [0,2,0,0,0,0|2,0,0]=4 8058 B9R0.57 CC(C)[C@@H](N)CS(O)(=O)=O Amb24509501 [0,2,0,0,0,0|2,0,0]=4 8059 B9R0.57 CC(C)[C@H](N)CS(O)(=O)=O Amb24529309 [0,2,0,0,0,0|2,0,0]=4 8060 B9R0.57 CC(O)C(C)CC(C)(C)O Amb25266535 [0,2,0,0,0,0|1,0,1]=4 8061 B9R0.57 CC(O)C(C)OP(O)(O)=O Amb25332491 [0,2,0,0,0,0|2,0,0]=4 8062 B9R0.57 CC(OP(O)(O)=O)C(C)N Amb25276578 [0,2,0,0,0,0|2,0,0]=4 8063 B9R0.57 C[C@@H](N)C(O)CP(O)(O)=O Amb25117717 [0,2,0,0,0,0|2,0,0]=4 8064 B9R0.30 CCC(C)(C)CS(N)(=O)=O Amb25760985 [0,2,0,0,0,0|1,0,1]=4 8065 B9R0.30 CCC(C)(N)CS(O)(=O)=O Amb24432826 [0,2,0,0,0,0|1,0,0]=3 8066 B7R1.1 BrCC1CC=CC1 Amb25216921 [1,0,0,1,0,0|2,0,0]=4 8067 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|1,0,1]=4 8068 B7R1.1 CCC1CNC=N1 Amb24481042 [1,0,0,1,0,0|2,0,0]=4 8069 B7R1.1 CCC1CNCC1 Amb18946548 [1,0,0,1,0,0|1,0,1]=4 8070 B7R1.1 CCC1CNCC1 Amb20630619 [1,0,0,1,0,0|1,0,1]=4 8071 B7R1.1 CCC1CNOC1 Amb25747042 [1,0,0,1,0,0|1,0,0]=3 8072 B7R1.1 CCC1COCN1 Amb24090823 [1,0,0,1,0,0|1,0,1]=4 8073 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|1,0,1]=4 8074 B7R1.1 CC[C@H]1CNCC1 Amb24479851 [1,0,0,1,0,0|1,0,1]=4 8075 B7R1.1 CNC1CC=CC1 Amb25800350 [1,0,0,1,0,0|2,0,0]=4 8076 B7R1.1 CNC1COCC1 Amb20241377 [1,0,0,1,0,0|1,0,1]=4 8077 B7R1.1 CN[C@@H]1COCC1 Amb20240861 [1,0,0,1,0,0|1,0,1]=4 8078 B7R1.1 CN[C@@H]1COCC1 Amb20241500 [1,0,0,1,0,0|1,0,1]=4 8079 B7R1.1 CN[C@H]1COCC1 Amb20241026 [1,0,0,1,0,0|1,0,1]=4 8080 B7R1.1 ClCC1CC=CC1 Amb25059951 [1,0,0,1,0,0|2,0,0]=4 8081 B7R1.1 ICC1CC=CC1 Amb24078965 [1,0,0,1,0,0|2,0,0]=4 8082 B7R1.1 ICC1COCC1 Amb23439064 [1,0,0,1,0,0|1,0,1]=4 8083 B7R1.1 NCC1CC=CC1 Amb22301490 [1,0,0,1,0,0|2,0,0]=4 8084 B7R1.1 NCC1COCC1 Amb1117962 [1,0,0,1,0,0|1,0,1]=4 8085 B7R1.1 NC[C@@H]1COCC1 Amb23439065 [1,0,0,1,0,0|1,0,1]=4 8086 B7R1.1 NC[C@@H]1COCC1 Amb23439174 [1,0,0,1,0,0|1,0,1]=4 8087 B7R1.1 OCC1COC=C1 Amb24480931 [1,0,0,1,0,0|1,0,1]=4 8088 B7R1.1 OC[C@@H]1COCC1 Amb22746669 [1,0,0,1,0,0|1,0,1]=4 8089 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [1,0,0,1,0,0|2,0,0]=4 8090 B7R1.2 C=C1CC(N)CC1 Amb24352464 [1,0,0,1,0,0|2,0,0]=4 8091 B7R1.2 C=C1CC(O)CC1 Amb25246529 [1,0,0,1,0,0|2,0,0]=4 8092 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,0]=3 8093 B7R1.2 CC1CC(=O)NC1 Amb10608004 [1,0,0,1,0,0|1,0,0]=3 8094 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [1,0,0,1,0,0|1,0,1]=4 8095 B7R1.2 CC1CC(N)CC1 Amb20669202 [1,0,0,1,0,0|1,0,1]=4 8096 B7R1.2 CC1CC(N)CC1 Amb24062164 [1,0,0,1,0,0|1,0,1]=4 8097 B7R1.2 CC1CC(O)CN1 Amb20668139 [1,0,0,1,0,0|1,0,1]=4 8098 B7R1.2 CC1CC(O)CS1 Amb24660406 [1,0,0,1,0,0|1,0,1]=4 8099 B7R1.2 CC1CC(S)CC1 Amb25829470 [1,0,0,1,0,0|0,1,1]=4 8100 B7R1.2 CC1CC=C(C)C1 Amb17674172 [1,0,0,1,0,0|1,0,1]=4 8101 B7R1.2 CC1CCC(=N)N1 Amb24479850 [1,0,0,1,0,0|2,0,0]=4 8102 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|1,0,0]=3 8103 B7R1.2 CC1CCC(=S)O1 Amb25361484 [1,0,0,1,0,0|1,1,0]=4 8104 B7R1.2 CC1CCC(C)=C1 Amb24479860 [1,0,0,1,0,0|1,0,1]=4 8105 B7R1.2 CC1CCC(C)=N1 Amb24598049 [1,0,0,1,0,0|2,0,0]=4 8106 B7R1.2 CC1CCC(O)O1 Amb22295909 [1,0,0,1,0,0|1,0,1]=4 8107 B7R1.2 CC1CN(N)CC1 Amb24385963 [1,0,0,1,0,0|2,0,0]=4 8108 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 8109 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|2,0,0]=4 8110 B7R1.2 CC1CNC(=O)S1 Amb25367335 [1,0,0,1,0,0|2,0,0]=4 8111 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 8112 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 8113 B7R1.2 CC1CS(=O)CC1 Amb24333540 [1,0,0,1,0,0|1,0,0]=3 8114 B7R1.2 CC1CSC(=O)C1 Amb25136024 [1,0,0,1,0,0|1,0,0]=3 8115 B7R1.2 CC1CSC(=O)S1 Amb22055765 [1,0,0,1,0,0|2,0,0]=4 8116 B7R1.2 CC1NNC(=O)C1 Amb2371659 [1,0,0,1,0,0|2,0,0]=4 8117 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|2,0,0]=4 8118 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [1,0,0,1,0,0|0,0,2]=4 8119 B7R1.2 CN1CC(=O)CC1 Amb22236123 [1,0,0,1,0,0|1,0,0]=3 8120 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,0,0,1,0,0|2,0,0]=4 8121 B7R1.2 CN1CCC(O)=C1 Amb24079726 [1,0,0,1,0,0|1,0,1]=4 8122 B7R1.2 CN1CC[C@@H](C1)O Amb10070789 [1,0,0,1,0,0|1,0,1]=4 8123 B7R1.2 CN1CNC(=O)C1 Amb24733801 [1,0,0,1,0,0|2,0,0]=4 8124 B7R1.2 CN1C[C@@H](O)CC1 Amb22748868 [1,0,0,1,0,0|1,0,1]=4 8125 B7R1.2 CP1CC(O)CC1 Amb24661188 [1,0,0,1,0,0|1,0,1]=4 8126 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [1,0,0,1,0,0|0,0,0]=2 8127 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [1,0,0,1,0,0|1,0,1]=4 8128 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,0]=2 8129 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|1,0,0]=3 8130 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [1,0,0,1,0,0|1,0,1]=4 8131 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [1,0,0,1,0,0|1,0,1]=4 8132 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [1,0,0,1,0,0|1,0,1]=4 8133 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,0]=3 8134 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|2,0,0]=4 8135 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 8136 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 8137 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [1,0,0,1,0,0|1,0,1]=4 8138 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [1,0,0,1,0,0|1,0,1]=4 8139 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [1,0,0,1,0,0|1,0,1]=4 8140 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [1,0,0,1,0,0|1,0,1]=4 8141 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [1,0,0,1,0,0|1,0,1]=4 8142 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [1,0,0,1,0,0|1,0,1]=4 8143 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [1,0,0,1,0,0|1,0,1]=4 8144 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [1,0,0,1,0,0|0,0,1]=3 8145 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [1,0,0,1,0,0|1,0,1]=4 8146 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [1,0,0,1,0,0|1,0,0]=3 8147 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [1,0,0,1,0,0|1,0,1]=4 8148 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [1,0,0,1,0,0|2,0,0]=4 8149 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 8150 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [1,0,0,1,0,0|1,0,1]=4 8151 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [1,0,0,1,0,0|1,0,1]=4 8152 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [1,0,0,1,0,0|1,0,1]=4 8153 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [1,0,0,1,0,0|0,0,1]=3 8154 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [1,0,0,1,0,0|1,0,1]=4 8155 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [1,0,0,1,0,0|1,0,1]=4 8156 B7R1.2 NC1CC(=O)CC1 Amb22236085 [1,0,0,1,0,0|1,0,0]=3 8157 B7R1.2 NC1CC(=O)CC1 Amb22494268 [1,0,0,1,0,0|1,0,0]=3 8158 B7R1.2 NC1CC(=O)CS1 Amb25090377 [1,0,0,1,0,0|2,0,0]=4 8159 B7R1.2 NC1CC(O)CC1 Amb18561405 [1,0,0,1,0,0|1,0,1]=4 8160 B7R1.2 NC1CC(O)CC1 Amb19958405 [1,0,0,1,0,0|1,0,1]=4 8161 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,0,0,1,0,0|2,0,0]=4 8162 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,0,0,1,0,0|2,0,0]=4 8163 B7R1.2 NC1CCC(=O)S1 Amb24479819 [1,0,0,1,0,0|2,0,0]=4 8164 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 8165 B7R1.2 NC1CS(=O)CC1 Amb19149072 [1,0,0,1,0,0|2,0,0]=4 8166 B7R1.2 NC1CS(=O)CC1 Amb25133789 [1,0,0,1,0,0|2,0,0]=4 8167 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [1,0,0,1,0,0|1,0,1]=4 8168 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [1,0,0,1,0,0|1,0,1]=4 8169 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [1,0,0,1,0,0|1,0,1]=4 8170 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 8171 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 8172 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [1,0,0,1,0,0|1,0,1]=4 8173 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [1,0,0,1,0,0|1,0,1]=4 8174 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [1,0,0,1,0,0|1,0,1]=4 8175 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [1,0,0,1,0,0|2,0,0]=4 8176 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [1,0,0,1,0,0|1,0,1]=4 8177 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [1,0,0,1,0,0|1,0,1]=4 8178 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 8179 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|2,0,0]=4 8180 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|2,0,0]=4 8181 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [1,0,0,1,0,0|1,0,1]=4 8182 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [1,0,0,1,0,0|1,0,0]=3 8183 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [1,0,0,1,0,0|2,0,0]=4 8184 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [1,0,0,1,0,0|2,0,0]=4 8185 B7R1.2 O=C1CC(F)CC1 Amb21963553 [1,0,0,1,0,0|1,0,0]=3 8186 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|2,0,0]=4 8187 B7R1.2 O=C1CC(I)CC1 Amb22001809 [1,0,0,1,0,0|1,0,0]=3 8188 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|2,0,0]=4 8189 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,0,0,1,0,0|2,0,0]=4 8190 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [1,0,0,1,0,0|2,0,0]=4 8191 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [1,0,0,1,0,0|2,0,0]=4 8192 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|2,0,0]=4 8193 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|2,0,0]=4 8194 B7R1.2 OC1CC(=O)CC1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 8195 B7R1.2 OC1CC(Br)CC1 Amb25275238 [1,0,0,1,0,0|1,0,1]=4 8196 B7R1.2 OC1CC(S)CC1 Amb25051687 [1,0,0,1,0,0|1,0,1]=4 8197 B7R1.2 OC1CCC(=O)N1 Amb21963236 [1,0,0,1,0,0|2,0,0]=4 8198 B7R1.2 OC1CCC(=O)O1 Amb22740957 [1,0,0,1,0,0|2,0,0]=4 8199 B7R1.2 OC1CNC(=O)C1 Amb19958404 [1,0,0,1,0,0|2,0,0]=4 8200 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [1,0,0,1,0,0|2,0,0]=4 8201 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [1,0,0,1,0,0|2,0,0]=4 8202 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [1,0,0,1,0,0|1,0,1]=4 8203 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 8204 B7R1.3 BrC1CC=CCC1 Amb22229671 [1,0,0,1,0,0|2,0,0]=4 8205 B7R1.3 CC1CC=CCC1 Amb22729698 [1,0,0,1,0,0|1,0,0]=3 8206 B7R1.3 CC1CC=CCO1 Amb25719582 [1,0,0,1,0,0|2,0,0]=4 8207 B7R1.3 CC1CCNC=C1 Amb25182980 [1,0,0,1,0,0|1,0,1]=4 8208 B7R1.3 CC1CCNCC1 Amb22549250 [1,0,0,1,0,0|1,0,1]=4 8209 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|0,0,1]=3 8210 B7R1.3 CC1CCOCO1 Amb17776591 [1,0,0,1,0,0|1,0,1]=4 8211 B7R1.3 CC1CNCCC1 Amb22491688 [1,0,0,1,0,0|2,0,0]=4 8212 B7R1.3 CC1COCCC1 Amb22347806 [1,0,0,1,0,0|2,0,0]=4 8213 B7R1.3 CN1CC=CCC1 Amb22734271 [1,0,0,1,0,0|2,0,0]=4 8214 B7R1.3 CN1CCOCC1 Amb2031952 [1,0,0,1,0,0|1,0,1]=4 8215 B7R1.3 CN1CCOCC1 Amb22730073 [1,0,0,1,0,0|1,0,1]=4 8216 B7R1.3 C[C@@H]1CNCCC1 Amb22745835 [1,0,0,1,0,0|2,0,0]=4 8217 B7R1.3 C[C@H]1CNCCC1 Amb24461444 [1,0,0,1,0,0|2,0,0]=4 8218 B7R1.3 ClC1CC=CCC1 Amb22229749 [1,0,0,1,0,0|2,0,0]=4 8219 B7R1.3 FC1CCOCC1 Amb22296909 [1,0,0,1,0,0|1,0,1]=4 8220 B7R1.3 NC1CC=CCC1 Amb18639038 [1,0,0,1,0,0|2,0,0]=4 8221 B7R1.3 NC1CC=CCC1 Amb19515491 [1,0,0,1,0,0|2,0,0]=4 8222 B7R1.3 NC1CCOCC1 Amb10069117 [1,0,0,1,0,0|1,0,1]=4 8223 B7R1.3 NC1CCOCC1 Amb1102242 [1,0,0,1,0,0|1,0,1]=4 8224 B7R1.3 OC1CC=CCC1 Amb24089165 [1,0,0,1,0,0|2,0,0]=4 8225 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [1,0,0,1,0,0|1,0,1]=4 8226 B7R1.4 CC1CC=NN1C Amb25026644 [1,0,0,1,0,0|2,0,0]=4 8227 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,1]=4 8228 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,1]=4 8229 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|2,0,0]=4 8230 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|2,0,0]=4 8231 B7R1.4 CC1N=CNC1C Amb24412610 [1,0,0,1,0,0|2,0,0]=4 8232 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,1,0,0|1,0,1]=4 8233 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,1,0,0|1,0,1]=4 8234 B7R1.4 CC1OCCC1I Amb25840995 [1,0,0,1,0,0|1,0,1]=4 8235 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|1,0,1]=4 8236 B7R1.4 C[C@@H]1CCC[C@@H]1C Amb22230410 [1,0,0,1,0,0|1,0,1]=4 8237 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|1,0,1]=4 8238 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,1]=4 8239 B7R1.4 C[C@@H]1CCN[C@H]1C Amb24515067 [1,0,0,1,0,0|1,0,1]=4 8240 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|2,0,0]=4 8241 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|2,0,0]=4 8242 B7R1.4 C[C@@H]1CNC[C@H]1C Amb24597585 [1,0,0,1,0,0|2,0,0]=4 8243 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|1,0,1]=4 8244 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|1,0,1]=4 8245 B7R1.4 C[C@@H]1OCC[C@H]1O Amb24624737 [1,0,0,1,0,0|1,0,1]=4 8246 B7R1.4 C[C@H]1C=CC[C@@H]1O Amb24630805 [1,0,0,1,0,0|2,0,0]=4 8247 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|1,0,1]=4 8248 B7R1.4 C[C@H]1CNC[C@@H]1C Amb24567666 [1,0,0,1,0,0|2,0,0]=4 8249 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [1,0,0,1,0,0|1,0,1]=4 8250 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|1,0,1]=4 8251 B7R1.5 C=C1C[C@@H]1CC=O Amb24574015 [1,0,0,1,0,0|0,0,2]=4 8252 B7R1.5 C=C1C[C@H]1CC=O Amb25326113 [1,0,0,1,0,0|0,0,2]=4 8253 B7R1.5 C=CCC1CC1Cl Amb24634288 [1,0,0,1,0,0|2,0,0]=4 8254 B7R1.5 C=CC[C@@H]1C[C@H]1O Amb25215350 [1,0,0,1,0,0|2,0,0]=4 8255 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,0]=2 8256 B7R1.5 CC1CC1CCC Amb24699677 [1,0,0,1,0,0|1,0,1]=4 8257 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,1]=3 8258 B7R1.5 CC1OC1CCO Amb24471660 [1,0,0,1,0,0|1,0,1]=4 8259 B7R1.5 C[C@@H]1C[C@@H]1CCC Amb24544739 [1,0,0,1,0,0|1,0,1]=4 8260 B7R1.5 C[C@@H]1C[C@H]1CCO Amb24593150 [1,0,0,1,0,0|0,0,1]=3 8261 B7R1.5 C[C@@H]1O[C@@H]1CCO Amb25176735 [1,0,0,1,0,0|1,0,1]=4 8262 B7R1.5 C[C@H]1C[C@H]1CCBr Amb24587326 [1,0,0,1,0,0|1,0,1]=4 8263 B7R1.5 C[C@H]1C[C@H]1CCC Amb25302063 [1,0,0,1,0,0|1,0,1]=4 8264 B7R1.5 C[C@H]1C[C@H]1CCO Amb25810215 [1,0,0,1,0,0|0,0,1]=3 8265 B7R1.5 C[C@H]1O[C@@H]1CCO Amb25226333 [1,0,0,1,0,0|1,0,1]=4 8266 B7R1.5 C[C@H]1O[C@H]1CCO Amb25025230 [1,0,0,1,0,0|1,0,1]=4 8267 B7R1.5 NNCC1CC1C Amb10610283 [1,0,0,1,0,0|2,0,0]=4 8268 B7R1.5 N[C@H]1C[C@@H]1CCO Amb24681172 [1,0,0,1,0,0|1,0,1]=4 8269 B7R1.5 N[C@H]1C[C@H]1CCO Amb24562303 [1,0,0,1,0,0|1,0,1]=4 8270 B7R1.6 C=CCC1CNC1 Amb23439504 [1,0,0,1,0,0|2,0,0]=4 8271 B7R1.6 C=CCC1COC1 Amb25856439 [1,0,0,1,0,0|2,0,0]=4 8272 B7R1.6 C=CCC1CSC1 Amb24623573 [1,0,0,1,0,0|2,0,0]=4 8273 B7R1.6 C=CC[C@@H]1CCN1 Amb25198891 [1,0,0,1,0,0|2,0,0]=4 8274 B7R1.6 C=CC[C@H]1CCN1 Amb25107968 [1,0,0,1,0,0|2,0,0]=4 8275 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|2,0,0]=4 8276 B7R1.6 CSCC1CCC1 Amb24613430 [1,0,0,1,0,0|2,0,0]=4 8277 B7R1.6 ICCC1CCC1 Amb25291483 [1,0,0,1,0,0|1,0,1]=4 8278 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,1]=4 8279 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,1]=4 8280 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 8281 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 8282 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,0]=2 8283 B7R1.6 O=CCC1COC1 Amb23440119 [1,0,0,1,0,0|1,0,0]=3 8284 B7R1.6 O=CCN1CCC1 Amb25831216 [1,0,0,1,0,0|1,0,0]=3 8285 B7R1.6 O=CNC1CCC1 Amb22295895 [1,0,0,1,0,0|1,0,0]=3 8286 B7R1.6 OCCC1CCC1 Amb22371147 [1,0,0,1,0,0|0,0,1]=3 8287 B7R1.6 OCCC1CCN1 Amb25350591 [1,0,0,1,0,0|1,0,1]=4 8288 B7R1.6 OCCC1CCO1 Amb25780445 [1,0,0,1,0,0|1,0,1]=4 8289 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|1,0,1]=4 8290 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|1,0,1]=4 8291 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|1,0,1]=4 8292 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|1,0,1]=4 8293 B7R1.6 OCC[C@@H]1CCN1 Amb24479867 [1,0,0,1,0,0|1,0,1]=4 8294 B7R1.6 OCC[C@H]1CCO1 Amb25129832 [1,0,0,1,0,0|1,0,1]=4 8295 B7R1.6 OCNC1CCC1 Amb24670261 [1,0,0,1,0,0|1,0,1]=4 8296 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,1]=4 8297 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|2,0,0]=4 8298 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,1]=4 8299 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,1]=3 8300 B7R1.8 CC1CCC1NC Amb25790859 [1,0,0,1,0,0|2,0,0]=4 8301 B7R1.8 CC1CNC1CO Amb25310037 [1,0,0,1,0,0|1,0,1]=4 8302 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|1,0,1]=4 8303 B7R1.8 C[C@@H]1CC[C@@H]1CCl Amb24514841 [1,0,0,1,0,0|1,0,1]=4 8304 B7R1.8 C[C@@H]1CC[C@H]1CO Amb24520389 [1,0,0,1,0,0|0,0,1]=3 8305 B7R1.8 C[C@@H]1CN[C@@H]1CO Amb25230021 [1,0,0,1,0,0|1,0,1]=4 8306 B7R1.8 C[C@H]1CC[C@H]1C=O Amb25373249 [1,0,0,1,0,0|0,0,0]=2 8307 B7R1.8 C[C@H]1CC[C@H]1CI Amb24519631 [1,0,0,1,0,0|1,0,1]=4 8308 B7R1.8 NC1CCC1CO Amb24375248 [1,0,0,1,0,0|1,0,1]=4 8309 B7R1.8 N[C@@H]1CC[C@@H]1CO Amb25782608 [1,0,0,1,0,0|1,0,1]=4 8310 B7R1.8 N[C@@H]1CC[C@H]1CO Amb25025452 [1,0,0,1,0,0|1,0,1]=4 8311 B7R1.8 N[C@H]1CC[C@H]1CO Amb25327109 [1,0,0,1,0,0|1,0,1]=4 8312 B7R1.8 O[C@@H]1CC[C@@H]1CO Amb25662759 [1,0,0,1,0,0|1,0,1]=4 8313 B7R1.9 C=CC1CC1C=O Amb25706757 [1,0,0,1,0,0|0,0,2]=4 8314 B7R1.9 C=CC1CC1CBr Amb25274052 [1,0,0,1,0,0|2,0,0]=4 8315 B7R1.9 C=C[C@@H]1C[C@H]1C=O Amb24550243 [1,0,0,1,0,0|0,0,2]=4 8316 B7R1.9 C=C[C@H]1C[C@@H]1C=O Amb24713815 [1,0,0,1,0,0|0,0,2]=4 8317 B7R1.9 C=C[C@H]1C[C@@H]1CO Amb25176489 [1,0,0,1,0,0|2,0,0]=4 8318 B7R1.9 C=C[C@H]1C[C@H]1C=O Amb24670531 [1,0,0,1,0,0|0,0,2]=4 8319 B7R1.9 C=C[C@H]1C[C@H]1CO Amb24519860 [1,0,0,1,0,0|2,0,0]=4 8320 B7R1.9 CCC1CC1C=O Amb24435958 [1,0,0,1,0,0|0,0,0]=2 8321 B7R1.9 CCC1CC1CCl Amb25278342 [1,0,0,1,0,0|1,0,1]=4 8322 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,1]=4 8323 B7R1.9 CCC1CC1NC Amb24480727 [1,0,0,1,0,0|2,0,0]=4 8324 B7R1.9 CCC1OC1C=O Amb25292367 [1,0,0,1,0,0|1,0,0]=3 8325 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,1]=3 8326 B7R1.9 CC[C@@H]1C[C@H]1C=O Amb24603090 [1,0,0,1,0,0|0,0,0]=2 8327 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,1]=4 8328 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,1]=3 8329 B7R1.9 CC[C@H]1C[C@@H]1CO Amb25215336 [1,0,0,1,0,0|0,0,1]=3 8330 B7R1.9 CC[C@H]1C[C@H]1C=O Amb25366612 [1,0,0,1,0,0|0,0,0]=2 8331 B7R1.9 CC[C@H]1O[C@@H]1C=O Amb24627851 [1,0,0,1,0,0|1,0,0]=3 8332 B7R1.9 CC[C@H]1O[C@@H]1CO Amb25213716 [1,0,0,1,0,0|1,0,1]=4 8333 B7R1.9 CC[C@H]1O[C@H]1CO Amb24715828 [1,0,0,1,0,0|1,0,1]=4 8334 B7R1.9 CN[C@@H]1C[C@@H]1CO Amb24551057 [1,0,0,1,0,0|1,0,1]=4 8335 B7R1.9 N#CC1CC1C=O Amb24378434 [1,0,0,1,0,0|1,0,1]=4 8336 B7R1.9 NCC1CC1CO Amb22499310 [1,0,0,1,0,0|1,0,1]=4 8337 B7R1.9 NC[C@@H]1C[C@@H]1CO Amb22746714 [1,0,0,1,0,0|1,0,1]=4 8338 B7R1.9 NC[C@@H]1C[C@H]1CO Amb22746972 [1,0,0,1,0,0|1,0,1]=4 8339 B7R1.9 NC[C@H]1C[C@@H]1CO Amb22224716 [1,0,0,1,0,0|1,0,1]=4 8340 B7R1.9 NC[C@H]1C[C@H]1CO Amb25217566 [1,0,0,1,0,0|1,0,1]=4 8341 B7R1.9 O=CC1CC1CBr Amb25087452 [1,0,0,1,0,0|1,0,0]=3 8342 B7R1.9 O=C[C@@H]1C[C@@H]1C=O Amb25349499 [1,0,0,1,0,0|1,0,1]=4 8343 B7R1.9 O=C[C@@H]1C[C@H]1C=O Amb25179869 [1,0,0,1,0,0|1,0,1]=4 8344 B7R1.9 OCC1CC1C=O Amb25726392 [1,0,0,1,0,0|1,0,0]=3 8345 B7R1.9 OCC1CC1CF Amb25129076 [1,0,0,1,0,0|1,0,1]=4 8346 B7R1.9 OC[C@@H]1C[C@H]1CO Amb25333423 [1,0,0,1,0,0|1,0,1]=4 8347 B7R1.9 OC[C@H]1C[C@@H]1CF Amb25235989 [1,0,0,1,0,0|1,0,1]=4 8348 B7R1.9 OC[C@H]1C[C@@H]1CO Amb24738177 [1,0,0,1,0,0|1,0,1]=4 8349 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [1,0,0,1,0,0|2,0,0]=4 8350 B7R1.10 C=C1CC(CO)C1 Amb25854323 [1,0,0,1,0,0|2,0,0]=4 8351 B7R1.10 CCC1CC(=C)C1 Amb25719578 [1,0,0,1,0,0|1,0,0]=3 8352 B7R1.10 CCC1CC(=O)C1 Amb24406738 [1,0,0,1,0,0|0,0,0]=2 8353 B7R1.10 CCC1CC(O)C1 Amb24654646 [1,0,0,1,0,0|0,0,1]=3 8354 B7R1.10 CCN1CC(O)C1 Amb19516884 [1,0,0,1,0,0|1,0,1]=4 8355 B7R1.10 CCN1CC(O)C1 Amb21960744 [1,0,0,1,0,0|1,0,1]=4 8356 B7R1.10 CC[C@H]1CC(=O)N1 Amb24479784 [1,0,0,1,0,0|1,0,0]=3 8357 B7R1.10 CNC1CC(=C)C1 Amb16230428 [1,0,0,1,0,0|2,0,0]=4 8358 B7R1.10 CNC1CC(O)C1 Amb19149003 [1,0,0,1,0,0|1,0,1]=4 8359 B7R1.10 CNC1CC(O)C1 Amb20623567 [1,0,0,1,0,0|1,0,1]=4 8360 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb23440035 [1,0,0,1,0,0|1,0,1]=4 8361 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb25173769 [1,0,0,1,0,0|1,0,1]=4 8362 B7R1.10 CN[C@@H]1C[C@H](O)C1 Amb23440266 [1,0,0,1,0,0|1,0,1]=4 8363 B7R1.10 COC1CC(=C)C1 Amb24733012 [1,0,0,1,0,0|2,0,0]=4 8364 B7R1.10 COC1CC(=O)C1 Amb22754340 [1,0,0,1,0,0|1,0,0]=3 8365 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 8366 B7R1.10 CSC1CC(O)C1 Amb24581791 [1,0,0,1,0,0|1,0,1]=4 8367 B7R1.10 ClCC1CC(=O)C1 Amb10610581 [1,0,0,1,0,0|1,0,0]=3 8368 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [1,0,0,1,0,0|1,0,1]=4 8369 B7R1.10 NCC1CC(=C)C1 Amb10071401 [1,0,0,1,0,0|2,0,0]=4 8370 B7R1.10 NCC1CC(=C)C1 Amb10976021 [1,0,0,1,0,0|2,0,0]=4 8371 B7R1.10 NCC1CC(=O)C1 Amb18251063 [1,0,0,1,0,0|1,0,0]=3 8372 B7R1.10 NCC1CC(=O)C1 Amb22406094 [1,0,0,1,0,0|1,0,0]=3 8373 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|2,0,0]=4 8374 B7R1.10 NCC1CC(O)C1 Amb21962033 [1,0,0,1,0,0|1,0,1]=4 8375 B7R1.10 NCC1CC(O)C1 Amb22405901 [1,0,0,1,0,0|1,0,1]=4 8376 B7R1.10 NC[C@@H]1CC(=O)N1 Amb24120375 [1,0,0,1,0,0|2,0,0]=4 8377 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899712 [1,0,0,1,0,0|1,0,1]=4 8378 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899737 [1,0,0,1,0,0|1,0,1]=4 8379 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22831753 [1,0,0,1,0,0|1,0,1]=4 8380 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22899743 [1,0,0,1,0,0|1,0,1]=4 8381 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [1,0,0,1,0,0|1,0,0]=3 8382 B7R1.10 O=C1CC(CBr)N1 Amb25779168 [1,0,0,1,0,0|2,0,0]=4 8383 B7R1.10 O=C1CC(CI)O1 Amb25169535 [1,0,0,1,0,0|2,0,0]=4 8384 B7R1.10 OC1CC(C1)CO Amb22284484 [1,0,0,1,0,0|1,0,1]=4 8385 B7R1.10 OC1CC(CCl)C1 Amb25083416 [1,0,0,1,0,0|1,0,1]=4 8386 B7R1.10 OCC1CC(=O)C1 Amb16231082 [1,0,0,1,0,0|1,0,0]=3 8387 B7R1.10 OCC1CC(=O)N1 Amb22388379 [1,0,0,1,0,0|2,0,0]=4 8388 B7R1.10 OCC1CC(=O)O1 Amb25706008 [1,0,0,1,0,0|2,0,0]=4 8389 B7R1.10 OC[C@@H]1CC(=O)N1 Amb24578924 [1,0,0,1,0,0|2,0,0]=4 8390 B7R1.10 OC[C@H]1CC(=O)O1 Amb25769462 [1,0,0,1,0,0|2,0,0]=4 8391 B7R1.10 O[C@H]1C[C@H](C1)CO Amb24665713 [1,0,0,1,0,0|1,0,1]=4 8392 B7R1.11 CC1C(Br)C1C=C Amb24653496 [1,0,0,1,0,0|2,0,0]=4 8393 B7R1.11 CC1C(C=O)C1C Amb25076190 [1,0,0,1,0,0|0,0,0]=2 8394 B7R1.11 CC1C(CBr)C1C Amb24518070 [1,0,0,1,0,0|1,0,1]=4 8395 B7R1.11 CC1C(CN)C1C Amb25350587 [1,0,0,1,0,0|1,0,1]=4 8396 B7R1.11 CC1C(Cl)C1CO Amb24479714 [1,0,0,1,0,0|1,0,1]=4 8397 B7R1.11 CC=1C(C=O)C1C Amb25365189 [1,0,0,1,0,0|0,0,2]=4 8398 B7R1.11 C[C@@H]1[C@@H](CO)[C@@H]1C Amb25847903 [1,0,0,1,0,0|0,0,1]=3 8399 B7R1.11 C[C@H]1C(CO)[C@@H]1C Amb24675074 [1,0,0,1,0,0|0,0,1]=3 8400 B7R1.11 C[C@H]1[C@@H](C=O)[C@H]1C Amb24682712 [1,0,0,1,0,0|0,0,0]=2 8401 B7R1.11 C[C@H]1[C@H](Br)[C@@H]1C=C Amb24710292 [1,0,0,1,0,0|2,0,0]=4 8402 B7R1.11 C[C@H]1[C@H](Br)[C@@H]1CO Amb25210525 [1,0,0,1,0,0|1,0,1]=4 8403 B7R1.15 CC1=CC(=O)C1C Amb24690597 [1,0,0,1,0,0|0,0,2]=4 8404 B7R1.15 CC1C(=O)CC1=O Amb24364046 [1,0,0,1,0,0|1,0,1]=4 8405 B7R1.15 CC1C(Br)CC1C Amb24718623 [1,0,0,1,0,0|1,0,1]=4 8406 B7R1.15 CC1C(C)CC1=C Amb24648318 [1,0,0,1,0,0|1,0,0]=3 8407 B7R1.15 CC1C(C)CC1=O Amb24605096 [1,0,0,1,0,0|0,0,0]=2 8408 B7R1.15 CC1C(C)NC1=O Amb22364651 [1,0,0,1,0,0|1,0,0]=3 8409 B7R1.15 CC1C(Cl)CC1C Amb24352196 [1,0,0,1,0,0|1,0,1]=4 8410 B7R1.15 CC1C(N)CC1C Amb25770629 [1,0,0,1,0,0|1,0,1]=4 8411 B7R1.15 CC1C(S)CC1C Amb24718624 [1,0,0,1,0,0|0,1,1]=4 8412 B7R1.15 CC1CC(=O)N1N Amb24415255 [1,0,0,1,0,0|2,0,0]=4 8413 B7R1.15 CC1CC(O)C1N Amb24564236 [1,0,0,1,0,0|1,0,1]=4 8414 B7R1.15 CC1NC(=O)C1I Amb24504951 [1,0,0,1,0,0|2,0,0]=4 8415 B7R1.15 CC1NC(=O)C1O Amb24536600 [1,0,0,1,0,0|2,0,0]=4 8416 B7R1.15 CC1OC(=O)C1N Amb25169554 [1,0,0,1,0,0|2,0,0]=4 8417 B7R1.15 CN1C(Cl)CC1=O Amb25211654 [1,0,0,1,0,0|2,0,0]=4 8418 B7R1.15 C[C@@H]1CC(=O)[C@@H]1Br Amb24656008 [1,0,0,1,0,0|1,0,0]=3 8419 B7R1.15 C[C@@H]1CC(=O)[C@H]1Br Amb24626651 [1,0,0,1,0,0|1,0,0]=3 8420 B7R1.15 C[C@@H]1NC(=O)[C@@H]1O Amb24632755 [1,0,0,1,0,0|2,0,0]=4 8421 B7R1.15 C[C@@H]1NC(=O)[C@H]1Cl Amb24746811 [1,0,0,1,0,0|2,0,0]=4 8422 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [1,0,0,1,0,0|2,0,0]=4 8423 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [1,0,0,1,0,0|2,0,0]=4 8424 B7R1.15 C[C@@H]1[C@H](C)CC1=O Amb25745705 [1,0,0,1,0,0|0,0,0]=2 8425 B7R1.15 C[C@H]1NC(=O)[C@H]1Br Amb25327771 [1,0,0,1,0,0|2,0,0]=4 8426 B7R1.15 C[C@H]1NC(=O)[C@H]1I Amb24561079 [1,0,0,1,0,0|2,0,0]=4 8427 B7R1.21 C=CCC1(N)CC1 Amb24589425 [1,0,0,1,0,0|2,0,0]=4 8428 B7R1.21 CC1(CC1)N=C=O Amb25736841 [1,0,0,1,0,0|1,0,1]=4 8429 B7R1.21 CC1(CCN)CC1 Amb18203037 [1,0,0,1,0,0|1,0,1]=4 8430 B7R1.21 CC1(CCO)CC1 Amb23538727 [1,0,0,1,0,0|0,0,1]=3 8431 B7R1.21 CC1(CCO)CO1 Amb25857517 [1,0,0,1,0,0|1,0,1]=4 8432 B7R1.21 CNCC1(C)CC1 Amb17605574 [1,0,0,1,0,0|2,0,0]=4 8433 B7R1.21 C[C@@]1(CCO)CO1 Amb25787188 [1,0,0,1,0,0|1,0,1]=4 8434 B7R1.21 C[C@]1(CCO)CO1 Amb25723082 [1,0,0,1,0,0|1,0,1]=4 8435 B7R1.21 NC1(CCO)CC1 Amb18202796 [1,0,0,1,0,0|1,0,1]=4 8436 B7R1.21 O=CCC1(F)CC1 Amb24620850 [1,0,0,1,0,0|1,0,0]=3 8437 B7R1.21 OC1(CC=O)CC1 Amb25243362 [1,0,0,1,0,0|1,0,0]=3 8438 B7R1.21 OCCC1(O)CC1 Amb22292375 [1,0,0,1,0,0|1,0,1]=4 8439 B7R1.22 CC(CBr)C1CO1 Amb24676951 [1,0,0,1,0,0|1,0,1]=4 8440 B7R1.22 CC(CC)C1CC1 Amb22231433 [1,0,0,1,0,0|1,0,1]=4 8441 B7R1.22 CC(OC)C1CO1 Amb25225530 [1,0,0,1,0,0|1,0,1]=4 8442 B7R1.22 CCC(Br)C1CO1 Amb25713756 [1,0,0,1,0,0|1,0,1]=4 8443 B7R1.22 CCC(Cl)C1CO1 Amb24559959 [1,0,0,1,0,0|1,0,1]=4 8444 B7R1.22 CC[C@H](O)[C@@H]1CO1 Amb24748610 [1,0,0,1,0,0|1,0,1]=4 8445 B7R1.22 C[C@@H](CO)[C@H]1CO1 Amb25257153 [1,0,0,1,0,0|1,0,1]=4 8446 B7R1.25 CC1(CBr)CCO1 Amb22736451 [1,0,0,1,0,0|1,0,1]=4 8447 B7R1.25 CC1(CCl)CCO1 Amb22736510 [1,0,0,1,0,0|1,0,1]=4 8448 B7R1.25 CC1(CI)CCO1 Amb22736694 [1,0,0,1,0,0|1,0,1]=4 8449 B7R1.25 CCC1(C)CCN1 Amb25843508 [1,0,0,1,0,0|1,0,1]=4 8450 B7R1.25 CCC1(C)CNC1 Amb25265414 [1,0,0,1,0,0|2,0,0]=4 8451 B7R1.27 CC1(CC1=O)C=C Amb25116558 [1,0,0,1,0,0|0,0,2]=4 8452 B7R1.27 CC1(CC1O)CO Amb24699167 [1,0,0,1,0,0|1,0,1]=4 8453 B7R1.27 CC1(CO)CC1=C Amb24577215 [1,0,0,1,0,0|2,0,0]=4 8454 B7R1.27 CCC1(C)CC1N Amb18280088 [1,0,0,1,0,0|1,0,1]=4 8455 B7R1.27 CC[C@@]1(C)C[C@H]1Br Amb25110633 [1,0,0,1,0,0|1,0,1]=4 8456 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [1,0,0,1,0,0|0,0,2]=4 8457 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [1,0,0,1,0,0|0,0,2]=4 8458 B7R1.12 CC(=O)C1CC1Br Amb24426068 [1,0,0,1,0,0|2,0,0]=4 8459 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [1,0,0,1,0,0|2,0,0]=4 8460 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [1,0,0,1,0,0|2,0,0]=4 8461 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [1,0,0,1,0,0|2,0,0]=4 8462 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [1,0,0,1,0,0|2,0,0]=4 8463 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [1,0,0,1,0,0|2,0,0]=4 8464 B7R1.12 CC(C)C1CC1O Amb25355248 [1,0,0,1,0,0|1,0,1]=4 8465 B7R1.12 CC(C)C1OC1Cl Amb24479293 [1,0,0,1,0,0|1,0,1]=4 8466 B7R1.12 CC(C)C1ON1C Amb24479796 [1,0,0,1,0,0|2,0,0]=4 8467 B7R1.12 CC1CC1C(C)=C Amb25694889 [1,0,0,1,0,0|2,0,0]=4 8468 B7R1.12 CC1CC1C(C)=O Amb25720437 [1,0,0,1,0,0|1,0,0]=3 8469 B7R1.12 CC1CC1C(C)O Amb25849677 [1,0,0,1,0,0|1,0,1]=4 8470 B7R1.12 CC1CC1C(N)=N Amb25139920 [1,0,0,1,0,0|2,0,0]=4 8471 B7R1.12 CC1CC1C(N)=S Amb25302556 [1,0,0,1,0,0|1,1,0]=4 8472 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [1,0,0,1,0,0|1,0,1]=4 8473 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [1,0,0,1,0,0|1,0,1]=4 8474 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,0]=3 8475 B7R1.12 CC1SC1C(C)=O Amb24333031 [1,0,0,1,0,0|2,0,0]=4 8476 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [1,0,0,1,0,0|1,0,1]=4 8477 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [1,0,0,1,0,0|1,0,0]=3 8478 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [1,0,0,1,0,0|1,0,0]=3 8479 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [1,0,0,1,0,0|0,0,0]=2 8480 B7R1.12 C[C@@H]1C[C@H]1B(O)O Amb24330179 [1,0,0,1,0,0|1,0,1]=4 8481 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,0]=3 8482 B7R1.12 C[C@@H]1C[C@H]1C(C)O Amb24714696 [1,0,0,1,0,0|1,0,1]=4 8483 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [1,0,0,1,0,0|0,0,0]=2 8484 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [1,0,0,1,0,0|1,0,0]=3 8485 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [1,0,0,1,0,0|1,0,0]=3 8486 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [1,0,0,1,0,0|2,0,0]=4 8487 B7R1.12 C[C@H]1C[C@@H]1B(O)O Amb24608885 [1,0,0,1,0,0|1,0,1]=4 8488 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [1,0,0,1,0,0|0,0,0]=2 8489 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [1,0,0,1,0,0|1,0,1]=4 8490 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,0]=2 8491 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [1,0,0,1,0,0|1,0,0]=3 8492 B7R1.12 C[C@H]1C[C@H]1C(C)O Amb24593507 [1,0,0,1,0,0|1,0,1]=4 8493 B7R1.12 C[C@H]1C[C@H]1[C@@H](C)O Amb25026747 [1,0,0,1,0,0|1,0,1]=4 8494 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [1,0,0,1,0,0|2,0,0]=4 8495 B7R1.12 NC1CC1C(N)=O Amb18279694 [1,0,0,1,0,0|2,0,0]=4 8496 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [1,0,0,1,0,0|1,0,0]=3 8497 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [1,0,0,1,0,0|1,0,0]=3 8498 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [1,0,0,1,0,0|1,0,0]=3 8499 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [1,0,0,1,0,0|2,0,0]=4 8500 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [1,0,0,1,0,0|2,0,0]=4 8501 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 8502 B7R1.12 OC(=O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,0]=3 8503 B7R1.12 OC(=O)C1CC1S Amb20246988 [1,0,0,1,0,0|1,0,0]=3 8504 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [1,0,0,1,0,0|1,0,0]=3 8505 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,0]=3 8506 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,0]=3 8507 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,0]=3 8508 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,0]=3 8509 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,0]=3 8510 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,0]=3 8511 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,0]=3 8512 B7R1.12 OC1CC1C(O)=O Amb24360896 [1,0,0,1,0,0|1,0,0]=3 8513 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [1,0,0,1,0,0|1,0,0]=3 8514 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [1,0,0,1,0,0|1,0,0]=3 8515 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [1,0,0,1,0,0|0,0,0]=2 8516 B7R1.16 CC1(C)CC(O)S1 Amb24431332 [1,0,0,1,0,0|0,1,1]=4 8517 B7R1.16 CC1CC(C)(O)C1 Amb25769307 [1,0,0,1,0,0|1,0,1]=4 8518 B7R1.16 OC1CP(O)(=O)C1 Amb25811046 [1,0,0,1,0,0|2,0,0]=4 8519 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|1,0,0]=3 8520 B7R1.20 CC(=O)CC1CO1 Amb25718439 [1,0,0,1,0,0|2,0,0]=4 8521 B7R1.20 CC(=O)OC1CC1 Amb24334499 [1,0,0,1,0,0|2,0,0]=4 8522 B7R1.20 CC(C)CC1CO1 Amb24631080 [1,0,0,1,0,0|1,0,1]=4 8523 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [1,0,0,1,0,0|1,0,1]=4 8524 B7R1.20 NC(=N)CC1CC1 Amb21964664 [1,0,0,1,0,0|2,0,0]=4 8525 B7R1.20 NC(=O)CC1CO1 Amb24654802 [1,0,0,1,0,0|2,0,0]=4 8526 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 8527 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,0]=3 8528 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 8529 B7R1.20 OC(=O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,0]=3 8530 B7R1.20 [O-][N+](=O)CC1CC1 Amb23589308 [1,0,0,1,0,0|1,0,1]=4 8531 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|1,0,1]=4 8532 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|1,0,1]=4 8533 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|1,0,1]=4 8534 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [1,0,0,1,0,0|2,0,0]=4 8535 B7R1.14 NC1(O)CCCC1 Amb24465053 [1,0,0,1,0,0|1,0,1]=4 8536 B7R1.17 CC1CCC1(C)O Amb24620558 [1,0,0,1,0,0|1,0,1]=4 8537 B7R1.17 CC1CCS1(=O)=O Amb22364950 [1,0,0,1,0,0|1,0,1]=4 8538 B7R1.18 CC(=C)C1CCC1 Amb25662691 [1,0,0,1,0,0|2,0,0]=4 8539 B7R1.18 CC(=O)C1CCO1 Amb25745997 [1,0,0,1,0,0|2,0,0]=4 8540 B7R1.18 CC(=O)C1CCS1 Amb24105980 [1,0,0,1,0,0|2,0,0]=4 8541 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,1,0,0|2,0,0]=4 8542 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,1,0,0|2,0,0]=4 8543 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|2,0,0]=4 8544 B7R1.18 CC(C1CCC1)O Amb10603414 [1,0,0,1,0,0|1,0,1]=4 8545 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,1,0,0|1,0,1]=4 8546 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,1,0,0|1,0,1]=4 8547 B7R1.18 NC(=N)C1CCC1 Amb19894979 [1,0,0,1,0,0|2,0,0]=4 8548 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|2,0,0]=4 8549 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|2,0,0]=4 8550 B7R1.18 NC(=O)C1CCO1 Amb24478900 [1,0,0,1,0,0|2,0,0]=4 8551 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,1,0,0|2,0,0]=4 8552 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,1,0,0|2,0,0]=4 8553 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,1,0,0|2,0,0]=4 8554 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,1,0,0|2,0,0]=4 8555 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,1,0,0|1,1,0]=4 8556 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,1,0,0|2,0,0]=4 8557 B7R1.18 OB(C1CCC1)O Amb10071491 [1,0,0,1,0,0|1,0,1]=4 8558 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|0,0,2]=4 8559 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,0]=3 8560 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,0]=3 8561 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,1,0,0|1,0,0]=3 8562 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,0,0]=3 8563 B7R1.18 OP(=O)C1CNC1 Amb25212879 [1,0,0,1,0,0|2,0,0]=4 8564 B7R1.18 [O-][N+](=O)C1CCC1 Amb13883563 [1,0,0,1,0,0|1,0,1]=4 8565 B7R1.23 CCC1CC1(C)O Amb24334471 [1,0,0,1,0,0|1,0,1]=4 8566 B7R1.19 CC(=C)C1(C)CC1 Amb25326278 [0,0,0,1,1,0|2,0,0]=4 8567 B7R1.19 CC(=O)C1(Br)CC1 Amb22498709 [0,0,0,1,1,0|2,0,0]=4 8568 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [0,0,0,1,1,0|1,0,0]=3 8569 B7R1.19 CC(=O)C1(Cl)CC1 Amb20671915 [0,0,0,1,1,0|2,0,0]=4 8570 B7R1.19 CC(=O)C1(F)CC1 Amb22388893 [0,0,0,1,1,0|2,0,0]=4 8571 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [0,0,0,1,1,0|2,0,0]=4 8572 B7R1.19 CC1(C=C1)C(O)=O Amb25042785 [0,0,0,1,1,0|0,0,2]=4 8573 B7R1.19 CC1(CC1)C(N)=O Amb19958822 [0,0,0,1,1,0|1,0,0]=3 8574 B7R1.19 CC1(CC1)C(N)=O Amb22752771 [0,0,0,1,1,0|1,0,0]=3 8575 B7R1.19 CC1(CO1)C(=O)O Amb17593087 [0,0,0,1,1,0|1,0,0]=3 8576 B7R1.19 CC1(CO1)C(N)=O Amb25261467 [0,0,0,1,1,0|2,0,0]=4 8577 B7R1.19 CC1(CS1)C(O)=O Amb24760846 [0,0,0,1,1,0|1,0,0]=3 8578 B7R1.19 C[C@@]1(CO1)C(O)=O Amb25785347 [0,0,0,1,1,0|1,0,0]=3 8579 B7R1.19 C[C@]1(CO1)C(O)=O Amb25063884 [0,0,0,1,1,0|1,0,0]=3 8580 B7R1.19 ClC(=O)C1(C)CC1 Amb16230812 [0,0,0,1,1,0|1,0,0]=3 8581 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [0,0,0,1,1,0|2,0,0]=4 8582 B7R1.19 NC(=O)C1(N)CC1 Amb20622292 [0,0,0,1,1,0|2,0,0]=4 8583 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [0,0,0,1,1,0|2,0,0]=4 8584 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [0,0,0,1,1,0|2,0,0]=4 8585 B7R1.19 NC1(CC1)C(=O)Cl Amb24565891 [0,0,0,1,1,0|2,0,0]=4 8586 B7R1.19 O=C(F)C1(F)CC1 Amb24600068 [0,0,0,1,1,0|2,0,0]=4 8587 B7R1.19 OC(=O)C1(Br)CC1 Amb19888922 [0,0,0,1,1,0|1,0,0]=3 8588 B7R1.19 OC(=O)C1(Cl)CC1 Amb25841916 [0,0,0,1,1,0|1,0,0]=3 8589 B7R1.19 OC(=O)C1(F)CC1 Amb22001836 [0,0,0,1,1,0|1,0,0]=3 8590 B9R1.1 CC1COC(CO1)CC Amb25726501 [0,0,0,1,0,1|1,0,1]=4 8591 B9R1.1 CCC1CCC(=S)CC1 Amb24478607 [0,0,0,1,0,1|1,1,0]=4 8592 B9R1.1 CCC1CCC(O)OC1 Amb24593816 [0,0,0,1,0,1|0,0,2]=4 8593 B9R1.1 CCC1CNC(=O)CC1 Amb25727228 [0,0,0,1,0,1|1,0,0]=3 8594 B9R1.1 CCC1CNC(=O)CN1 Amb18832614 [0,0,0,1,0,1|1,0,0]=3 8595 B9R1.1 CCC1CNC(=O)CS1 Amb24597647 [0,0,0,1,0,1|1,0,0]=3 8596 B9R1.1 CCC1CNC(=O)OC1 Amb24645209 [0,0,0,1,0,1|0,0,0]=2 8597 B9R1.1 CCC1COC(CN1)C Amb1105038 [0,0,0,1,0,1|1,0,1]=4 8598 B9R1.1 CC[C@@H]1CCC(=O)C=C1 Amb24736307 [0,0,0,1,0,1|1,0,1]=4 8599 B9R1.1 CC[C@@H]1CC[C@@H](O)CC1 Amb22231677 [0,0,0,1,0,1|1,0,1]=4 8600 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,0,0,1,0,1|2,0,0]=4 8601 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,0,0,1,0,1|2,0,0]=4 8602 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,0,0,1,0,1|2,0,0]=4 8603 B9R1.1 COC1CNC(O)=NC1 Amb25304325 [0,0,0,1,0,1|2,0,0]=4 8604 B9R1.1 CSC1CCC(=O)CC1 Amb25707895 [0,0,0,1,0,1|2,0,0]=4 8605 B9R1.1 NCC1CCC(=O)CC1 Amb20247631 [0,0,0,1,0,1|2,0,0]=4 8606 B9R1.1 NCC1CNC(=O)CC1 Amb18832607 [0,0,0,1,0,1|2,0,0]=4 8607 B9R1.1 NCC1CNC(=O)CN1 Amb25194789 [0,0,0,1,0,1|2,0,0]=4 8608 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,0,0,1,0,1|2,0,0]=4 8609 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,0,0,1,0,1|2,0,0]=4 8610 B9R1.1 NCC1CNC(=O)CS1 Amb25242244 [0,0,0,1,0,1|2,0,0]=4 8611 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,0,0,1,0,1|2,0,0]=4 8612 B9R1.1 O=C1CCC(CF)CC1 Amb25217167 [0,0,0,1,0,1|2,0,0]=4 8613 B9R1.1 OCC1CCC(=O)CC1 Amb10071596 [0,0,0,1,0,1|2,0,0]=4 8614 B9R1.1 OCC1CCC(=O)CN1 Amb25207554 [0,0,0,1,0,1|2,0,0]=4 8615 B9R1.1 OCC1CNC(=O)CC1 Amb19958990 [0,0,0,1,0,1|2,0,0]=4 8616 B9R1.1 OCC1CNC(=O)CN1 Amb25187358 [0,0,0,1,0,1|2,0,0]=4 8617 B9R1.1 OCC1CNC(=O)CO1 Amb22236094 [0,0,0,1,0,1|2,0,0]=4 8618 B9R1.1 OCC1CNC(=O)CS1 Amb25374316 [0,0,0,1,0,1|2,0,0]=4 8619 B9R1.1 OCC1CNC(=O)NC1 Amb25291682 [0,0,0,1,0,1|2,0,0]=4 8620 B9R1.1 OCC1CNC(=O)OC1 Amb25247634 [0,0,0,1,0,1|1,0,0]=3 8621 B9R1.1 OC[C@@H]1CNC(=O)CO1 Amb10067153 [0,0,0,1,0,1|2,0,0]=4 8622 B9R1.10 C[C@@H]1CC[C@](C)(O)CC1 Amb24593240 [0,0,0,1,0,1|1,0,1]=4 8623 B9R1.35 CC(=O)C1CCC(Cl)C1 Amb24064130 [0,0,0,1,0,1|2,0,0]=4 8624 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [0,0,0,1,0,1|2,0,0]=4 8625 B9R1.35 CC(=O)C=1CC[C@H](C)C1 Amb24689488 [0,0,0,1,0,1|1,0,1]=4 8626 B9R1.35 CC(=O)N1CC(Br)CC1 Amb21861126 [0,0,0,1,0,1|2,0,0]=4 8627 B9R1.35 CC(=O)N1CC(Cl)CC1 Amb21861140 [0,0,0,1,0,1|2,0,0]=4 8628 B9R1.35 CC(=O)N1CC(I)CC1 Amb21861147 [0,0,0,1,0,1|2,0,0]=4 8629 B9R1.35 CC(=O)N1CC(N)CC1 Amb20669217 [0,0,0,1,0,1|2,0,0]=4 8630 B9R1.35 CC(=O)N1CC(O)CC1 Amb20622704 [0,0,0,1,0,1|2,0,0]=4 8631 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,0,0,1,0,1|2,0,0]=4 8632 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,1,0,1|2,0,0]=4 8633 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,1,0,1|2,0,0]=4 8634 B9R1.35 CC(=O)N1C[C@@H](Br)CC1 Amb22227522 [0,0,0,1,0,1|2,0,0]=4 8635 B9R1.35 CC(=O)N1C[C@@H](Cl)CC1 Amb22227524 [0,0,0,1,0,1|2,0,0]=4 8636 B9R1.35 CC(=O)N1C[C@@H](I)CC1 Amb22227531 [0,0,0,1,0,1|2,0,0]=4 8637 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb19890016 [0,0,0,1,0,1|2,0,0]=4 8638 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb22227520 [0,0,0,1,0,1|2,0,0]=4 8639 B9R1.35 CC(=O)N1C[C@H](Br)CC1 Amb22227483 [0,0,0,1,0,1|2,0,0]=4 8640 B9R1.35 CC(=O)N1C[C@H](Cl)CC1 Amb22227481 [0,0,0,1,0,1|2,0,0]=4 8641 B9R1.35 CC(=O)N1C[C@H](I)CC1 Amb22227495 [0,0,0,1,0,1|2,0,0]=4 8642 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb19891343 [0,0,0,1,0,1|2,0,0]=4 8643 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb22227487 [0,0,0,1,0,1|2,0,0]=4 8644 B9R1.35 CC1=CC(SC1)C(=O)O Amb10809142 [0,0,0,1,0,1|1,0,1]=4 8645 B9R1.35 CC1=NC(CO1)C(O)=O Amb20621597 [0,0,0,1,0,1|1,0,1]=4 8646 B9R1.35 CC1=NC(CS1)C(O)=O Amb18124720 [0,0,0,1,0,1|1,0,1]=4 8647 B9R1.35 CC1C=CC(O1)C(O)=O Amb18642586 [0,0,0,1,0,1|0,0,2]=4 8648 B9R1.35 CC1C=CC(S1)C(O)=O Amb18644111 [0,0,0,1,0,1|0,0,2]=4 8649 B9R1.35 CC1CC(=CC1)C(O)=O Amb18642398 [0,0,0,1,0,1|0,0,1]=3 8650 B9R1.35 CC1CC(=NO1)C(O)=O Amb25694020 [0,0,0,1,0,1|2,0,0]=4 8651 B9R1.35 CC1CC(CC1)C(N)=N Amb25825672 [0,0,0,1,0,1|2,0,0]=4 8652 B9R1.35 CC1CC(CC1)C(N)=O Amb24763749 [0,0,0,1,0,1|1,0,0]=3 8653 B9R1.35 CC1CC(CC1)C(N)=S Amb25140648 [0,0,0,1,0,1|1,1,0]=4 8654 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [0,0,0,1,0,1|0,0,0]=2 8655 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [0,0,0,1,0,1|1,0,0]=3 8656 B9R1.35 CC1CC(CO1)C(=O)Cl Amb25832627 [0,0,0,1,0,1|2,0,0]=4 8657 B9R1.35 CC1CC(N=C1)C(O)=O Amb24650545 [0,0,0,1,0,1|1,0,1]=4 8658 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [0,0,0,1,0,1|0,0,1]=3 8659 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [0,0,0,1,0,1|1,0,0]=3 8660 B9R1.35 CC1CCC(C1)C(C)O Amb24447243 [0,0,0,1,0,1|1,0,1]=4 8661 B9R1.35 CC1CCC(N1)C(N)=O Amb18642667 [0,0,0,1,0,1|1,0,0]=3 8662 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [0,0,0,1,0,1|0,0,0]=2 8663 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [0,0,0,1,0,1|0,0,0]=2 8664 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [0,0,0,1,0,1|1,0,0]=3 8665 B9R1.35 CC1CCC(O1)[C@@H](C)O Amb24561971 [0,0,0,1,0,1|1,0,1]=4 8666 B9R1.35 CC1CCC(S1)B(O)O Amb24716870 [0,0,0,1,0,1|1,0,1]=4 8667 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [0,0,0,1,0,1|0,0,0]=2 8668 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [0,0,0,1,0,1|0,0,0]=2 8669 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [0,0,0,1,0,1|0,0,0]=2 8670 B9R1.35 CC1CC[C@H](N1)C(N)=O Amb24696154 [0,0,0,1,0,1|1,0,0]=3 8671 B9R1.35 CC1CC[C@H](S1)B(O)O Amb24698939 [0,0,0,1,0,1|1,0,1]=4 8672 B9R1.35 CC1CN(CC1)C(C)=N Amb25055962 [0,0,0,1,0,1|2,0,0]=4 8673 B9R1.35 CC1CN(CC1)C(N)=O Amb25692037 [0,0,0,1,0,1|1,0,0]=3 8674 B9R1.35 CC1CN(CO1)C(=O)Cl Amb25839832 [0,0,0,1,0,1|2,0,0]=4 8675 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [0,0,0,1,0,1|1,0,0]=3 8676 B9R1.35 CC1CSC(=C1)C(O)=O Amb25044433 [0,0,0,1,0,1|1,0,1]=4 8677 B9R1.35 CC1CSC(S1)C(C)=O Amb24676738 [0,0,0,1,0,1|2,0,0]=4 8678 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [0,0,0,1,0,1|1,0,0]=3 8679 B9R1.35 CC1C[C@H](N=C1)C(O)=O Amb24394037 [0,0,0,1,0,1|1,0,1]=4 8680 B9R1.35 CC1N=C(CS1)C(O)=O Amb24099770 [0,0,0,1,0,1|1,0,1]=4 8681 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [0,0,0,1,0,1|1,0,0]=3 8682 B9R1.35 CC=1CC(CC1)C(O)=O Amb18642425 [0,0,0,1,0,1|0,0,2]=4 8683 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [0,0,0,1,0,1|0,0,1]=3 8684 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [0,0,0,1,0,1|0,0,1]=3 8685 B9R1.35 CC=1C[C@H](CC1)C(O)=O Amb24350803 [0,0,0,1,0,1|0,0,2]=4 8686 B9R1.35 CC=1NC(CN1)C(O)=O Amb24599993 [0,0,0,1,0,1|1,0,1]=4 8687 B9R1.35 CN1CC(=CC1)C(O)=O Amb25032089 [0,0,0,1,0,1|1,0,1]=4 8688 B9R1.35 CN1CC(CC1)C(N)=O Amb25144200 [0,0,0,1,0,1|2,0,0]=4 8689 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [0,0,0,1,0,1|1,0,0]=3 8690 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [0,0,0,1,0,1|1,0,0]=3 8691 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [0,0,0,1,0,1|1,0,0]=3 8692 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [0,0,0,1,0,1|0,0,0]=2 8693 B9R1.35 C[C@@H]1CC[C@@H](N1)C(N)=O Amb24572556 [0,0,0,1,0,1|1,0,0]=3 8694 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [0,0,0,1,0,1|0,0,0]=2 8695 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [0,0,0,1,0,1|0,0,0]=2 8696 B9R1.35 C[C@@H]1CS[C@H](S1)C(=O)Cl Amb25110654 [0,0,0,1,0,1|2,0,0]=4 8697 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [0,0,0,1,0,1|1,0,0]=3 8698 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [0,0,0,1,0,1|1,0,0]=3 8699 B9R1.35 C[C@@H]1C[C@@H](ON1)C(O)=O Amb24680946 [0,0,0,1,0,1|2,0,0]=4 8700 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [0,0,0,1,0,1|1,0,0]=3 8701 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [0,0,0,1,0,1|1,0,0]=3 8702 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [0,0,0,1,0,1|1,0,0]=3 8703 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [0,0,0,1,0,1|0,0,0]=2 8704 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [0,0,0,1,0,1|0,0,0]=2 8705 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [0,0,0,1,0,1|0,0,0]=2 8706 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [0,0,0,1,0,1|0,0,0]=2 8707 B9R1.35 C[C@H]1C[C@@H](CC1)C(N)=O Amb24612116 [0,0,0,1,0,1|1,0,0]=3 8708 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [0,0,0,1,0,1|1,0,0]=3 8709 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [0,0,0,1,0,1|1,0,0]=3 8710 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [0,0,0,1,0,1|1,0,0]=3 8711 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [0,0,0,1,0,1|1,0,0]=3 8712 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [0,0,0,1,0,1|1,0,0]=3 8713 B9R1.35 N=C1CCC(N1)C(O)=O Amb18642592 [0,0,0,1,0,1|1,0,1]=4 8714 B9R1.35 NC(=O)C1CCC(O)C1 Amb25230928 [0,0,0,1,0,1|2,0,0]=4 8715 B9R1.35 NC(=O)N1CC(O)CC1 Amb24635585 [0,0,0,1,0,1|2,0,0]=4 8716 B9R1.35 NC(=O)N1C[C@@H](O)CC1 Amb24478790 [0,0,0,1,0,1|2,0,0]=4 8717 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,0,0,1,0,1|2,0,0]=4 8718 B9R1.35 NC1CC(=CC1)C(O)=O Amb18642495 [0,0,0,1,0,1|1,0,1]=4 8719 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [0,0,0,1,0,1|2,0,0]=4 8720 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [0,0,0,1,0,1|2,0,0]=4 8721 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [0,0,0,1,0,1|2,0,0]=4 8722 B9R1.35 NC1CCC(=C1)C(O)=O Amb18642496 [0,0,0,1,0,1|1,0,1]=4 8723 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [0,0,0,1,0,1|1,0,0]=3 8724 B9R1.35 NC1CCC(C1)C(N)=O Amb25104222 [0,0,0,1,0,1|2,0,0]=4 8725 B9R1.35 NC1CN(CC1)C(N)=O Amb18943828 [0,0,0,1,0,1|2,0,0]=4 8726 B9R1.35 NC1CN(CC1)C(N)=O Amb19373727 [0,0,0,1,0,1|2,0,0]=4 8727 B9R1.35 NC1NC(CS1)C(O)=O Amb25703132 [0,0,0,1,0,1|2,0,0]=4 8728 B9R1.35 NC=1CC[C@H](N1)C(O)=O Amb25346757 [0,0,0,1,0,1|1,0,1]=4 8729 B9R1.35 N[C@@H]1CC(=CC1)C(O)=O Amb25143919 [0,0,0,1,0,1|1,0,1]=4 8730 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [0,0,0,1,0,1|1,0,0]=3 8731 B9R1.35 N[C@@H]1CC[C@@H](C1)C(N)=O Amb25321319 [0,0,0,1,0,1|2,0,0]=4 8732 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [0,0,0,1,0,1|1,0,0]=3 8733 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [0,0,0,1,0,1|2,0,0]=4 8734 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [0,0,0,1,0,1|1,0,0]=3 8735 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [0,0,0,1,0,1|2,0,0]=4 8736 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [0,0,0,1,0,1|2,0,0]=4 8737 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [0,0,0,1,0,1|1,0,0]=3 8738 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [0,0,0,1,0,1|2,0,0]=4 8739 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [0,0,0,1,0,1|2,0,0]=4 8740 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [0,0,0,1,0,1|2,0,0]=4 8741 B9R1.35 N[C@H]1CC(=CC1)C(O)=O Amb25824589 [0,0,0,1,0,1|1,0,1]=4 8742 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [0,0,0,1,0,1|1,0,0]=3 8743 B9R1.35 N[C@H]1CN(CC1)C(N)=O Amb25688167 [0,0,0,1,0,1|2,0,0]=4 8744 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [0,0,0,1,0,1|2,0,0]=4 8745 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [0,0,0,1,0,1|2,0,0]=4 8746 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [0,0,0,1,0,1|2,0,0]=4 8747 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [0,0,0,1,0,1|2,0,0]=4 8748 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [0,0,0,1,0,1|2,0,0]=4 8749 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [0,0,0,1,0,1|2,0,0]=4 8750 B9R1.35 O=C(Cl)C1CC(Cl)CC1 Amb24707520 [0,0,0,1,0,1|2,0,0]=4 8751 B9R1.35 O=C(Cl)C1CCC(F)C1 Amb25071689 [0,0,0,1,0,1|2,0,0]=4 8752 B9R1.35 O=C1CC[C@H](N1)C(=O)O Amb1995036 [0,0,0,1,0,1|1,0,1]=4 8753 B9R1.35 OC(=O)C1CC(Br)CN1 Amb25239348 [0,0,0,1,0,1|2,0,0]=4 8754 B9R1.35 OC(=O)C1CC(CN1)F Amb10608925 [0,0,0,1,0,1|2,0,0]=4 8755 B9R1.35 OC(=O)C1CC(CN1)S Amb10608928 [0,0,0,1,0,1|2,0,0]=4 8756 B9R1.35 OC(=O)C1CCC(=O)N1 Amb22282321 [0,0,0,1,0,1|1,0,1]=4 8757 B9R1.35 OC(=O)C1CCC(=O)O1 Amb20623076 [0,0,0,1,0,1|1,0,1]=4 8758 B9R1.35 OC(=O)C1CCC(=O)S1 Amb23439315 [0,0,0,1,0,1|1,0,1]=4 8759 B9R1.35 OC(=O)C1CCC(=S)N1 Amb24477679 [0,0,0,1,0,1|1,0,1]=4 8760 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,1|1,0,0]=3 8761 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [0,0,0,1,0,1|1,0,0]=3 8762 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,1|1,0,0]=3 8763 B9R1.35 OC(=O)C1C[C@H](F)CN1 Amb24598689 [0,0,0,1,0,1|2,0,0]=4 8764 B9R1.35 OC(=O)C=1CC(O)CN1 Amb25141429 [0,0,0,1,0,1|2,0,0]=4 8765 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [0,0,0,1,0,1|1,0,1]=4 8766 B9R1.35 OC(=O)[C@@H]1CC(F)CN1 Amb25123838 [0,0,0,1,0,1|2,0,0]=4 8767 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 Amb24099403 [0,0,0,1,0,1|1,0,1]=4 8768 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [0,0,0,1,0,1|1,0,0]=3 8769 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)Br Amb10603137 [0,0,0,1,0,1|2,0,0]=4 8770 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)F Amb10603139 [0,0,0,1,0,1|2,0,0]=4 8771 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)I Amb10603140 [0,0,0,1,0,1|2,0,0]=4 8772 B9R1.35 OC(=O)[C@@H]1C[C@@H](Cl)CN1 Amb24582915 [0,0,0,1,0,1|2,0,0]=4 8773 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|2,0,0]=4 8774 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb25245369 [0,0,0,1,0,1|2,0,0]=4 8775 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)Br Amb10603132 [0,0,0,1,0,1|2,0,0]=4 8776 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)F Amb16232298 [0,0,0,1,0,1|2,0,0]=4 8777 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)I Amb10603134 [0,0,0,1,0,1|2,0,0]=4 8778 B9R1.35 OC(=O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|2,0,0]=4 8779 B9R1.35 OC(=O)[C@H]1C[C@@H](CN1)F Amb10067741 [0,0,0,1,0,1|2,0,0]=4 8780 B9R1.35 OC(=O)[C@H]1C[C@H](CN1)F Amb10839999 [0,0,0,1,0,1|2,0,0]=4 8781 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,0,0,1,0,1|1,0,0]=3 8782 B9R1.35 OC1CN(CC1)C(=O)Cl Amb25740939 [0,0,0,1,0,1|2,0,0]=4 8783 B9R1.35 OC1CNC(C1)C(=O)O Amb1151287 [0,0,0,1,0,1|2,0,0]=4 8784 B9R1.35 OC1CN[C@@H](C1)C(O)=O Amb25743296 [0,0,0,1,0,1|2,0,0]=4 8785 B9R1.35 OC1COC(C1)C(O)=O Amb18642869 [0,0,0,1,0,1|2,0,0]=4 8786 B9R1.35 OC1CSC(O1)C(=O)O Amb2432252 [0,0,0,1,0,1|2,0,0]=4 8787 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [0,0,0,1,0,1|2,0,0]=4 8788 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,0,0,1,0,1|1,0,0]=3 8789 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,0,0,1,0,1|1,0,0]=3 8790 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,0,0,1,0,1|1,0,0]=3 8791 B9R1.35 O[C@@H]1CNC(C1)C(O)=O Amb25118054 [0,0,0,1,0,1|2,0,0]=4 8792 B9R1.35 O[C@@H]1CN[C@@H](C1)C(O)=O Amb22748218 [0,0,0,1,0,1|2,0,0]=4 8793 B9R1.35 O[C@@H]1CN[C@H](C1)C(=O)O Amb16230723 [0,0,0,1,0,1|2,0,0]=4 8794 B9R1.35 O[C@@H]1CO[C@@H](C1)C(O)=O Amb24501449 [0,0,0,1,0,1|2,0,0]=4 8795 B9R1.35 O[C@@H]1CO[C@H](C1)C(O)=O Amb24501448 [0,0,0,1,0,1|2,0,0]=4 8796 B9R1.35 O[C@@H]1CS[C@H](O1)C(O)=O Amb25288477 [0,0,0,1,0,1|2,0,0]=4 8797 B9R1.35 O[C@H]1CNC(C1)C(O)=O Amb24682710 [0,0,0,1,0,1|2,0,0]=4 8798 B9R1.35 O[C@H]1CN[C@@H](C1)C(=O)O Amb1994991 [0,0,0,1,0,1|2,0,0]=4 8799 B9R1.46 C=C1CC1NCC(O)=O Amb24402024 [0,0,0,1,0,1|0,0,2]=4 8800 B9R1.46 CC1CC1C#CC(O)=O Amb24390173 [0,0,0,1,0,1|0,0,1]=3 8801 B9R1.46 CC1CC1CNC(C)=O Amb25851867 [0,0,0,1,0,1|1,0,0]=3 8802 B9R1.46 CC1CC1CNC(N)=N Amb25716226 [0,0,0,1,0,1|2,0,0]=4 8803 B9R1.46 CC1CC1CNC(N)=O Amb25185082 [0,0,0,1,0,1|1,0,0]=3 8804 B9R1.46 CC1CC1CNC(N)=S Amb25847200 [0,0,0,1,0,1|1,1,0]=4 8805 B9R1.46 CC1CC1NCC(=C)Br Amb18990743 [0,0,0,1,0,1|2,0,0]=4 8806 B9R1.46 CC1CC1NCC(=C)Cl Amb18990744 [0,0,0,1,0,1|2,0,0]=4 8807 B9R1.46 CC1CC1NCC(C)=C Amb18990737 [0,0,0,1,0,1|2,0,0]=4 8808 B9R1.46 CC1CC1NCC(C)O Amb25139772 [0,0,0,1,0,1|1,0,1]=4 8809 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,0,0,1,0,1|1,0,0]=3 8810 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [0,0,0,1,0,1|0,0,0]=2 8811 B9R1.46 CC1CC1NC[C@@H](C)O Amb24644247 [0,0,0,1,0,1|1,0,1]=4 8812 B9R1.46 CC1OC1\C=C\C(O)=O Amb24475226 [0,0,0,1,0,1|1,0,1]=4 8813 B9R1.46 C[C@@H]1C[C@@H]1CCC(C)=O Amb25834668 [0,0,0,1,0,1|1,0,0]=3 8814 B9R1.46 C[C@@H]1C[C@H]1CCC(C)=O Amb25163844 [0,0,0,1,0,1|1,0,0]=3 8815 B9R1.49 CC1CCC(O)OCC1 Amb24697549 [0,0,0,1,0,1|0,0,2]=4 8816 B9R1.49 CC1CCCC(=C)CC1 Amb22364866 [0,0,0,1,0,1|2,0,0]=4 8817 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,0,0,1,0,1|1,0,1]=4 8818 B9R1.49 CC1CCNC(=N)CC1 Amb24460651 [0,0,0,1,0,1|2,0,0]=4 8819 B9R1.49 CC1CCNC(=S)CC1 Amb25230099 [0,0,0,1,0,1|1,1,0]=4 8820 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,0,1,0,1|0,0,0]=2 8821 B9R1.49 CC1CNC(=N)CCC1 Amb25080544 [0,0,0,1,0,1|2,0,0]=4 8822 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,0,0,1,0,1|2,0,0]=4 8823 B9R1.49 CC1CNCC(=O)NC1 Amb25372388 [0,0,0,1,0,1|2,0,0]=4 8824 B9R1.49 CC1COC(=O)NCC1 Amb24393355 [0,0,0,1,0,1|1,0,0]=3 8825 B9R1.49 CC1CSCC(=O)CS1 Amb25024961 [0,0,0,1,0,1|2,0,0]=4 8826 B9R1.49 CC1NCCC(=O)NC1 Amb10607813 [0,0,0,1,0,1|2,0,0]=4 8827 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,0,0,1,0,1|2,0,0]=4 8828 B9R1.49 CN1CCOC(=O)CC1 Amb25376750 [0,0,0,1,0,1|1,0,0]=3 8829 B9R1.49 CN1CNC(=O)CCC1 Amb25118592 [0,0,0,1,0,1|2,0,0]=4 8830 B9R1.49 C[C@@H]1CCC[C@@H](O)CC1 Amb24623728 [0,0,0,1,0,1|1,0,1]=4 8831 B9R1.49 C[C@@H]1CCC[C@H](O)CC1 Amb24515396 [0,0,0,1,0,1|1,0,1]=4 8832 B9R1.49 C[C@H]1CCC(O)OCC1 Amb25051811 [0,0,0,1,0,1|0,0,2]=4 8833 B9R1.49 C[C@H]1CCCC(=O)C=C1 Amb24513554 [0,0,0,1,0,1|1,0,1]=4 8834 B9R1.49 C[C@H]1CCNC(=O)CC1 Amb25146079 [0,0,0,1,0,1|1,0,0]=3 8835 B9R1.49 C[C@H]1CNC(=N)CCC1 Amb25146115 [0,0,0,1,0,1|2,0,0]=4 8836 B9R1.49 NC1CCCC(=O)CC1 Amb25259225 [0,0,0,1,0,1|2,0,0]=4 8837 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,0,0,1,0,1|2,0,0]=4 8838 B9R1.49 NC1CCOC(=O)CC1 Amb23598291 [0,0,0,1,0,1|1,0,0]=3 8839 B9R1.49 NC1CNC(=O)CCC1 Amb22230053 [0,0,0,1,0,1|2,0,0]=4 8840 B9R1.49 O=C1CCC(=O)OCC1 Amb25723209 [0,0,0,1,0,1|1,0,1]=4 8841 B9R1.49 O=C1CCC(Br)CCO1 Amb25188931 [0,0,0,1,0,1|1,0,0]=3 8842 B9R1.49 O=C1CCC(Cl)CCO1 Amb24480302 [0,0,0,1,0,1|1,0,0]=3 8843 B9R1.49 O=C1CC[C@@H](Cl)CCO1 Amb24518083 [0,0,0,1,0,1|1,0,0]=3 8844 B9R1.49 O=C1CC[C@H](Cl)CCO1 Amb25123845 [0,0,0,1,0,1|1,0,0]=3 8845 B9R1.49 OC1CCOC(=O)CC1 Amb23598292 [0,0,0,1,0,1|1,0,0]=3 8846 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [0,0,0,1,0,1|2,0,0]=4 8847 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [0,0,0,1,0,1|2,0,0]=4 8848 B9R1.55 CC(=O)C1=C[C@@H](C)[C@H]1C Amb24722820 [0,0,0,1,0,1|1,0,1]=4 8849 B9R1.55 CC1C(CC1C)C(C)=O Amb24476715 [0,0,0,1,0,1|1,0,0]=3 8850 B9R1.55 CC1C(CC1C)C(O)=O Amb23456159 [0,0,0,1,0,1|0,0,0]=2 8851 B9R1.55 CC1C(NC1=O)C(O)=O Amb25339232 [0,0,0,1,0,1|1,0,1]=4 8852 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,0,0,1,0,1|2,0,0]=4 8853 B9R1.55 C[C@@H]1C[C@@H](C(O)=O)N1C Amb24683087 [0,0,0,1,0,1|1,0,0]=3 8854 B9R1.55 C[C@H]1[C@@H](C[C@H]1C)C(O)=O Amb24745807 [0,0,0,1,0,1|0,0,0]=2 8855 B9R1.55 C[C@H]1[C@H](C[C@@H]1C)C(O)=O Amb24629706 [0,0,0,1,0,1|0,0,0]=2 8856 B9R1.55 N[C@@H]1[C@H](C[C@@H]1O)C(O)=O Amb24514844 [0,0,0,1,0,1|2,0,0]=4 8857 B9R1.67 CC(=O)C[C@@H]1CC[C@@H]1F Amb24440447 [0,0,0,1,0,1|2,0,0]=4 8858 B9R1.67 CC(=O)C[C@H]1CC[C@H]1F Amb25246392 [0,0,0,1,0,1|2,0,0]=4 8859 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O Amb25297958 [0,0,0,1,0,1|2,0,0]=4 8860 B9R1.67 CC(=O)OC1CCC1Br Amb24529040 [0,0,0,1,0,1|2,0,0]=4 8861 B9R1.67 CC(=O)OC1CCC1Cl Amb24480103 [0,0,0,1,0,1|2,0,0]=4 8862 B9R1.67 CC(=O)OC1CCC1N Amb25064702 [0,0,0,1,0,1|2,0,0]=4 8863 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,0,0,1,0,1|2,0,0]=4 8864 B9R1.67 CC(=O)O[C@H]1CC[C@@H]1Br Amb24519430 [0,0,0,1,0,1|2,0,0]=4 8865 B9R1.67 CC(=O)O[C@H]1CC[C@@H]1Cl Amb24586951 [0,0,0,1,0,1|2,0,0]=4 8866 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,0,0,1,0,1|0,0,0]=2 8867 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,0,0,1,0,1|1,0,0]=3 8868 B9R1.67 OC(=O)CN1CCC1=O Amb25368422 [0,0,0,1,0,1|1,0,1]=4 8869 B9R1.69 CC1=CC(=O)CCC1C Amb25128835 [0,0,0,1,0,1|1,0,1]=4 8870 B9R1.69 CC1=CC(=O)NCC1C Amb25083025 [0,0,0,1,0,1|1,0,1]=4 8871 B9R1.69 CC1=NC(=O)CCC1C Amb24070883 [0,0,0,1,0,1|1,0,1]=4 8872 B9R1.69 CC1CC(=O)CCC1C Amb22732216 [0,0,0,1,0,1|1,0,0]=3 8873 B9R1.69 CC1CC(=O)CCC1Cl Amb24391486 [0,0,0,1,0,1|2,0,0]=4 8874 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,0,0,1,0,1|2,0,0]=4 8875 B9R1.69 CC1CC(=O)CCN1C Amb19148128 [0,0,0,1,0,1|2,0,0]=4 8876 B9R1.69 CC1CC(=O)NCC1N Amb24496285 [0,0,0,1,0,1|2,0,0]=4 8877 B9R1.69 CC1CCC(=O)CC1Br Amb24398782 [0,0,0,1,0,1|2,0,0]=4 8878 B9R1.69 CC1CCC(=O)CN1C Amb25792971 [0,0,0,1,0,1|2,0,0]=4 8879 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,0,0,1,0,1|1,0,1]=4 8880 B9R1.69 CC1CCC(C)=CC1C Amb25048711 [0,0,0,1,0,1|2,0,0]=4 8881 B9R1.69 CC1CNC(=O)CC1C Amb25124566 [0,0,0,1,0,1|1,0,0]=3 8882 B9R1.69 CC1COC(=O)CC1O Amb25781910 [0,0,0,1,0,1|2,0,0]=4 8883 B9R1.69 CC1COC(O)CC1C Amb24333809 [0,0,0,1,0,1|1,0,1]=4 8884 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,0,0,1,0,1|2,0,0]=4 8885 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,0,0,1,0,1|2,0,0]=4 8886 B9R1.69 CC1NC(=O)NCC1Br Amb24675323 [0,0,0,1,0,1|2,0,0]=4 8887 B9R1.69 CC1NC(=S)NCC1C Amb24740288 [0,0,0,1,0,1|1,1,0]=4 8888 B9R1.69 CC1OC(=O)CCC1O Amb24524239 [0,0,0,1,0,1|1,0,0]=3 8889 B9R1.69 CC1OC(=O)CNC1=O Amb25145608 [0,0,0,1,0,1|1,0,1]=4 8890 B9R1.69 CC1OC(=S)NCC1C Amb24477731 [0,0,0,1,0,1|0,1,0]=3 8891 B9R1.69 CC1SCC(=O)NC1C Amb24655776 [0,0,0,1,0,1|1,0,0]=3 8892 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,0,0,1,0,1|1,0,1]=4 8893 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1C Amb22231666 [0,0,0,1,0,1|1,0,0]=3 8894 B9R1.69 C[C@@H]1CC(O)CC[C@@H]1C Amb25215758 [0,0,0,1,0,1|1,0,1]=4 8895 B9R1.69 C[C@@H]1CC=C(C)O[C@H]1O Amb25236121 [0,0,0,1,0,1|2,0,0]=4 8896 B9R1.69 C[C@@H]1COC(O)C[C@@H]1C Amb25266294 [0,0,0,1,0,1|1,0,1]=4 8897 B9R1.69 C[C@@H]1C[C@@H](O)CC[C@H]1C Amb24705627 [0,0,0,1,0,1|1,0,1]=4 8898 B9R1.69 C[C@@H]1NC(=O)CC[C@@H]1O Amb25081565 [0,0,0,1,0,1|2,0,0]=4 8899 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1N Amb24100133 [0,0,0,1,0,1|2,0,0]=4 8900 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1O Amb24710524 [0,0,0,1,0,1|2,0,0]=4 8901 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1Br Amb24571741 [0,0,0,1,0,1|1,0,0]=3 8902 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1C Amb24679479 [0,0,0,1,0,1|0,0,0]=2 8903 B9R1.69 C[C@@H]1O[C@@H](C)CN[C@H]1C Amb25259246 [0,0,0,1,0,1|1,0,1]=4 8904 B9R1.69 C[C@@H]1SC(N)=NC[C@@H]1C Amb24609899 [0,0,0,1,0,1|1,1,0]=4 8905 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O Amb25202720 [0,0,0,1,0,1|2,0,0]=4 8906 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,0,0,1,0,1|1,0,0]=3 8907 B9R1.69 C[C@H]1CC=C(C)O[C@H]1O Amb25175541 [0,0,0,1,0,1|2,0,0]=4 8908 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1Cl Amb25179045 [0,0,0,1,0,1|2,0,0]=4 8909 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Br Amb25178854 [0,0,0,1,0,1|2,0,0]=4 8910 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Cl Amb25179044 [0,0,0,1,0,1|2,0,0]=4 8911 B9R1.69 C[C@H]1COC(=O)C[C@H]1O Amb24516166 [0,0,0,1,0,1|2,0,0]=4 8912 B9R1.69 C[C@H]1C[C@H](O)CC[C@H]1C Amb24620750 [0,0,0,1,0,1|1,0,1]=4 8913 B9R1.69 C[C@H]1NC(=O)CC[C@H]1N Amb24622058 [0,0,0,1,0,1|2,0,0]=4 8914 B9R1.69 C[C@H]1NC(=O)CC[C@H]1O Amb24598792 [0,0,0,1,0,1|2,0,0]=4 8915 B9R1.69 C[C@H]1OC(=O)CCC1=O Amb25749526 [0,0,0,1,0,1|1,0,1]=4 8916 B9R1.69 C[C@H]1OC(=O)CC[C@@H]1O Amb25350343 [0,0,0,1,0,1|1,0,0]=3 8917 B9R1.69 C[C@H]1O[C@H](C)CN[C@@H]1C Amb24628511 [0,0,0,1,0,1|1,0,1]=4 8918 B9R1.69 OC1CCC(C(C1)C)C Amb10844787 [0,0,0,1,0,1|1,0,1]=4 8919 B9R1.80 CC(CC)OCC1CO1 Amb25844344 [0,0,0,1,0,1|1,0,1]=4 8920 B9R1.80 CC(CC)OC[C@@H]1CO1 Amb25851839 [0,0,0,1,0,1|1,0,1]=4 8921 B9R1.80 CC(CCC1CO1)CC Amb24595175 [0,0,0,1,0,1|1,0,1]=4 8922 B9R1.82 CC(CO)C1CC(=O)N1 Amb24598373 [0,0,0,1,0,1|2,0,0]=4 8923 B9R1.82 CCC(Cl)C1CC(=O)O1 Amb24433017 [0,0,0,1,0,1|1,0,0]=3 8924 B9R1.82 CCC(O)C1CC(=O)O1 Amb24420833 [0,0,0,1,0,1|1,0,0]=3 8925 B9R1.82 C[C@@H](CO)[C@H]1CC(=O)O1 Amb24675614 [0,0,0,1,0,1|1,0,0]=3 8926 B9R1.82 C[C@H](CO)[C@@H]1CC(=O)N1 Amb24517111 [0,0,0,1,0,1|2,0,0]=4 8927 B9R1.84 C=C(Br)CNC1CCC1 Amb18990432 [0,0,0,1,0,1|2,0,0]=4 8928 B9R1.84 C=C(Cl)CNC1CCC1 Amb18990433 [0,0,0,1,0,1|2,0,0]=4 8929 B9R1.84 CC(=C)CNC1CCC1 Amb18298086 [0,0,0,1,0,1|2,0,0]=4 8930 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,0,0,1,0,1|1,0,0]=3 8931 B9R1.84 CC(=O)CSC1CCC1 Amb24481902 [0,0,0,1,0,1|1,0,0]=3 8932 B9R1.84 CC(=O)CSC1COC1 Amb25853147 [0,0,0,1,0,1|2,0,0]=4 8933 B9R1.84 CC(=O)\C=C\C1CCC1 Amb22494067 [0,0,0,1,0,1|1,0,1]=4 8934 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,0,0,1,0,1|1,0,1]=4 8935 B9R1.84 C[C@H](O)CNC1CCC1 Amb24481590 [0,0,0,1,0,1|1,0,1]=4 8936 B9R1.84 NC(=N)NCC1CCC1 Amb24594164 [0,0,0,1,0,1|2,0,0]=4 8937 B9R1.84 NC(=O)CCC1CNC1 Amb24627864 [0,0,0,1,0,1|2,0,0]=4 8938 B9R1.84 NC(=O)CCN1CCC1 Amb25081700 [0,0,0,1,0,1|2,0,0]=4 8939 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,0,0,1,0,1|1,0,0]=3 8940 B9R1.84 NC(=O)COC1CCC1 Amb24714151 [0,0,0,1,0,1|1,0,0]=3 8941 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,0,0,1,0,1|2,0,0]=4 8942 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,0,0,1,0,1|2,0,0]=4 8943 B9R1.84 NC(=O)NOC1CCC1 Amb25295666 [0,0,0,1,0,1|2,0,0]=4 8944 B9R1.84 NC(=O)OCC1CCC1 Amb24642121 [0,0,0,1,0,1|1,0,0]=3 8945 B9R1.84 NC(=S)COC1CCC1 Amb25266184 [0,0,0,1,0,1|1,1,0]=4 8946 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,0,0,1,0,1|1,0,0]=3 8947 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,0,0,1,0,1|2,0,0]=4 8948 B9R1.84 OC(=O)C=CC1CCC1 Amb20624021 [0,0,0,1,0,1|0,0,1]=3 8949 B9R1.84 OC(=O)CCN1CCC1 Amb22292346 [0,0,0,1,0,1|1,0,0]=3 8950 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [0,0,0,1,0,1|0,0,0]=2 8951 B9R1.84 OC(=O)CNC1CNC1 Amb25254651 [0,0,0,1,0,1|1,0,0]=3 8952 B9R1.84 OC(=O)CNC1COC1 Amb22737320 [0,0,0,1,0,1|1,0,0]=3 8953 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [0,0,0,1,0,1|0,0,0]=2 8954 B9R1.84 OC(=O)COC1CNC1 Amb24454311 [0,0,0,1,0,1|1,0,0]=3 8955 B9R1.84 OC(=O)COC1COC1 Amb24539538 [0,0,0,1,0,1|1,0,0]=3 8956 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [0,0,0,1,0,1|0,0,0]=2 8957 B9R1.84 OC(=O)CSC1CNC1 Amb24759226 [0,0,0,1,0,1|1,0,0]=3 8958 B9R1.84 OC(=O)CSC1CSC1 Amb24569012 [0,0,0,1,0,1|1,0,0]=3 8959 B9R1.84 [O-][N+](=O)CCC1CCC1 Amb15692934 [0,0,0,1,0,1|1,0,1]=4 8960 B9R1.86 CC(=O)NC1CC1CO Amb25846832 [0,0,0,1,0,1|2,0,0]=4 8961 B9R1.86 CC(O)CC1CC1CC Amb24356232 [0,0,0,1,0,1|1,0,1]=4 8962 B9R1.86 CCC1CC1NC(C)=O Amb25208251 [0,0,0,1,0,1|1,0,0]=3 8963 B9R1.86 CCC1CC1NC(N)=N Amb25055361 [0,0,0,1,0,1|2,0,0]=4 8964 B9R1.86 CCC1CC1NC(N)=O Amb25208250 [0,0,0,1,0,1|1,0,0]=3 8965 B9R1.86 C[C@@H](O)C[C@@H]1C[C@@H]1CC Amb25204804 [0,0,0,1,0,1|1,0,1]=4 8966 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [0,0,0,1,0,1|1,0,0]=3 8967 B9R1.86 OC(=O)CN1CC1C=O Amb24078335 [0,0,0,1,0,1|1,0,1]=4 8968 B9R1.95 CC(=O)C=1CC(CC)C1 Amb24495314 [0,0,0,1,0,1|1,0,1]=4 8969 B9R1.95 CC(=O)N1CC(CCl)C1 Amb25332330 [0,0,0,1,0,1|2,0,0]=4 8970 B9R1.95 CCC1CC(=C1)C(O)=O Amb25238748 [0,0,0,1,0,1|0,0,1]=3 8971 B9R1.95 CCC1CC(C1)C(=O)Cl Amb25791521 [0,0,0,1,0,1|1,0,0]=3 8972 B9R1.95 CCC1CC(C1)C(C)=O Amb25046444 [0,0,0,1,0,1|1,0,0]=3 8973 B9R1.95 CCC1CC(C1)C(N)=O Amb25690385 [0,0,0,1,0,1|1,0,0]=3 8974 B9R1.95 CCC1CC(C1)C(O)=O Amb23456004 [0,0,0,1,0,1|0,0,0]=2 8975 B9R1.95 CCN1CC(C1)C(O)=O Amb24117130 [0,0,0,1,0,1|1,0,0]=3 8976 B9R1.95 CC[C@@H]1C[C@@H](C1)C(O)=O Amb25129624 [0,0,0,1,0,1|0,0,0]=2 8977 B9R1.95 CNC1CC(C1)C(O)=O Amb20622656 [0,0,0,1,0,1|1,0,0]=3 8978 B9R1.95 CNC1CN(C1)C(C)=O Amb23598676 [0,0,0,1,0,1|2,0,0]=4 8979 B9R1.95 CNC1CN(C1)C(N)=O Amb23598671 [0,0,0,1,0,1|2,0,0]=4 8980 B9R1.95 COC1CC(C1)C(C)=O Amb24595933 [0,0,0,1,0,1|2,0,0]=4 8981 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [0,0,0,1,0,1|1,0,0]=3 8982 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [0,0,0,1,0,1|1,0,0]=3 8983 B9R1.95 NC(=O)N1CC(CO)C1 Amb24478714 [0,0,0,1,0,1|2,0,0]=4 8984 B9R1.95 OC(=O)C1CC(CBr)C1 Amb19958667 [0,0,0,1,0,1|1,0,0]=3 8985 B9R1.95 OC(=O)[C@H]1C[C@@H](CBr)C1 Amb25116147 [0,0,0,1,0,1|1,0,0]=3 8986 B9R1.95 OCC1CC(C1)C(O)=O Amb22002175 [0,0,0,1,0,1|1,0,0]=3 8987 B9R1.95 OC[C@@H]1C[C@@H](N1)C(O)=O Amb24556421 [0,0,0,1,0,1|1,0,0]=3 8988 B9R1.125 CC1(CBr)CNC(=O)O1 Amb24753177 [0,0,0,1,0,1|1,0,0]=3 8989 B9R1.125 CC1(CBr)CNC(=O)S1 Amb25163395 [0,0,0,1,0,1|1,1,0]=4 8990 B9R1.125 CC1(CCC(=O)O1)C#C Amb25277305 [0,0,0,1,0,1|0,0,2]=4 8991 B9R1.125 CC1(CCl)CNC(=O)C1 Amb24384917 [0,0,0,1,0,1|2,0,0]=4 8992 B9R1.125 CC1(CCl)CNC(=O)S1 Amb25032092 [0,0,0,1,0,1|1,1,0]=4 8993 B9R1.125 CC1(CCl)COC(=O)N1 Amb25793609 [0,0,0,1,0,1|2,0,0]=4 8994 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,0,0,1,0,1|2,0,0]=4 8995 B9R1.125 CC1(CN)CNC(=O)C1 Amb24677517 [0,0,0,1,0,1|2,0,0]=4 8996 B9R1.125 CC1(CO)CCC(=O)N1 Amb25796503 [0,0,0,1,0,1|2,0,0]=4 8997 B9R1.125 CC1(CO)CCC(=O)O1 Amb24424055 [0,0,0,1,0,1|1,0,0]=3 8998 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,0,0,1,0,1|2,0,0]=4 8999 B9R1.125 CC1(CO)COC(=O)C1 Amb24748377 [0,0,0,1,0,1|2,0,0]=4 9000 B9R1.125 CC1(CS)COC(=O)N1 Amb24666773 [0,0,0,1,0,1|2,0,0]=4 9001 B9R1.125 CCC1(C)CC(=O)CC1 Amb24706768 [0,0,0,1,0,1|1,0,0]=3 9002 B9R1.125 CCC1(C)CC(O)CC1 Amb25109111 [0,0,0,1,0,1|1,0,1]=4 9003 B9R1.125 CCC1(C)CNC(=O)C1 Amb24655544 [0,0,0,1,0,1|1,0,0]=3 9004 B9R1.125 CCC1(C)CNC(=O)O1 Amb25228455 [0,0,0,1,0,1|0,0,0]=2 9005 B9R1.125 CCC1(C)CNC(=S)N1 Amb24745606 [0,0,0,1,0,1|1,1,0]=4 9006 B9R1.125 CCC1(C)COC(=S)C1 Amb25300753 [0,0,0,1,0,1|1,1,0]=4 9007 B9R1.125 CCC1(C)COC(N)=N1 Amb24759550 [0,0,0,1,0,1|2,0,0]=4 9008 B9R1.125 CCC1(C)COC(O)C1 Amb24517530 [0,0,0,1,0,1|1,0,1]=4 9009 B9R1.125 CCC1(C)CSC(=S)C1 Amb24481780 [0,0,0,1,0,1|1,1,0]=4 9010 B9R1.125 CCC1(C)N=C(C)CS1 Amb24394922 [0,0,0,1,0,1|2,0,0]=4 9011 B9R1.125 CCC1(C)NC(=O)CS1 Amb24452202 [0,0,0,1,0,1|1,0,0]=3 9012 B9R1.125 CCC1(C)NC(=O)N=N1 Amb25810149 [0,0,0,1,0,1|2,0,0]=4 9013 B9R1.125 CCC1(C)NCC(=S)N1 Amb24714751 [0,0,0,1,0,1|1,1,0]=4 9014 B9R1.125 CCC1(C)NCC(C)O1 Amb24400991 [0,0,0,1,0,1|1,0,1]=4 9015 B9R1.125 CC[C@@]1(C)CCC(=O)N1 Amb24356520 [0,0,0,1,0,1|1,0,0]=3 9016 B9R1.125 CC[C@@]1(C)COC(=O)N1 Amb24587770 [0,0,0,1,0,1|1,0,0]=3 9017 B9R1.125 CC[C@@]1(C)CO[C@H](O)C1 Amb25283511 [0,0,0,1,0,1|1,0,1]=4 9018 B9R1.125 CC[C@]1(C)CC(=O)CC1 Amb25706157 [0,0,0,1,0,1|1,0,0]=3 9019 B9R1.125 CC[C@]1(C)COC(=O)N1 Amb25253542 [0,0,0,1,0,1|1,0,0]=3 9020 B9R1.125 C[C@@]1(CBr)CCC(=O)O1 Amb24480303 [0,0,0,1,0,1|1,0,0]=3 9021 B9R1.125 C[C@@]1(CBr)CNC(=O)O1 Amb25264424 [0,0,0,1,0,1|1,0,0]=3 9022 B9R1.125 C[C@]1(CBr)CCC(=O)O1 Amb24425525 [0,0,0,1,0,1|1,0,0]=3 9023 B9R1.125 C[C@]1(CCl)CNC(=O)O1 Amb24480106 [0,0,0,1,0,1|1,0,0]=3 9024 B9R1.125 C[C@]1(CO)C=CC(=O)O1 Amb24404816 [0,0,0,1,0,1|1,0,1]=4 9025 B9R1.127 CC(=O)C1CC1(C)CCl Amb25141665 [0,0,0,1,0,1|2,0,0]=4 9026 B9R1.127 CC(=O)C1OC1(C)CCl Amb24670937 [0,0,0,1,0,1|2,0,0]=4 9027 B9R1.127 CC(=O)C1OC1(C)CO Amb24662478 [0,0,0,1,0,1|2,0,0]=4 9028 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,0,0,1,0,1|1,0,0]=3 9029 B9R1.127 CCC1(C)CC1C(N)=O Amb24377068 [0,0,0,1,0,1|1,0,0]=3 9030 B9R1.127 CCC1(C)CC1C(O)=O Amb18285802 [0,0,0,1,0,1|0,0,0]=2 9031 B9R1.127 C[C@@]1(CN)C[C@H]1C(O)=O Amb24517240 [0,0,0,1,0,1|1,0,0]=3 9032 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,0,0,1,0,1|2,0,0]=4 9033 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,0,0,1,0,1|2,0,0]=4 9034 B9R1.133 CCC1CC(C)(O)CC1 Amb25147188 [0,0,0,1,0,1|1,0,1]=4 9035 B9R1.138 CC1C(C)COS1(=O)=O Amb25311685 [0,0,0,1,0,1|1,0,1]=4 9036 B9R1.147 CC(=N)NCC1(C)CC1 Amb24404061 [0,0,0,1,0,1|2,0,0]=4 9037 B9R1.147 CC(=O)CCC1(O)CC1 Amb25278414 [0,0,0,1,0,1|2,0,0]=4 9038 B9R1.147 CC(O)CNC1(C)CC1 Amb25724802 [0,0,0,1,0,1|1,0,1]=4 9039 B9R1.147 CC1(CC1)C#CC(O)=O Amb25662631 [0,0,0,1,0,1|0,0,1]=3 9040 B9R1.147 CC1(CCC(O)=O)N=N1 Amb25840850 [0,0,0,1,0,1|2,0,0]=4 9041 B9R1.147 CC1(CNC(N)=N)CC1 Amb25762470 [0,0,0,1,0,1|2,0,0]=4 9042 B9R1.147 CC1(CNC(N)=O)CC1 Amb24733644 [0,0,0,1,0,1|1,0,0]=3 9043 B9R1.147 CC1(CNC(N)=S)CC1 Amb24354499 [0,0,0,1,0,1|1,1,0]=4 9044 B9R1.147 NC(=O)CCC1(N)CC1 Amb24756880 [0,0,0,1,0,1|2,0,0]=4 9045 B9R1.147 NC1(CC1)C#CC(O)=O Amb24558280 [0,0,0,1,0,1|1,0,1]=4 9046 B9R1.147 NC1(CC1)\C=C\C(O)=O Amb24460594 [0,0,0,1,0,1|1,0,1]=4 9047 B9R1.147 NC1(CCC(O)=O)CC1 Amb18832570 [0,0,0,1,0,1|1,0,0]=3 9048 B9R1.147 OC(=O)C#CC1(Cl)CC1 Amb25133518 [0,0,0,1,0,1|1,0,1]=4 9049 B9R1.3 CC1C(=O)NCCN1C Amb19723393 [0,1,0,1,0,0|2,0,0]=4 9050 B9R1.3 CC1C(=O)NCCN1C Amb21961555 [0,1,0,1,0,0|2,0,0]=4 9051 B9R1.3 CC1C(C)NCCC1=O Amb18642528 [0,1,0,1,0,0|2,0,0]=4 9052 B9R1.3 CC1C(O)CCOC1=O Amb24592874 [0,1,0,1,0,0|1,0,0]=3 9053 B9R1.3 CC1CC=CC(=O)C1O Amb24570442 [0,1,0,1,0,0|1,0,1]=4 9054 B9R1.3 CC1CCC=C(C)C1Br Amb25246943 [0,1,0,1,0,0|2,0,0]=4 9055 B9R1.3 CC1CCCC(=O)C1=O Amb22043334 [0,1,0,1,0,0|1,0,1]=4 9056 B9R1.3 CC1CCCC(=O)C1Br Amb24355950 [0,1,0,1,0,0|1,0,0]=3 9057 B9R1.3 CC1CCCC(=O)C1Cl Amb25101122 [0,1,0,1,0,0|1,0,0]=3 9058 B9R1.3 CC1CCCC(O)C1Cl Amb25707552 [0,1,0,1,0,0|1,0,1]=4 9059 B9R1.3 CC1CCCC(O)C1N Amb25377554 [0,1,0,1,0,0|1,0,1]=4 9060 B9R1.3 CC1CCCC(O)C1O Amb25823103 [0,1,0,1,0,0|1,0,1]=4 9061 B9R1.3 CC1CCC[C@@H](O)[C@H]1O Amb25245925 [0,1,0,1,0,0|1,0,1]=4 9062 B9R1.3 CC1CCNC(=O)C1Cl Amb25339436 [0,1,0,1,0,0|1,0,0]=3 9063 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|1,0,0]=3 9064 B9R1.3 CC1CCNC(=O)N1C Amb25781297 [0,1,0,1,0,0|2,0,0]=4 9065 B9R1.3 CC1CCOC(=O)C1O Amb25369401 [0,1,0,1,0,0|0,0,0]=2 9066 B9R1.3 CC1CCOC(=O)[C@H]1O Amb25315194 [0,1,0,1,0,0|0,0,0]=2 9067 B9R1.3 CC1CCOC(C)C1O Amb24428158 [0,1,0,1,0,0|1,0,1]=4 9068 B9R1.3 CC1CCOC(O)C1C Amb25255954 [0,1,0,1,0,0|0,0,2]=4 9069 B9R1.3 CC1NCCC(=O)C1O Amb24618856 [0,1,0,1,0,0|2,0,0]=4 9070 B9R1.3 CC1OCCC(=O)C1O Amb24723617 [0,1,0,1,0,0|2,0,0]=4 9071 B9R1.3 CC1[C@H](C)CC=CC1=O Amb25834367 [0,1,0,1,0,0|1,0,1]=4 9072 B9R1.3 C[C@@H]1CCCC(=O)C1Br Amb24726834 [0,1,0,1,0,0|1,0,0]=3 9073 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1Br Amb25211285 [0,1,0,1,0,0|1,0,0]=3 9074 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1C Amb24631628 [0,1,0,1,0,0|1,0,0]=3 9075 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1Cl Amb25238274 [0,1,0,1,0,0|1,0,0]=3 9076 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1N Amb24515607 [0,1,0,1,0,0|1,0,1]=4 9077 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1C Amb24747627 [0,1,0,1,0,0|1,0,1]=4 9078 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1O Amb25176154 [0,1,0,1,0,0|1,0,1]=4 9079 B9R1.3 C[C@@H]1CCOC(O)[C@H]1O Amb25226516 [0,1,0,1,0,0|0,0,2]=4 9080 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1O Amb25373144 [0,1,0,1,0,0|1,0,1]=4 9081 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1Br Amb24564319 [0,1,0,1,0,0|1,0,0]=3 9082 B9R1.3 C[C@H]1CCCC(=O)[C@H]1C Amb25179382 [0,1,0,1,0,0|1,0,0]=3 9083 B9R1.3 C[C@H]1CCCC(=O)[C@H]1Cl Amb24545462 [0,1,0,1,0,0|1,0,0]=3 9084 B9R1.3 C[C@H]1CCOC(=O)[C@H]1O Amb25239425 [0,1,0,1,0,0|0,0,0]=2 9085 B9R1.3 C[C@H]1[C@@H](O)CCCC1=O Amb24737440 [0,1,0,1,0,0|2,0,0]=4 9086 B9R1.3 C[C@H]1[C@H](C)SCCC1=O Amb25319950 [0,1,0,1,0,0|2,0,0]=4 9087 B9R1.3 C[C@H]1[C@H](N)CCCC1=O Amb24670466 [0,1,0,1,0,0|2,0,0]=4 9088 B9R1.3 NC1C(O)CCNC1=O Amb24529078 [0,1,0,1,0,0|2,0,0]=4 9089 B9R1.3 NC1CCNC(=O)C1O Amb24593871 [0,1,0,1,0,0|2,0,0]=4 9090 B9R1.3 N[C@@H]1[C@@H](O)CCNC1=O Amb25220585 [0,1,0,1,0,0|2,0,0]=4 9091 B9R1.3 O=C1CCCC(Br)C1Cl Amb25231312 [0,1,0,1,0,0|2,0,0]=4 9092 B9R1.3 O=C1CCCC(Cl)C1Cl Amb25147221 [0,1,0,1,0,0|2,0,0]=4 9093 B9R1.3 O=C1CCCC(F)C1Br Amb25840986 [0,1,0,1,0,0|2,0,0]=4 9094 B9R1.3 O=C1CCC[C@@H](Br)[C@@H]1Cl Amb25220218 [0,1,0,1,0,0|2,0,0]=4 9095 B9R1.3 O=C1CCC[C@@H](Cl)[C@@H]1Br Amb25380764 [0,1,0,1,0,0|2,0,0]=4 9096 B9R1.3 OC1C(Cl)CCCC1=O Amb24433119 [0,1,0,1,0,0|2,0,0]=4 9097 B9R1.3 OC1CCCC(=O)C1Br Amb25216961 [0,1,0,1,0,0|2,0,0]=4 9098 B9R1.3 OC1CCCC(=O)C1Cl Amb25138773 [0,1,0,1,0,0|2,0,0]=4 9099 B9R1.3 OC1CCNC(=O)C1Cl Amb23440466 [0,1,0,1,0,0|2,0,0]=4 9100 B9R1.3 OC1CCNC(=O)C1O Amb24712104 [0,1,0,1,0,0|2,0,0]=4 9101 B9R1.3 OC1CCOC(=O)C1O Amb24735003 [0,1,0,1,0,0|1,0,0]=3 9102 B9R1.3 O[C@@H]1CCCC(=O)[C@@H]1O Amb24706773 [0,1,0,1,0,0|2,0,0]=4 9103 B9R1.3 O[C@@H]1CCCC(=O)[C@H]1Cl Amb24591761 [0,1,0,1,0,0|2,0,0]=4 9104 B9R1.3 O[C@H]1CCCC(=O)[C@H]1O Amb25191514 [0,1,0,1,0,0|2,0,0]=4 9105 B9R1.3 O[C@H]1[C@H](Br)CCCC1=O Amb25210888 [0,1,0,1,0,0|2,0,0]=4 9106 B9R1.37 CC1=CC(=O)[C@@H](O)[C@@H]1C Amb24629195 [0,1,0,1,0,0|0,0,2]=4 9107 B9R1.37 CC1=CC(=O)[C@@H](O)[C@H]1C Amb24612133 [0,1,0,1,0,0|0,0,2]=4 9108 B9R1.37 CC1=NC(=O)C(C)C1C Amb24353879 [0,1,0,1,0,0|1,0,1]=4 9109 B9R1.37 CC1C(=O)CC(C)N1C Amb25297041 [0,1,0,1,0,0|2,0,0]=4 9110 B9R1.37 CC1C(Br)C(C)OC1=O Amb24678811 [0,1,0,1,0,0|1,0,0]=3 9111 B9R1.37 CC1C(C)C(O)OC1=O Amb24705671 [0,1,0,1,0,0|1,0,0]=3 9112 B9R1.37 CC1C(C)OC(=O)C1=C Amb24481883 [0,1,0,1,0,0|0,0,1]=3 9113 B9R1.37 CC1C(C)OC(Br)C1C Amb25091152 [0,1,0,1,0,0|1,0,1]=4 9114 B9R1.37 CC1C(C)OC(C)C1C Amb25331035 [0,1,0,1,0,0|1,0,1]=4 9115 B9R1.37 CC1C(N)C(=O)OC1=O Amb24549009 [0,1,0,1,0,0|1,0,1]=4 9116 B9R1.37 CC1C(O)C(=O)OC1C Amb24748283 [0,1,0,1,0,0|0,0,0]=2 9117 B9R1.37 CC1C(O)C(C)OC1=O Amb25056081 [0,1,0,1,0,0|1,0,0]=3 9118 B9R1.37 CC1C=C(O)C(=O)C1C Amb25031643 [0,1,0,1,0,0|0,0,1]=3 9119 B9R1.37 CC1CC(=O)C(=O)C1Cl Amb25756646 [0,1,0,1,0,0|1,0,1]=4 9120 B9R1.37 CC1CC(=O)C(=O)C1O Amb17593338 [0,1,0,1,0,0|1,0,1]=4 9121 B9R1.37 CC1CC(=O)C(C)=C1C Amb25139953 [0,1,0,1,0,0|1,0,1]=4 9122 B9R1.37 CC1CC(=O)C(C)C1C Amb25829043 [0,1,0,1,0,0|1,0,0]=3 9123 B9R1.37 CC1OC(=O)C(=O)C1C Amb24360322 [0,1,0,1,0,0|0,0,1]=3 9124 B9R1.37 CC1OC(=O)C(Br)C1O Amb25695369 [0,1,0,1,0,0|1,0,0]=3 9125 B9R1.37 CC1OC(=O)C(C)=C1C Amb21926616 [0,1,0,1,0,0|0,0,2]=4 9126 B9R1.37 CC1OC(=O)C(C)C1=O Amb25347361 [0,1,0,1,0,0|1,0,1]=4 9127 B9R1.37 CC1OC(=O)C(F)C1=O Amb24736506 [0,1,0,1,0,0|1,0,1]=4 9128 B9R1.37 CC1OC(=O)C(N)C1=N Amb24580975 [0,1,0,1,0,0|1,0,1]=4 9129 B9R1.37 CC1OC(=O)C(N)C1O Amb25120313 [0,1,0,1,0,0|1,0,0]=3 9130 B9R1.37 CC1OC(=O)C(O)C1O Amb25137171 [0,1,0,1,0,0|1,0,0]=3 9131 B9R1.37 CC1OC(=O)N(C)C1O Amb24502365 [0,1,0,1,0,0|2,0,0]=4 9132 B9R1.37 CC=1C(C)OC(=O)C1N Amb24340138 [0,1,0,1,0,0|0,0,2]=4 9133 B9R1.37 CC=1C(O)C(=O)OC1C Amb24419290 [0,1,0,1,0,0|0,0,2]=4 9134 B9R1.37 CC=1[C@@H](C)OC(=O)C1N Amb24529118 [0,1,0,1,0,0|0,0,2]=4 9135 B9R1.37 C[C@@H]1C(=O)N[C@H](C)N1C Amb24610226 [0,1,0,1,0,0|2,0,0]=4 9136 B9R1.37 C[C@@H]1CC(=O)N(C)C1O Amb25078022 [0,1,0,1,0,0|2,0,0]=4 9137 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb22747095 [0,1,0,1,0,0|2,0,0]=4 9138 B9R1.37 C[C@@H]1CN(O)C(=O)[C@H]1N Amb24678122 [0,1,0,1,0,0|2,0,0]=4 9139 B9R1.37 C[C@@H]1OC(=O)C(O)C1O Amb24605729 [0,1,0,1,0,0|1,0,0]=3 9140 B9R1.37 C[C@@H]1OC(=O)[C@@H](O)[C@H]1O Amb25261892 [0,1,0,1,0,0|1,0,0]=3 9141 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@@H]1O Amb25327544 [0,1,0,1,0,0|1,0,0]=3 9142 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@H]1O Amb24714713 [0,1,0,1,0,0|1,0,0]=3 9143 B9R1.37 C[C@@H]1[C@@H](N)C(=O)O[C@H]1C Amb24575237 [0,1,0,1,0,0|0,0,0]=2 9144 B9R1.37 C[C@@H]1[C@@H](O)C(O)O[C@H]1C Amb25317570 [0,1,0,1,0,0|0,0,2]=4 9145 B9R1.37 C[C@@H]1[C@@H](O)[C@@H](C)OC1=O Amb24686935 [0,1,0,1,0,0|1,0,0]=3 9146 B9R1.37 C[C@@H]1[C@H](N)C(=O)O[C@@H]1C Amb24606913 [0,1,0,1,0,0|0,0,0]=2 9147 B9R1.37 C[C@@H]1[C@H](O)C(=O)O[C@@H]1C Amb24592551 [0,1,0,1,0,0|0,0,0]=2 9148 B9R1.37 C[C@@H]1[C@H](O)[C@@H](C)OC1=O Amb25343889 [0,1,0,1,0,0|1,0,0]=3 9149 B9R1.37 C[C@H]1C=C(O)C(=O)[C@@H]1C Amb24583035 [0,1,0,1,0,0|0,0,1]=3 9150 B9R1.37 C[C@H]1CN(O)C(=O)[C@@H]1N Amb24587752 [0,1,0,1,0,0|2,0,0]=4 9151 B9R1.37 C[C@H]1OC(=N)[C@H](O)[C@@H]1O Amb24515434 [0,1,0,1,0,0|2,0,0]=4 9152 B9R1.37 C[C@H]1OC(=O)C(=C)[C@@H]1O Amb25332246 [0,1,0,1,0,0|1,0,1]=4 9153 B9R1.37 C[C@H]1OC(=O)C(=O)C1C Amb24748953 [0,1,0,1,0,0|0,0,1]=3 9154 B9R1.37 C[C@H]1OC(=O)C(Br)[C@@H]1O Amb25179050 [0,1,0,1,0,0|1,0,0]=3 9155 B9R1.37 C[C@H]1OC(=O)C(O)C1O Amb24527858 [0,1,0,1,0,0|1,0,0]=3 9156 B9R1.37 C[C@H]1OC(=O)[C@@H](N)[C@@H]1O Amb24561377 [0,1,0,1,0,0|1,0,0]=3 9157 B9R1.37 C[C@H]1[C@@H](N)C(=O)O[C@@H]1C Amb25259190 [0,1,0,1,0,0|0,0,0]=2 9158 B9R1.37 C[C@H]1[C@@H](O)C(O)O[C@@H]1C Amb24576631 [0,1,0,1,0,0|0,0,2]=4 9159 B9R1.37 C[C@H]1[C@@H](O)[C@H](C)OC1=O Amb24520333 [0,1,0,1,0,0|1,0,0]=3 9160 B9R1.37 C[C@H]1[C@H](N)C(=O)OC1C Amb24585127 [0,1,0,1,0,0|0,0,0]=2 9161 B9R1.37 C[C@H]1[C@H](O)[C@@H](C)NC1=O Amb25203685 [0,1,0,1,0,0|2,0,0]=4 9162 B9R1.37 C[C@H]1[C@H](O)[C@@H](C)OC1=O Amb25235586 [0,1,0,1,0,0|1,0,0]=3 9163 B9R1.37 C[C@H]1[C@H](O)[C@H](C)OC1=O Amb25176668 [0,1,0,1,0,0|1,0,0]=3 9164 B9R1.37 OC1OC(=O)C(Br)C1Br Amb21811590 [0,1,0,1,0,0|2,0,0]=4 9165 B9R1.37 OC1OC(=O)C(O)C1O Amb24419120 [0,1,0,1,0,0|2,0,0]=4 9166 B9R1.41 C=C1CCCC1C(O)=O Amb18642417 [0,1,0,1,0,0|0,0,2]=4 9167 B9R1.41 CC(=O)C1=CCC[C@H]1C Amb25724215 [0,1,0,1,0,0|1,0,1]=4 9168 B9R1.41 CC(=O)C1CCCC1Br Amb24710867 [0,1,0,1,0,0|2,0,0]=4 9169 B9R1.41 CC(=O)C1CCCC1Cl Amb24063968 [0,1,0,1,0,0|2,0,0]=4 9170 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|2,0,0]=4 9171 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [0,1,0,1,0,0|2,0,0]=4 9172 B9R1.41 CC(=O)C1CSCC1O Amb25685933 [0,1,0,1,0,0|2,0,0]=4 9173 B9R1.41 CC(=O)[C@@H]1CSC[C@@H]1O Amb25046323 [0,1,0,1,0,0|2,0,0]=4 9174 B9R1.41 CC(=O)[C@@H]1CSC[C@H]1O Amb25110108 [0,1,0,1,0,0|2,0,0]=4 9175 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [0,1,0,1,0,0|2,0,0]=4 9176 B9R1.41 CC(=O)[C@H]1CSC[C@@H]1O Amb25174811 [0,1,0,1,0,0|2,0,0]=4 9177 B9R1.41 CC(=O)[C@H]1CSC[C@H]1O Amb24594984 [0,1,0,1,0,0|2,0,0]=4 9178 B9R1.41 CC(=O)[C@H]1OCC[C@@H]1Cl Amb25232993 [0,1,0,1,0,0|2,0,0]=4 9179 B9R1.41 CC1=CCSC1C(O)=O Amb25801334 [0,1,0,1,0,0|0,0,2]=4 9180 B9R1.41 CC1C=CCC1C(O)=O Amb25304598 [0,1,0,1,0,0|0,0,1]=3 9181 B9R1.41 CC1CCCC1C(=O)C Amb17593321 [0,1,0,1,0,0|1,0,0]=3 9182 B9R1.41 CC1CCCC1C(N)=O Amb24680775 [0,1,0,1,0,0|1,0,0]=3 9183 B9R1.41 CC1CCCC1[C@H](C)O Amb24738206 [0,1,0,1,0,0|1,0,1]=4 9184 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [0,1,0,1,0,0|2,0,0]=4 9185 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [0,1,0,1,0,0|0,0,0]=2 9186 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [0,1,0,1,0,0|0,0,0]=2 9187 B9R1.41 CC1CCOC1C(C)O Amb24332228 [0,1,0,1,0,0|1,0,1]=4 9188 B9R1.41 CC1CCOC1C(N)=O Amb25107757 [0,1,0,1,0,0|1,0,0]=3 9189 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [0,1,0,1,0,0|0,0,0]=2 9190 B9R1.41 CC1CNCC1C(C)=C Amb25124347 [0,1,0,1,0,0|2,0,0]=4 9191 B9R1.41 CC1COCC1C(O)=O Amb25326733 [0,1,0,1,0,0|0,0,0]=2 9192 B9R1.41 CC1NCCC1C(C)=O Amb24393053 [0,1,0,1,0,0|1,0,0]=3 9193 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [0,1,0,1,0,0|0,0,0]=2 9194 B9R1.41 CC1OCCC1C(=O)Cl Amb24334543 [0,1,0,1,0,0|1,0,0]=3 9195 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [0,1,0,1,0,0|0,0,0]=2 9196 B9R1.41 CC1OCNC1C(O)=O Amb24564435 [0,1,0,1,0,0|1,0,0]=3 9197 B9R1.41 CC1SC=NC1C(O)=O Amb24419416 [0,1,0,1,0,0|1,0,1]=4 9198 B9R1.41 CC1SCCC1C(C)=O Amb25218259 [0,1,0,1,0,0|1,0,0]=3 9199 B9R1.41 CC=1SCCC1C(O)=O Amb24750254 [0,1,0,1,0,0|0,0,2]=4 9200 B9R1.41 CN1CC=CC1C(=O)O Amb15701264 [0,1,0,1,0,0|1,0,1]=4 9201 B9R1.41 CN1CC=CC1C(O)=O Amb22587153 [0,1,0,1,0,0|1,0,1]=4 9202 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [0,1,0,1,0,0|2,0,0]=4 9203 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [0,1,0,1,0,0|2,0,0]=4 9204 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [0,1,0,1,0,0|1,0,0]=3 9205 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [0,1,0,1,0,0|1,0,0]=3 9206 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [0,1,0,1,0,0|1,0,0]=3 9207 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [0,1,0,1,0,0|1,0,0]=3 9208 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [0,1,0,1,0,0|1,0,0]=3 9209 B9R1.41 CN1CCN=C1C(O)=O Amb25352083 [0,1,0,1,0,0|1,0,1]=4 9210 B9R1.41 CN1CSCC1C(O)=O Amb19650934 [0,1,0,1,0,0|1,0,0]=3 9211 B9R1.41 CN1CSCC1C(O)=O Amb21959971 [0,1,0,1,0,0|1,0,0]=3 9212 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [0,1,0,1,0,0|1,0,0]=3 9213 B9R1.41 CN1CSC[C@H]1C(O)=O Amb22587250 [0,1,0,1,0,0|1,0,0]=3 9214 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|0,0,0]=2 9215 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|0,0,0]=2 9216 B9R1.41 C[C@@H]1CCC[C@H]1C(C)=O Amb24692616 [0,1,0,1,0,0|1,0,0]=3 9217 B9R1.41 C[C@@H]1CCC[C@H]1C(N)=O Amb24598612 [0,1,0,1,0,0|1,0,0]=3 9218 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [0,1,0,1,0,0|0,0,0]=2 9219 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [0,1,0,1,0,0|0,0,0]=2 9220 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|1,0,0]=3 9221 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [0,1,0,1,0,0|0,0,0]=2 9222 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [0,1,0,1,0,0|0,0,0]=2 9223 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [0,1,0,1,0,0|0,0,0]=2 9224 B9R1.41 C[C@@H]1SCN[C@@H]1C(O)=O Amb24514827 [0,1,0,1,0,0|1,0,0]=3 9225 B9R1.41 C[C@@H]1SCN[C@H]1C(O)=O Amb24670517 [0,1,0,1,0,0|1,0,0]=3 9226 B9R1.41 C[C@H]1C=CC[C@@H]1C(O)=O Amb25180008 [0,1,0,1,0,0|0,0,1]=3 9227 B9R1.41 C[C@H]1CCC[C@@H]1B(O)O Amb24566352 [0,1,0,1,0,0|1,0,1]=4 9228 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|0,0,0]=2 9229 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|0,0,0]=2 9230 B9R1.41 C[C@H]1CCN[C@@H]1C(N)=O Amb25174509 [0,1,0,1,0,0|1,0,0]=3 9231 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [0,1,0,1,0,0|0,0,0]=2 9232 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [0,1,0,1,0,0|0,0,0]=2 9233 B9R1.41 C[C@H]1COC[C@@H]1C(C)=O Amb24645383 [0,1,0,1,0,0|1,0,0]=3 9234 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [0,1,0,1,0,0|0,0,0]=2 9235 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [0,1,0,1,0,0|0,0,0]=2 9236 B9R1.41 C[C@H]1SCN[C@@H]1C(O)=O Amb24539832 [0,1,0,1,0,0|1,0,0]=3 9237 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [0,1,0,1,0,0|1,0,0]=3 9238 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|2,0,0]=4 9239 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|2,0,0]=4 9240 B9R1.41 NC(=O)[C@@H]1CCC[C@H]1O Amb24120348 [0,1,0,1,0,0|2,0,0]=4 9241 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|2,0,0]=4 9242 B9R1.41 NC(=O)[C@H]1CCC[C@@H]1O Amb24514485 [0,1,0,1,0,0|2,0,0]=4 9243 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|2,0,0]=4 9244 B9R1.41 NC1C=CCC1C(O)=O Amb22353819 [0,1,0,1,0,0|1,0,1]=4 9245 B9R1.41 NC1C=CCC1C(O)=O Amb25723511 [0,1,0,1,0,0|1,0,1]=4 9246 B9R1.41 NC1CCCC1C(N)=O Amb19148786 [0,1,0,1,0,0|2,0,0]=4 9247 B9R1.41 NC1CCN[C@@H]1C(O)=O Amb25032243 [0,1,0,1,0,0|1,0,0]=3 9248 B9R1.41 NC1CCSC1C(O)=O Amb25314364 [0,1,0,1,0,0|1,0,0]=3 9249 B9R1.41 NC1COCC1C(N)=O Amb25129487 [0,1,0,1,0,0|2,0,0]=4 9250 B9R1.41 NC1COCC1C(O)=O Amb24709230 [0,1,0,1,0,0|1,0,0]=3 9251 B9R1.41 NC1CSCC1C(O)=O Amb24457278 [0,1,0,1,0,0|1,0,0]=3 9252 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [0,1,0,1,0,0|1,0,0]=3 9253 B9R1.41 NN1CCCC1C(O)=O Amb18642792 [0,1,0,1,0,0|2,0,0]=4 9254 B9R1.41 NN1CCC[C@@H]1C(=O)O Amb10069459 [0,1,0,1,0,0|2,0,0]=4 9255 B9R1.41 N[C@@H]1C=CC[C@@H]1C(O)=O Amb25213056 [0,1,0,1,0,0|1,0,1]=4 9256 B9R1.41 N[C@@H]1CCC[C@H]1C(N)=O Amb25269871 [0,1,0,1,0,0|2,0,0]=4 9257 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [0,1,0,1,0,0|1,0,0]=3 9258 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [0,1,0,1,0,0|1,0,0]=3 9259 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=[ClH] Amb24627931 [0,1,0,1,0,0|2,0,0]=4 9260 B9R1.41 N[C@@H]1CCN[C@@H]1C(O)=O Amb19929517 [0,1,0,1,0,0|1,0,0]=3 9261 B9R1.41 N[C@@H]1CCS[C@H]1C(O)=O Amb24061395 [0,1,0,1,0,0|1,0,0]=3 9262 B9R1.41 N[C@@H]1CNC[C@@H]1C(O)=O Amb25685466 [0,1,0,1,0,0|1,0,0]=3 9263 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [0,1,0,1,0,0|1,0,0]=3 9264 B9R1.41 N[C@@H]1CSC[C@@H]1C(O)=O Amb25685470 [0,1,0,1,0,0|1,0,0]=3 9265 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [0,1,0,1,0,0|1,0,0]=3 9266 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [0,1,0,1,0,0|1,0,0]=3 9267 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [0,1,0,1,0,0|1,0,0]=3 9268 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|1,0,0]=3 9269 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|1,0,0]=3 9270 B9R1.41 N[C@H]1CCS[C@H]1C(O)=O Amb24061394 [0,1,0,1,0,0|1,0,0]=3 9271 B9R1.41 N[C@H]1CNC[C@H]1C(O)=O Amb24628081 [0,1,0,1,0,0|1,0,0]=3 9272 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [0,1,0,1,0,0|1,0,0]=3 9273 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [0,1,0,1,0,0|1,0,0]=3 9274 B9R1.41 OC(=O)C1=CCC[C@H]1O Amb25795408 [0,1,0,1,0,0|1,0,1]=4 9275 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [0,1,0,1,0,0|1,0,1]=4 9276 B9R1.41 OC(=O)C1CCCC1=S Amb25273371 [0,1,0,1,0,0|1,0,1]=4 9277 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [0,1,0,1,0,0|1,0,0]=3 9278 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,0,0]=3 9279 B9R1.41 OC(=O)C1CCCN1Cl Amb25291925 [0,1,0,1,0,0|2,0,0]=4 9280 B9R1.41 OC(=O)C1CCNC1=O Amb18642691 [0,1,0,1,0,0|1,0,1]=4 9281 B9R1.41 OC(=O)C1CCOC1=O Amb17593365 [0,1,0,1,0,0|1,0,1]=4 9282 B9R1.41 OC(=O)C1CSCC1=O Amb16230660 [0,1,0,1,0,0|1,0,1]=4 9283 B9R1.41 OC(=O)C1NCCC1=S Amb25147125 [0,1,0,1,0,0|1,0,1]=4 9284 B9R1.41 OC(=O)C1NCCC1Br Amb24694082 [0,1,0,1,0,0|1,0,0]=3 9285 B9R1.41 OC(=O)C1NCCC1Cl Amb25080543 [0,1,0,1,0,0|1,0,0]=3 9286 B9R1.41 OC(=O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|1,0,0]=3 9287 B9R1.41 OC(=O)C1NCCC1S Amb24556940 [0,1,0,1,0,0|1,0,0]=3 9288 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [0,1,0,1,0,0|1,0,0]=3 9289 B9R1.41 OC(=O)[C@@H]1CCCN1Br Amb24480123 [0,1,0,1,0,0|2,0,0]=4 9290 B9R1.41 OC(=O)[C@@H]1CSCC1=O Amb24182054 [0,1,0,1,0,0|1,0,1]=4 9291 B9R1.41 OC(=O)[C@H]1CCCN1F Amb24534439 [0,1,0,1,0,0|2,0,0]=4 9292 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [0,1,0,1,0,0|1,0,0]=3 9293 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [0,1,0,1,0,0|1,0,0]=3 9294 B9R1.41 OC(=O)[C@H]1NCCC1F Amb25312348 [0,1,0,1,0,0|1,0,0]=3 9295 B9R1.41 OC(=O)[C@H]1NCC[C@@H]1S Amb24548407 [0,1,0,1,0,0|1,0,0]=3 9296 B9R1.41 OC1CCCC1C(=O)Cl Amb24524192 [0,1,0,1,0,0|2,0,0]=4 9297 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 9298 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [0,1,0,1,0,0|1,0,0]=3 9299 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [0,1,0,1,0,0|1,0,0]=3 9300 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [0,1,0,1,0,0|1,0,0]=3 9301 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [0,1,0,1,0,0|1,0,0]=3 9302 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [0,1,0,1,0,0|1,0,0]=3 9303 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [0,1,0,1,0,0|1,0,0]=3 9304 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 9305 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [0,1,0,1,0,0|1,0,0]=3 9306 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [0,1,0,1,0,0|1,0,0]=3 9307 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [0,1,0,1,0,0|1,0,0]=3 9308 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [0,1,0,1,0,0|1,0,0]=3 9309 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [0,1,0,1,0,0|1,0,0]=3 9310 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [0,1,0,1,0,0|1,0,0]=3 9311 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [0,1,0,1,0,0|1,0,0]=3 9312 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [0,1,0,1,0,0|1,0,0]=3 9313 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [0,1,0,1,0,0|1,0,0]=3 9314 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [0,1,0,1,0,0|1,0,0]=3 9315 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [0,1,0,1,0,0|1,0,0]=3 9316 B9R1.45 C=C1CC1C(N)C(O)=O Amb24117258 [0,1,0,1,0,0|0,0,2]=4 9317 B9R1.45 CC(=O)C(=O)C1CC1C Amb25775771 [0,1,0,1,0,0|1,0,1]=4 9318 B9R1.45 CC(C1CC1C)C(C)=O Amb24529060 [0,1,0,1,0,0|1,0,0]=3 9319 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [0,1,0,1,0,0|0,0,0]=2 9320 B9R1.45 CC(C1OC1C)C(C)O Amb24685231 [0,1,0,1,0,0|1,0,1]=4 9321 B9R1.45 CC/1C\C1=C(\Cl)/C(O)=O Amb24340255 [0,1,0,1,0,0|0,0,2]=4 9322 B9R1.45 CC1CC1C(=O)C(O)=O Amb24760671 [0,1,0,1,0,0|0,0,1]=3 9323 B9R1.45 CC1CC1C(N)C(C)=C Amb24478683 [0,1,0,1,0,0|2,0,0]=4 9324 B9R1.45 CC1CC1C(O)C(C)=C Amb25300998 [0,1,0,1,0,0|2,0,0]=4 9325 B9R1.45 C[C@@H]([C@H]1O[C@H]1C)[C@H](C)O Amb25175538 [0,1,0,1,0,0|1,0,1]=4 9326 B9R1.45 C[C@H]([C@H]1O[C@H]1C)[C@@H](C)O Amb25215123 [0,1,0,1,0,0|1,0,1]=4 9327 B9R1.45 NC([C@H]1C[C@@H]1N)C(O)=O Amb25245366 [0,1,0,1,0,0|1,0,0]=3 9328 B9R1.81 CC1CCC1C(=O)CC Amb24614007 [0,1,0,1,0,0|1,0,0]=3 9329 B9R1.81 CC1CCC1C(=O)OC Amb25110041 [0,1,0,1,0,0|0,0,0]=2 9330 B9R1.81 CCC(=O)N1CCC1C Amb24466096 [0,1,0,1,0,0|2,0,0]=4 9331 B9R1.81 CN1CCC1C(=O)NN Amb25177619 [0,1,0,1,0,0|2,0,0]=4 9332 B9R1.81 CNC(=O)N1CCC1C Amb24502373 [0,1,0,1,0,0|2,0,0]=4 9333 B9R1.81 COC(=O)C1=CCC1C Amb25335471 [0,1,0,1,0,0|0,0,2]=4 9334 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,1,0,0|1,0,0]=3 9335 B9R1.81 COC(=O)C1CCC1O Amb24448430 [0,1,0,1,0,0|1,0,0]=3 9336 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,1,0,0|1,0,0]=3 9337 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,1,0,0|1,0,0]=3 9338 B9R1.81 COC(=O)[C@@H]1CC[C@H]1Cl Amb24635677 [0,1,0,1,0,0|1,0,0]=3 9339 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N Amb25261158 [0,1,0,1,0,0|1,0,0]=3 9340 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,1,0,0|1,0,0]=3 9341 B9R1.81 COC(=O)[C@H]1NC[C@H]1O Amb24573017 [0,1,0,1,0,0|2,0,0]=4 9342 B9R1.81 C[C@H]1CC[C@H]1C(=O)OC Amb24559896 [0,1,0,1,0,0|0,0,0]=2 9343 B9R1.93 C#CC1CC1(N)C(O)=O Amb23456002 [0,1,0,1,0,0|0,0,2]=4 9344 B9R1.93 C=C[C@@H]1C[C@]1(N)C(O)=O Amb22744970 [0,1,0,1,0,0|0,0,2]=4 9345 B9R1.93 C=C[C@H]1C[C@]1(N)C(O)=O Amb25105090 [0,1,0,1,0,0|0,0,2]=4 9346 B9R1.93 CC(=O)C1(Br)CC1CO Amb24593916 [0,1,0,1,0,0|2,0,0]=4 9347 B9R1.93 CC1(CC1CN)C(O)=O Amb24550226 [0,1,0,1,0,0|1,0,0]=3 9348 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [0,1,0,1,0,0|1,0,0]=3 9349 B9R1.93 CC1(OC1CO)C(O)=O Amb24746000 [0,1,0,1,0,0|2,0,0]=4 9350 B9R1.93 CCC1CC1(C)C(C)=O Amb24443160 [0,1,0,1,0,0|1,0,0]=3 9351 B9R1.93 CCC1CC1(N)C(O)=O Amb24655862 [0,1,0,1,0,0|0,0,0]=2 9352 B9R1.93 CCC1OC1(C)C(C)=O Amb25073390 [0,1,0,1,0,0|2,0,0]=4 9353 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [0,1,0,1,0,0|1,0,0]=3 9354 B9R1.93 CC[C@@H]1CC1(N)C(O)=O Amb25104706 [0,1,0,1,0,0|0,0,0]=2 9355 B9R1.93 CC[C@@H]1C[C@@]1(C)C(C)=O Amb24564910 [0,1,0,1,0,0|1,0,0]=3 9356 B9R1.93 CC[C@@H]1C[C@@]1(N)C(O)=O Amb23452849 [0,1,0,1,0,0|0,0,0]=2 9357 B9R1.93 CC[C@@H]1C[C@@]1(O)C(O)=O Amb25377855 [0,1,0,1,0,0|0,0,0]=2 9358 B9R1.93 CC[C@@H]1C[C@]1(N)C(O)=O Amb23452884 [0,1,0,1,0,0|0,0,0]=2 9359 B9R1.93 CC[C@@H]1O[C@@]1(C)C(C)=O Amb24760756 [0,1,0,1,0,0|2,0,0]=4 9360 B9R1.93 C[C@]1(C[C@@H]1CN)C(O)=O Amb25339704 [0,1,0,1,0,0|1,0,0]=3 9361 B9R1.93 NC1(CC1C=C)C(=O)O Amb10068409 [0,1,0,1,0,0|0,0,2]=4 9362 B9R1.93 NC1(CC1CO)C(O)=O Amb25828351 [0,1,0,1,0,0|1,0,0]=3 9363 B9R1.93 NC[C@@H]1C[C@@]1(N)C(O)=O Amb24763621 [0,1,0,1,0,0|1,0,0]=3 9364 B9R1.93 N[C@@]1(C[C@H]1CO)C(O)=O Amb25101898 [0,1,0,1,0,0|1,0,0]=3 9365 B9R1.93 N[C@]1(C[C@@H]1CO)C(O)=O Amb24581240 [0,1,0,1,0,0|1,0,0]=3 9366 B9R1.93 OC(=O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|1,0,0]=3 9367 B9R1.96 CC(=O)C1CCC1C#N Amb25188967 [0,1,0,1,0,0|1,0,1]=4 9368 B9R1.96 CC(=O)[C@H]1CC[C@@H]1C#N Amb25370614 [0,1,0,1,0,0|1,0,1]=4 9369 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,1,0,1,0,0|0,0,0]=2 9370 B9R1.96 CCN1CCC1C(O)=O Amb22011877 [0,1,0,1,0,0|1,0,0]=3 9371 B9R1.96 CCN1CC[C@@H]1C(O)=O Amb24634744 [0,1,0,1,0,0|1,0,0]=3 9372 B9R1.96 CCN1CC[C@H]1C(O)=O Amb25347394 [0,1,0,1,0,0|1,0,0]=3 9373 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [0,1,0,1,0,0|0,0,0]=2 9374 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [0,1,0,1,0,0|0,0,0]=2 9375 B9R1.96 C\C=C/1\CNC1C(O)=O Amb25338611 [0,1,0,1,0,0|0,0,2]=4 9376 B9R1.96 C\C=C\1/CN[C@@H]1C(O)=O Amb25075476 [0,1,0,1,0,0|0,0,2]=4 9377 B9R1.96 NC(=O)[C@@H]1CC[C@H]1C#N Amb25224355 [0,1,0,1,0,0|1,0,1]=4 9378 B9R1.96 NC(=O)[C@H]1CC[C@H]1C#N Amb25175059 [0,1,0,1,0,0|1,0,1]=4 9379 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [0,1,0,1,0,0|0,0,0]=2 9380 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [0,1,0,1,0,0|0,0,0]=2 9381 B9R1.96 O=NN1CC[C@H]1C(=O)O Amb17618565 [0,1,0,1,0,0|2,0,0]=4 9382 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,1,0,1,0,0|0,0,1]=3 9383 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|0,0,0]=2 9384 B9R1.96 OC(=O)C1CCN1N=O Amb24726882 [0,1,0,1,0,0|2,0,0]=4 9385 B9R1.96 OC(=O)[C@H]1CCN1N=O Amb24340220 [0,1,0,1,0,0|2,0,0]=4 9386 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,1,0,1,0,0|0,0,0]=2 9387 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [0,1,0,1,0,0|1,0,0]=3 9388 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,1,0,1,0,0|1,0,0]=3 9389 B9R1.96 [O-]C(=O)[C@H]1CC[C@H]1CO Amb25176734 [0,1,0,1,0,0|0,0,1]=3 9390 B9R1.110 CC(=C)C(N)C1CCC1 Amb25726126 [0,1,0,1,0,0|2,0,0]=4 9391 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,1,0,1,0,0|1,0,0]=3 9392 B9R1.110 CC(C(=O)O)C1CCC1 Amb17087517 [0,1,0,1,0,0|0,0,0]=2 9393 B9R1.110 CC(C(N)=O)N1CCC1 Amb25857238 [0,1,0,1,0,0|2,0,0]=4 9394 B9R1.110 CC(C(O)=O)N1CCC1 Amb24178905 [0,1,0,1,0,0|1,0,0]=3 9395 B9R1.110 CC(C1CCC1)C(C)O Amb24481851 [0,1,0,1,0,0|1,0,1]=4 9396 B9R1.110 CC(C1CCC1)C(N)=N Amb23590267 [0,1,0,1,0,0|2,0,0]=4 9397 B9R1.110 CC(C1CNC1)C(C)=O Amb24673466 [0,1,0,1,0,0|2,0,0]=4 9398 B9R1.110 CC(C1CSC1)C(O)=O Amb25200790 [0,1,0,1,0,0|1,0,0]=3 9399 B9R1.110 C[C@@H](C1CCC1)C(O)=O Amb22748271 [0,1,0,1,0,0|0,0,0]=2 9400 B9R1.110 C[C@@H](O)[C@@H](N)C1CCC1 Amb24514875 [0,1,0,1,0,0|1,0,1]=4 9401 B9R1.110 C[C@H](C1CCC1)C(O)=O Amb24360449 [0,1,0,1,0,0|0,0,0]=2 9402 B9R1.110 C[C@H](O)[C@H](N)C1CCC1 Amb25245251 [0,1,0,1,0,0|1,0,1]=4 9403 B9R1.110 NC(C1CCC1)C(O)=O Amb19149365 [0,1,0,1,0,0|0,0,0]=2 9404 B9R1.110 NC(C1CCC1)C(O)=O Amb21858491 [0,1,0,1,0,0|0,0,0]=2 9405 B9R1.110 NC(C1CCC1)P(O)=O Amb25721258 [0,1,0,1,0,0|1,0,0]=3 9406 B9R1.110 NC(C1CCO1)C(N)=O Amb25364480 [0,1,0,1,0,0|2,0,0]=4 9407 B9R1.110 NC(C1COC1)C(O)=O Amb22405987 [0,1,0,1,0,0|1,0,0]=3 9408 B9R1.110 NC(C1CSC1)C(N)=O Amb25287406 [0,1,0,1,0,0|2,0,0]=4 9409 B9R1.110 N[C@@H](C1CCC1)C(N)=O Amb24476623 [0,1,0,1,0,0|1,0,0]=3 9410 B9R1.110 N[C@@H](C1COC1)C(O)=O Amb22737551 [0,1,0,1,0,0|1,0,0]=3 9411 B9R1.110 N[C@H](C(O)=O)C=1CCC1 Amb25680165 [0,1,0,1,0,0|0,0,2]=4 9412 B9R1.110 N[C@H](C1COC1)C(O)=O Amb22737550 [0,1,0,1,0,0|1,0,0]=3 9413 B9R1.110 O=C(Cl)C(Br)C1CCC1 Amb24598080 [0,1,0,1,0,0|1,0,0]=3 9414 B9R1.110 O=C(Cl)C(Cl)C1CCC1 Amb25362548 [0,1,0,1,0,0|1,0,0]=3 9415 B9R1.110 OC(=O)C(=O)C1CCC1 Amb19958875 [0,1,0,1,0,0|0,0,1]=3 9416 B9R1.110 OC(=O)C(=O)N1CCC1 Amb22896654 [0,1,0,1,0,0|1,0,1]=4 9417 B9R1.110 OC(=O)C(Br)=C1CCC1 Amb25355576 [0,1,0,1,0,0|0,0,2]=4 9418 B9R1.110 OC(=O)C(F)=C1CCC1 Amb24432885 [0,1,0,1,0,0|0,0,2]=4 9419 B9R1.110 OC(=O)C(F)C1CNC1 Amb25110697 [0,1,0,1,0,0|1,0,0]=3 9420 B9R1.110 OC(C1CCC1)C(O)=O Amb24426901 [0,1,0,1,0,0|0,0,0]=2 9421 B9R1.110 OC(C1CNC1)C(O)=O Amb24339989 [0,1,0,1,0,0|1,0,0]=3 9422 B9R1.110 OC(C1CSC1)C(O)=O Amb24759238 [0,1,0,1,0,0|1,0,0]=3 9423 B9R1.111 CC(=O)C(O)C1(Br)CC1 Amb25739838 [0,1,0,1,0,0|2,0,0]=4 9424 B9R1.111 CC(C(C)=O)C1(C)CC1 Amb24736134 [0,1,0,1,0,0|1,0,0]=3 9425 B9R1.111 CC(C(C)=O)C1(Cl)CC1 Amb24380961 [0,1,0,1,0,0|2,0,0]=4 9426 B9R1.111 CC(C(C)=O)C1(O)CC1 Amb25162760 [0,1,0,1,0,0|2,0,0]=4 9427 B9R1.111 CC(C(O)=O)C1(C)CC1 Amb18832624 [0,1,0,1,0,0|0,0,0]=2 9428 B9R1.111 CC(C(O)=O)C1(N)CC1 Amb18832571 [0,1,0,1,0,0|1,0,0]=3 9429 B9R1.111 CC1(CC1)C(N)C(O)=O Amb25146159 [0,1,0,1,0,0|0,0,0]=2 9430 B9R1.111 CC1(CC1)[C@@H](N)C(O)=O Amb23439674 [0,1,0,1,0,0|0,0,0]=2 9431 B9R1.111 CC1(CO1)C(=O)C(O)=O Amb25803495 [0,1,0,1,0,0|1,0,1]=4 9432 B9R1.111 CC1(CO1)C(O)C(O)=O Amb24590009 [0,1,0,1,0,0|1,0,0]=3 9433 B9R1.111 C[C@]1(CO1)C(=O)C(O)=O Amb24681893 [0,1,0,1,0,0|1,0,1]=4 9434 B9R1.111 C[C@]1(CO1)[C@H](O)C(O)=O Amb25174908 [0,1,0,1,0,0|1,0,0]=3 9435 B9R1.111 N[C@@H](C(O)=O)C1(O)CC1 Amb22751391 [0,1,0,1,0,0|1,0,0]=3 9436 B9R1.111 N[C@H](C(O)=O)C1(O)CC1 Amb24117270 [0,1,0,1,0,0|1,0,0]=3 9437 B9R1.132 CC1C(CN=C1N)CC Amb25242752 [0,1,0,1,0,0|2,0,0]=4 9438 B9R1.132 CC1C(CNC1=O)CC Amb24395523 [0,1,0,1,0,0|1,0,0]=3 9439 B9R1.132 CC1C(CO)CNC1=O Amb25142911 [0,1,0,1,0,0|2,0,0]=4 9440 B9R1.132 CC1C(O)CCC1CC Amb25682024 [0,1,0,1,0,0|1,0,1]=4 9441 B9R1.132 CC1[C@@H](CO)CNC1=O Amb24724590 [0,1,0,1,0,0|2,0,0]=4 9442 B9R1.132 CCC1CCC(=O)C1=C Amb25348574 [0,1,0,1,0,0|1,0,1]=4 9443 B9R1.132 CCC1CCC(=O)C1Br Amb25363275 [0,1,0,1,0,0|1,0,0]=3 9444 B9R1.132 CCC1CCC(O)C1O Amb25780900 [0,1,0,1,0,0|1,0,1]=4 9445 B9R1.132 CCC1CNC(=O)C1N Amb25732553 [0,1,0,1,0,0|1,0,0]=3 9446 B9R1.132 CCC1CNC(=O)N1C Amb25834141 [0,1,0,1,0,0|2,0,0]=4 9447 B9R1.132 CC[C@@H]1CCC(=O)C1=C Amb25714242 [0,1,0,1,0,0|1,0,1]=4 9448 B9R1.132 CC[C@@H]1CNC(=O)[C@@H]1N Amb24603686 [0,1,0,1,0,0|1,0,0]=3 9449 B9R1.132 CC[C@@H]1COC(=O)N1C Amb25736752 [0,1,0,1,0,0|1,0,0]=3 9450 B9R1.132 CC[C@@H]1ONC(=O)[C@H]1N Amb25745431 [0,1,0,1,0,0|2,0,0]=4 9451 B9R1.132 CC[C@H]1CCC(=O)[C@H]1Br Amb25249103 [0,1,0,1,0,0|1,0,0]=3 9452 B9R1.132 CN1C(CO)COC1=O Amb22504497 [0,1,0,1,0,0|2,0,0]=4 9453 B9R1.132 CO[C@@H]1COC(=O)[C@@H]1O Amb24733177 [0,1,0,1,0,0|1,0,0]=3 9454 B9R1.132 C[C@H]1[C@@H](CCC1=O)CBr Amb24595759 [0,1,0,1,0,0|2,0,0]=4 9455 B9R1.132 C[C@H]1[C@@H](CCC1=O)CO Amb24582507 [0,1,0,1,0,0|2,0,0]=4 9456 B9R1.132 C[C@H]1[C@@H](CO)CNC1=O Amb25204711 [0,1,0,1,0,0|2,0,0]=4 9457 B9R1.132 N[C@H]1[C@H](CS)COC1=O Amb24715941 [0,1,0,1,0,0|1,0,0]=3 9458 B9R1.132 O=C1OCC(CCl)C1Cl Amb24653769 [0,1,0,1,0,0|1,0,0]=3 9459 B9R1.132 O[C@H]1[C@H](COC1=O)CO Amb24733237 [0,1,0,1,0,0|1,0,0]=3 9460 B9R1.141 CC(=O)[C@]1(C)[C@H](C)[C@@H]1C Amb25706911 [0,1,0,1,0,0|1,0,0]=3 9461 B9R1.141 CC1(C(C)C1C)C(N)=O Amb25825043 [0,1,0,1,0,0|1,0,0]=3 9462 B9R1.141 CC1(C(C)C1C)C(O)=O Amb24429202 [0,1,0,1,0,0|0,0,0]=2 9463 B9R1.141 CC1C(Br)C1(C)C(C)=O Amb24711571 [0,1,0,1,0,0|2,0,0]=4 9464 B9R1.141 CC1C(Br)C1(C)C(O)=O Amb24663119 [0,1,0,1,0,0|1,0,0]=3 9465 B9R1.141 CC1C(C)C1(N)C(O)=O Amb24366699 [0,1,0,1,0,0|0,0,0]=2 9466 B9R1.141 CC1C(Cl)C1(C)C(C)=O Amb25350446 [0,1,0,1,0,0|2,0,0]=4 9467 B9R1.141 C[C@@H]1[C@@H](C)C1(N)C(O)=O Amb24618306 [0,1,0,1,0,0|0,0,0]=2 9468 B9R1.141 C[C@@H]1[C@@H](Cl)[C@@]1(C)C(C)=O Amb25326688 [0,1,0,1,0,0|2,0,0]=4 9469 B9R1.141 C[C@@H]1[C@H](C)[C@@]1(N)C(O)=O Amb25859080 [0,1,0,1,0,0|0,0,0]=2 9470 B9R1.141 C[C@@H]1[C@H](C)[C@]1(N)C(O)=O Amb24402011 [0,1,0,1,0,0|0,0,0]=2 9471 B9R1.141 C[C@H]1[C@@H](Br)[C@]1(C)C(C)=O Amb25242457 [0,1,0,1,0,0|2,0,0]=4 9472 B9R1.141 C[C@H]1[C@H](C)C1(N)C(O)=O Amb25243123 [0,1,0,1,0,0|0,0,0]=2 9473 B9R1.159 CC1CCC1(N)C(N)=O Amb24391671 [0,1,0,1,0,0|1,0,0]=3 9474 B9R1.159 CC1CCC1(N)C(O)=O Amb23456072 [0,1,0,1,0,0|0,0,0]=2 9475 B9R1.159 C[C@@H]1CC[C@]1(N)C(O)=O Amb24586126 [0,1,0,1,0,0|0,0,0]=2 9476 B9R1.159 C[C@H]1CC[C@@]1(C)C(O)=O Amb24575030 [0,1,0,1,0,0|0,0,0]=2 9477 B9R1.159 NC1(CCC1F)C(O)=O Amb25223441 [0,1,0,1,0,0|1,0,0]=3 9478 B9R1.159 N[C@@H]1CC[C@]1(N)C(O)=O Amb25233319 [0,1,0,1,0,0|1,0,0]=3 9479 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [0,1,0,1,0,0|1,0,0]=3 9480 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [0,1,0,1,0,0|1,0,0]=3 9481 B9R1.199 CC1C(C)CC1(O)C=C Amb25342389 [0,1,0,1,0,0|1,0,1]=4 9482 B9R1.199 CC1C(C)CC1(O)CN Amb24623144 [0,1,0,1,0,0|1,0,1]=4 9483 B9R1.199 CCC1(C)OC(=O)C1Cl Amb24753405 [0,1,0,1,0,0|0,0,0]=2 9484 B9R1.199 CC[C@@]1(C)OC(=O)[C@@H]1Cl Amb25242419 [0,1,0,1,0,0|0,0,0]=2 9485 B9R1.7 C#CCC1CC(=O)CC1 Amb25343081 [0,1,0,1,0,0|1,0,1]=4 9486 B9R1.7 C#CC[C@@H]1COC(=O)N1 Amb25809399 [0,1,0,1,0,0|1,0,1]=4 9487 B9R1.7 C=C1CC(CCO)CC1 Amb24575578 [0,1,0,1,0,0|2,0,0]=4 9488 B9R1.7 C=CCC1CNC(=O)C1 Amb25694415 [0,1,0,1,0,0|1,0,1]=4 9489 B9R1.7 C=CCC1COC(=O)N1 Amb24532876 [0,1,0,1,0,0|1,0,1]=4 9490 B9R1.7 C=CC[C@@H]1CC(=O)CC1 Amb25358940 [0,1,0,1,0,0|1,0,1]=4 9491 B9R1.7 C=CC[C@@H]1COC(=O)N1 Amb25329003 [0,1,0,1,0,0|1,0,1]=4 9492 B9R1.7 C=CC[C@H]1CC(=O)CC1 Amb24613923 [0,1,0,1,0,0|1,0,1]=4 9493 B9R1.7 CC1CC(CNC)CO1 Amb25742425 [0,1,0,1,0,0|1,0,1]=4 9494 B9R1.7 CCCC1CC(=O)C=C1 Amb25768578 [0,1,0,1,0,0|1,0,1]=4 9495 B9R1.7 CCCC1CC(=O)CC1 Amb24087435 [0,1,0,1,0,0|1,0,0]=3 9496 B9R1.7 CCCC1CCC(=O)N1 Amb17940083 [0,1,0,1,0,0|2,0,0]=4 9497 B9R1.7 CCCC1CCC(O)C1 Amb24554977 [0,1,0,1,0,0|1,0,1]=4 9498 B9R1.7 CCCC1CNC(=N)C1 Amb24410446 [0,1,0,1,0,0|2,0,0]=4 9499 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [0,1,0,1,0,0|1,0,0]=3 9500 B9R1.7 CCCC1COC(N)=N1 Amb24750095 [0,1,0,1,0,0|2,0,0]=4 9501 B9R1.7 CCCC=1CC(=O)ON1 Amb24581199 [0,1,0,1,0,0|1,0,1]=4 9502 B9R1.7 CCC[C@@H]1CC(=O)CC1 Amb25802135 [0,1,0,1,0,0|1,0,0]=3 9503 B9R1.7 CCC[C@@H]1CCC(=O)N1 Amb25824143 [0,1,0,1,0,0|2,0,0]=4 9504 B9R1.7 CCC[C@H]1CC(=O)C=C1 Amb24620152 [0,1,0,1,0,0|1,0,1]=4 9505 B9R1.7 CCC[C@H]1CC(=O)CC1 Amb25298534 [0,1,0,1,0,0|1,0,0]=3 9506 B9R1.7 CCC[C@H]1CCC(=O)N1 Amb24477475 [0,1,0,1,0,0|2,0,0]=4 9507 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [0,1,0,1,0,0|1,0,0]=3 9508 B9R1.7 CCC[C@H]1CNC(=O)S1 Amb25698617 [0,1,0,1,0,0|2,0,0]=4 9509 B9R1.7 CCNC=1COC(=O)C1 Amb24476774 [0,1,0,1,0,0|0,0,2]=4 9510 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,1,0,1,0,0|2,0,0]=4 9511 B9R1.7 CCOC1CCC(O)C1 Amb24642566 [0,1,0,1,0,0|1,0,1]=4 9512 B9R1.7 CCOC=1COC(=O)C1 Amb25760072 [0,1,0,1,0,0|0,0,2]=4 9513 B9R1.7 CCO[C@@H]1CC[C@H](O)C1 Amb25175111 [0,1,0,1,0,0|1,0,1]=4 9514 B9R1.7 CNCC1CCC(=O)N1 Amb2372617 [0,1,0,1,0,0|2,0,0]=4 9515 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [0,1,0,1,0,0|2,0,0]=4 9516 B9R1.7 CNCC1COC(=O)N1 Amb25115897 [0,1,0,1,0,0|1,0,0]=3 9517 B9R1.7 CNC[C@H]1CNC(=O)O1 Amb25199568 [0,1,0,1,0,0|2,0,0]=4 9518 B9R1.7 COCC1CCC(=O)N1 Amb24713685 [0,1,0,1,0,0|2,0,0]=4 9519 B9R1.7 COCC1CCC(O)C1 Amb25692823 [0,1,0,1,0,0|1,0,1]=4 9520 B9R1.7 COCC1CNC(=O)C1 Amb25693762 [0,1,0,1,0,0|1,0,0]=3 9521 B9R1.7 COCC=1CC(=O)ON1 Amb24420035 [0,1,0,1,0,0|1,0,1]=4 9522 B9R1.7 COC[C@@H]1CCC(=O)N1 Amb25145589 [0,1,0,1,0,0|2,0,0]=4 9523 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [0,1,0,1,0,0|2,0,0]=4 9524 B9R1.7 COC[C@@H]1COC(=O)N1 Amb24381462 [0,1,0,1,0,0|1,0,0]=3 9525 B9R1.7 COC[C@@H]1COC(=O)O1 Amb22366849 [0,1,0,1,0,0|1,0,0]=3 9526 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [0,1,0,1,0,0|2,0,0]=4 9527 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [0,1,0,1,0,0|1,0,0]=3 9528 B9R1.7 CSCC1COC(=O)N1 Amb25304404 [0,1,0,1,0,0|1,0,0]=3 9529 B9R1.7 C\C=C/[C@@H]1CCC(=O)C1 Amb25319155 [0,1,0,1,0,0|1,0,1]=4 9530 B9R1.7 C\C=C/[C@H]1CCC(=O)C1 Amb24646663 [0,1,0,1,0,0|1,0,1]=4 9531 B9R1.7 C\C=C\C1CNC(=O)C1 Amb25278424 [0,1,0,1,0,0|1,0,1]=4 9532 B9R1.7 N#CCC1CC(=O)CC1 Amb25091467 [0,1,0,1,0,0|1,0,1]=4 9533 B9R1.7 N#CCC1COC(=O)N1 Amb24353276 [0,1,0,1,0,0|1,0,1]=4 9534 B9R1.7 N#CC[C@@H]1CC(=O)CC1 Amb24447318 [0,1,0,1,0,0|1,0,1]=4 9535 B9R1.7 NCCC1CC(=O)CC1 Amb24409510 [0,1,0,1,0,0|1,0,0]=3 9536 B9R1.7 NCCC1CCC(=O)N1 Amb18832609 [0,1,0,1,0,0|2,0,0]=4 9537 B9R1.7 NCCC1CCC(=O)O1 Amb25146052 [0,1,0,1,0,0|2,0,0]=4 9538 B9R1.7 NCCC1CNC(=O)C1 Amb18832612 [0,1,0,1,0,0|1,0,0]=3 9539 B9R1.7 NCCC1COC(=O)N1 Amb24732121 [0,1,0,1,0,0|1,0,0]=3 9540 B9R1.7 NCCC1COC(=O)O1 Amb24746673 [0,1,0,1,0,0|1,0,0]=3 9541 B9R1.7 NCCC=1CC(=O)ON1 Amb18832636 [0,1,0,1,0,0|1,0,1]=4 9542 B9R1.7 NCC[C@@H]1CC[C@@H](O)C1 Amb17933186 [0,1,0,1,0,0|1,0,1]=4 9543 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|1,0,1]=4 9544 B9R1.7 NCC[C@H]1CCC(=O)N1 Amb24616850 [0,1,0,1,0,0|2,0,0]=4 9545 B9R1.7 O=C1CC(CO1)N=C=S Amb25776098 [0,1,0,1,0,0|1,0,1]=4 9546 B9R1.7 O=C1CCC(CCBr)N1 Amb25059535 [0,1,0,1,0,0|2,0,0]=4 9547 B9R1.7 O=C1CCC(CCCl)O1 Amb24459566 [0,1,0,1,0,0|2,0,0]=4 9548 B9R1.7 O=C1CN(CCF)CC1 Amb24685571 [0,1,0,1,0,0|2,0,0]=4 9549 B9R1.7 O=C1NCC(CCCl)O1 Amb25145966 [0,1,0,1,0,0|2,0,0]=4 9550 B9R1.7 O=CCC1CC(=O)CC1 Amb18642410 [0,1,0,1,0,0|1,0,1]=4 9551 B9R1.7 O=CCC1COC(=O)C1 Amb24633507 [0,1,0,1,0,0|0,0,1]=3 9552 B9R1.7 O=CCC1COC(=O)N1 Amb18642692 [0,1,0,1,0,0|1,0,1]=4 9553 B9R1.7 O=CC[C@@H]1COC(=O)N1 Amb24524150 [0,1,0,1,0,0|1,0,1]=4 9554 B9R1.7 OCCC1CC(=O)CC1 Amb24467811 [0,1,0,1,0,0|1,0,0]=3 9555 B9R1.7 OCCC1CC(=O)CN1 Amb24574037 [0,1,0,1,0,0|2,0,0]=4 9556 B9R1.7 OCCC1CC(=O)NN1 Amb24070734 [0,1,0,1,0,0|2,0,0]=4 9557 B9R1.7 OCCC1CCC(=O)O1 Amb25188957 [0,1,0,1,0,0|2,0,0]=4 9558 B9R1.7 OCCC1CNC(=O)C1 Amb23598230 [0,1,0,1,0,0|1,0,0]=3 9559 B9R1.7 OCCC1CNC(=O)O1 Amb24604919 [0,1,0,1,0,0|2,0,0]=4 9560 B9R1.7 OCCC1COC(=O)C1 Amb24577239 [0,1,0,1,0,0|0,0,0]=2 9561 B9R1.7 OCCC1COC(=O)N1 Amb24477775 [0,1,0,1,0,0|1,0,0]=3 9562 B9R1.7 OCC[C@@H]1CC(=O)CC1 Amb24750224 [0,1,0,1,0,0|1,0,0]=3 9563 B9R1.7 OCC[C@@H]1CCC(=O)N1 Amb24761403 [0,1,0,1,0,0|2,0,0]=4 9564 B9R1.7 OCC[C@@H]1CNC(=O)O1 Amb25340109 [0,1,0,1,0,0|2,0,0]=4 9565 B9R1.7 OCC[C@@H]1COC(=O)N1 Amb25354215 [0,1,0,1,0,0|1,0,0]=3 9566 B9R1.7 OCC[C@H]1CCC(=O)O1 Amb24397212 [0,1,0,1,0,0|2,0,0]=4 9567 B9R1.7 OCC[C@H]1COC(=O)C1 Amb25740657 [0,1,0,1,0,0|0,0,0]=2 9568 B9R1.7 OCC[C@H]1COC(=O)N1 Amb24649331 [0,1,0,1,0,0|1,0,0]=3 9569 B9R1.7 O[C@@H]1CC[C@H](C1)CCO Amb24719687 [0,1,0,1,0,0|1,0,1]=4 9570 B9R1.7 [N-]=[N+]=NC1COC(=O)C1 Amb25804104 [0,1,0,1,0,0|2,0,0]=4 9571 B9R1.13 CC(=C)CC1CCCC1 Amb22052678 [0,1,0,1,0,0|2,0,0]=4 9572 B9R1.13 CC(=C)CC1CCCN1 Amb25162820 [0,1,0,1,0,0|2,0,0]=4 9573 B9R1.13 CC(=O)CC1CC=CC1 Amb25337514 [0,1,0,1,0,0|1,0,1]=4 9574 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [0,1,0,1,0,0|1,0,0]=3 9575 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|1,0,0]=3 9576 B9R1.13 CC(=O)CC1COCC1 Amb20622791 [0,1,0,1,0,0|1,0,0]=3 9577 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|2,0,0]=4 9578 B9R1.13 CC(=O)CC=1CCCN1 Amb24659155 [0,1,0,1,0,0|1,0,1]=4 9579 B9R1.13 CC(=O)C[C@@H]1CCC=C1 Amb25358818 [0,1,0,1,0,0|1,0,1]=4 9580 B9R1.13 CC(=O)C[C@@H]1CCCN1 Amb24709255 [0,1,0,1,0,0|1,0,0]=3 9581 B9R1.13 CC(=O)C[C@H]1CCC=C1 Amb24380779 [0,1,0,1,0,0|1,0,1]=4 9582 B9R1.13 CC(=O)C[C@H]1CCCO1 Amb24752778 [0,1,0,1,0,0|1,0,0]=3 9583 B9R1.13 CC(=O)NC1COCC1 Amb25185374 [0,1,0,1,0,0|2,0,0]=4 9584 B9R1.13 CC(=O)N[C@@H]1CCCN1 Amb25848370 [0,1,0,1,0,0|2,0,0]=4 9585 B9R1.13 CC(=O)N[C@@H]1CNCC1 Amb22744974 [0,1,0,1,0,0|2,0,0]=4 9586 B9R1.13 CC(=O)N[C@H]1CNCC1 Amb10067002 [0,1,0,1,0,0|2,0,0]=4 9587 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,1,0,1,0,0|2,0,0]=4 9588 B9R1.13 CC(=O)OC1CCCS1 Amb24402377 [0,1,0,1,0,0|2,0,0]=4 9589 B9R1.13 CC(=O)OC1CNCC1 Amb21956160 [0,1,0,1,0,0|2,0,0]=4 9590 B9R1.13 CC(=O)OC1CNCC1 Amb22011811 [0,1,0,1,0,0|2,0,0]=4 9591 B9R1.13 CC(=O)OC1COCC1 Amb25052014 [0,1,0,1,0,0|2,0,0]=4 9592 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [0,1,0,1,0,0|2,0,0]=4 9593 B9R1.13 CC(=O)SC1CNCC1 Amb25146202 [0,1,0,1,0,0|2,0,0]=4 9594 B9R1.13 CC(=O)SC1COCC1 Amb13892074 [0,1,0,1,0,0|2,0,0]=4 9595 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|1,0,1]=4 9596 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|1,0,1]=4 9597 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [0,1,0,1,0,0|1,0,1]=4 9598 B9R1.13 CS(=O)CC1CCCN1 Amb25772181 [0,1,0,1,0,0|2,0,0]=4 9599 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|1,0,1]=4 9600 B9R1.13 C[C@H](O)C[C@@H]1CCCO1 Amb25176662 [0,1,0,1,0,0|1,0,1]=4 9601 B9R1.13 ClC(=O)CN1CCCC1 Amb17142871 [0,1,0,1,0,0|2,0,0]=4 9602 B9R1.13 ClC(=O)OC1CCCC1 Amb10070029 [0,1,0,1,0,0|2,0,0]=4 9603 B9R1.13 NC(=N)CC1CNCC1 Amb24566322 [0,1,0,1,0,0|2,0,0]=4 9604 B9R1.13 NC(=N)CC1COCC1 Amb25132816 [0,1,0,1,0,0|2,0,0]=4 9605 B9R1.13 NC(=O)CC1CCC=C1 Amb16233726 [0,1,0,1,0,0|1,0,1]=4 9606 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [0,1,0,1,0,0|1,0,0]=3 9607 B9R1.13 NC(=O)CC1COCC1 Amb25228942 [0,1,0,1,0,0|1,0,0]=3 9608 B9R1.13 NC(=O)CC1NCCS1 Amb25308974 [0,1,0,1,0,0|2,0,0]=4 9609 B9R1.13 NC(=O)CC=1CCCC1 Amb24384197 [0,1,0,1,0,0|1,0,1]=4 9610 B9R1.13 NC(=O)CN1CCCC1 Amb10671440 [0,1,0,1,0,0|2,0,0]=4 9611 B9R1.13 NC(=O)CN1CCCC1 Amb19387226 [0,1,0,1,0,0|2,0,0]=4 9612 B9R1.13 NC(=O)C[C@@H]1CCCN1 Amb24583408 [0,1,0,1,0,0|1,0,0]=3 9613 B9R1.13 NC(=O)C[C@H]1CNCC1 Amb25724831 [0,1,0,1,0,0|1,0,0]=3 9614 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [0,1,0,1,0,0|2,0,0]=4 9615 B9R1.13 NC(=O)NC1CSCC1 Amb24612307 [0,1,0,1,0,0|2,0,0]=4 9616 B9R1.13 NC(=O)OC1CNCC1 Amb23598229 [0,1,0,1,0,0|2,0,0]=4 9617 B9R1.13 NC(=O)OC1COCC1 Amb25141917 [0,1,0,1,0,0|2,0,0]=4 9618 B9R1.13 NC(=O)O[C@H]1CNCC1 Amb25267939 [0,1,0,1,0,0|2,0,0]=4 9619 B9R1.13 O=C(Cl)CC1CCC=C1 Amb24754210 [0,1,0,1,0,0|1,0,1]=4 9620 B9R1.13 O=C(Cl)CC1COCC1 Amb22642272 [0,1,0,1,0,0|1,0,0]=3 9621 B9R1.13 O=C(Cl)CN1CCCC1 Amb18364315 [0,1,0,1,0,0|2,0,0]=4 9622 B9R1.13 O=C(Cl)OC1CCCO1 Amb24760352 [0,1,0,1,0,0|2,0,0]=4 9623 B9R1.13 O=C(Cl)OC1COCC1 Amb22642258 [0,1,0,1,0,0|2,0,0]=4 9624 B9R1.13 O=C(Cl)O[C@@H]1CCCO1 Amb24638442 [0,1,0,1,0,0|2,0,0]=4 9625 B9R1.13 O=C(F)NC1CCCC1 Amb25711539 [0,1,0,1,0,0|2,0,0]=4 9626 B9R1.13 OB(O)CC1CCCC1 Amb25320686 [0,1,0,1,0,0|1,0,1]=4 9627 B9R1.13 OB(O)C[C@@H]1CCCN1 Amb24670511 [0,1,0,1,0,0|1,0,1]=4 9628 B9R1.13 OC(=O)CC1=CCCO1 Amb24639240 [0,1,0,1,0,0|0,0,2]=4 9629 B9R1.13 OC(=O)CC1CC=CC1 Amb25673915 [0,1,0,1,0,0|0,0,1]=3 9630 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|0,0,0]=2 9631 B9R1.13 OC(=O)CC1CCCN1 Amb20668514 [0,1,0,1,0,0|0,0,0]=2 9632 B9R1.13 OC(=O)CC1CCCO1 Amb1088908 [0,1,0,1,0,0|0,0,0]=2 9633 B9R1.13 OC(=O)CC1CCCS1 Amb18644290 [0,1,0,1,0,0|0,0,0]=2 9634 B9R1.13 OC(=O)CC1CCNO1 Amb25261098 [0,1,0,1,0,0|1,0,0]=3 9635 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [0,1,0,1,0,0|0,0,0]=2 9636 B9R1.13 OC(=O)CC1NCCS1 Amb18644340 [0,1,0,1,0,0|1,0,0]=3 9637 B9R1.13 OC(=O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|1,0,0]=3 9638 B9R1.13 OC(=O)CC1SCCS1 Amb25361118 [0,1,0,1,0,0|1,0,0]=3 9639 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [0,1,0,1,0,0|0,0,1]=3 9640 B9R1.13 OC(=O)CC=1CCOC1 Amb23538473 [0,1,0,1,0,0|0,0,2]=4 9641 B9R1.13 OC(=O)CN1CC=CC1 Amb24360179 [0,1,0,1,0,0|1,0,1]=4 9642 B9R1.13 OC(=O)C[C@@H]1CCCN1 Amb13891876 [0,1,0,1,0,0|0,0,0]=2 9643 B9R1.13 OC(=O)C[C@@H]1CCCO1 Amb24271115 [0,1,0,1,0,0|0,0,0]=2 9644 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [0,1,0,1,0,0|0,0,0]=2 9645 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [0,1,0,1,0,0|0,0,1]=3 9646 B9R1.13 OC(=O)C[C@H]1CCCN1 Amb16184011 [0,1,0,1,0,0|0,0,0]=2 9647 B9R1.13 OC(=O)C[C@H]1CCCO1 Amb24271109 [0,1,0,1,0,0|0,0,0]=2 9648 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [0,1,0,1,0,0|0,0,0]=2 9649 B9R1.13 OC(=O)NN1CCCC1 Amb24082039 [0,1,0,1,0,0|2,0,0]=4 9650 B9R1.13 OC(=O)\C=C/1\CCNC1 Amb21953701 [0,1,0,1,0,0|0,0,2]=4 9651 B9R1.13 OC(=O)\C=C\1/CCNC1 Amb24538554 [0,1,0,1,0,0|0,0,2]=4 9652 B9R1.13 [O-][N+](=O)CC1CNCC1 Amb18203199 [0,1,0,1,0,0|1,0,1]=4 9653 B9R1.22 C=CC1OC(=O)CC1O Amb24648262 [0,1,0,1,0,0|1,0,1]=4 9654 B9R1.22 C=C[C@@H]1OC(=O)C[C@@H]1O Amb24630773 [0,1,0,1,0,0|1,0,1]=4 9655 B9R1.22 C=C[C@H]1OC(=O)C[C@H]1O Amb24613503 [0,1,0,1,0,0|1,0,1]=4 9656 B9R1.22 CC1=CC(=O)CC1CC Amb24686502 [0,1,0,1,0,0|1,0,0]=3 9657 B9R1.22 CC1=CC(=O)OC1CO Amb25116791 [0,1,0,1,0,0|0,0,2]=4 9658 B9R1.22 CC1=CC(=O)O[C@@H]1CO Amb25830656 [0,1,0,1,0,0|0,0,2]=4 9659 B9R1.22 CC1CC(=C)OC1CO Amb25220526 [0,1,0,1,0,0|1,0,0]=3 9660 B9R1.22 CC1CC(=O)CC1CC Amb25032178 [0,1,0,1,0,0|1,0,0]=3 9661 B9R1.22 CC1CC(=O)CC1OC Amb24364094 [0,1,0,1,0,0|1,0,0]=3 9662 B9R1.22 CC1CC(=O)NC1C#N Amb18642194 [0,1,0,1,0,0|1,0,1]=4 9663 B9R1.22 CC1CC(=O)NC1CC Amb24578188 [0,1,0,1,0,0|1,0,0]=3 9664 B9R1.22 CC1CC(=O)OC1CBr Amb25240937 [0,1,0,1,0,0|0,0,0]=2 9665 B9R1.22 CC1CC(=O)OC1CCl Amb24480344 [0,1,0,1,0,0|0,0,0]=2 9666 B9R1.22 CC1CC(=O)OC1CN Amb25300550 [0,1,0,1,0,0|0,0,0]=2 9667 B9R1.22 CC1CC(=O)O[C@@H]1CN Amb25222804 [0,1,0,1,0,0|0,0,0]=2 9668 B9R1.22 CC1CC(CC)C(O)O1 Amb25065208 [0,1,0,1,0,0|1,0,1]=4 9669 B9R1.22 CC1CC(O)CN1CC Amb23453943 [0,1,0,1,0,0|1,0,1]=4 9670 B9R1.22 CC1NC(=N)CC1CC Amb25340640 [0,1,0,1,0,0|2,0,0]=4 9671 B9R1.22 CC1NC(=N)OC1CC Amb25779190 [0,1,0,1,0,0|2,0,0]=4 9672 B9R1.22 CC1NC(=O)CC1CO Amb24670468 [0,1,0,1,0,0|1,0,0]=3 9673 B9R1.22 CC1NC(=O)OC1CC Amb25679025 [0,1,0,1,0,0|1,0,0]=3 9674 B9R1.22 CC1OC(=N)NC1CC Amb25139446 [0,1,0,1,0,0|2,0,0]=4 9675 B9R1.22 CC1OC(=O)CC1CO Amb25110752 [0,1,0,1,0,0|0,0,0]=2 9676 B9R1.22 CC1OC(=O)CC1NC Amb24476703 [0,1,0,1,0,0|0,0,0]=2 9677 B9R1.22 CC1OC(=O)NC1CBr Amb25784059 [0,1,0,1,0,0|1,0,0]=3 9678 B9R1.22 CC1OC(=O)NC1OC Amb24383631 [0,1,0,1,0,0|1,0,0]=3 9679 B9R1.22 CC1OC(C)CC1CO Amb25286847 [0,1,0,1,0,0|1,0,1]=4 9680 B9R1.22 CC1OC(C)CC1NC Amb25204035 [0,1,0,1,0,0|1,0,1]=4 9681 B9R1.22 CCC1=CC(=O)CC1C Amb24597151 [0,1,0,1,0,0|1,0,0]=3 9682 B9R1.22 CCC1=CC(=O)OC1O Amb25221620 [0,1,0,1,0,0|0,0,2]=4 9683 B9R1.22 CCC1CC(=O)CC1O Amb25237318 [0,1,0,1,0,0|1,0,0]=3 9684 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,1,0,1,0,0|1,0,1]=4 9685 B9R1.22 CCC1CC(=O)NN1C Amb24598970 [0,1,0,1,0,0|1,0,0]=3 9686 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [0,1,0,1,0,0|0,0,1]=3 9687 B9R1.22 CCC1CC(O)CN1C Amb23453955 [0,1,0,1,0,0|1,0,1]=4 9688 B9R1.22 CCC1NC(=O)OC1=O Amb25127713 [0,1,0,1,0,0|1,0,1]=4 9689 B9R1.22 CCC1OC(=O)CC1O Amb25788884 [0,1,0,1,0,0|1,0,0]=3 9690 B9R1.22 CCN1N=C(N)CC1C Amb25095672 [0,1,0,1,0,0|2,0,0]=4 9691 B9R1.22 CCN1NC(=O)CC1C Amb24473638 [0,1,0,1,0,0|1,0,0]=3 9692 B9R1.22 CC[C@@H]1CC(=O)C[C@H]1O Amb24534308 [0,1,0,1,0,0|1,0,0]=3 9693 B9R1.22 CC[C@@H]1NC(=O)C[C@@H]1N Amb25240439 [0,1,0,1,0,0|2,0,0]=4 9694 B9R1.22 CC[C@@H]1NC(=O)C[C@@H]1O Amb25258693 [0,1,0,1,0,0|2,0,0]=4 9695 B9R1.22 CC[C@@H]1NC(=O)C[C@H]1O Amb24513054 [0,1,0,1,0,0|2,0,0]=4 9696 B9R1.22 CC[C@@H]1OC(=O)C[C@H]1Br Amb25362262 [0,1,0,1,0,0|1,0,0]=3 9697 B9R1.22 CC[C@H]1CC(=O)C[C@H]1O Amb24575930 [0,1,0,1,0,0|1,0,0]=3 9698 B9R1.22 CC[C@H]1CC(=O)NC1=O Amb24606518 [0,1,0,1,0,0|1,0,1]=4 9699 B9R1.22 CC[C@H]1CC(=O)OC1O Amb25725427 [0,1,0,1,0,0|0,0,0]=2 9700 B9R1.22 CC[C@H]1NC(=O)C[C@@H]1O Amb24374772 [0,1,0,1,0,0|2,0,0]=4 9701 B9R1.22 CC[C@H]1OC(=O)C[C@@H]1O Amb25195896 [0,1,0,1,0,0|1,0,0]=3 9702 B9R1.22 CN1NC(=O)CC1CN Amb24519835 [0,1,0,1,0,0|2,0,0]=4 9703 B9R1.22 COC1=CC(=O)OC1C Amb24582255 [0,1,0,1,0,0|0,0,2]=4 9704 B9R1.22 COC1NC(=O)CC1O Amb24724345 [0,1,0,1,0,0|2,0,0]=4 9705 B9R1.22 C[C@@H]1CC(=N)N[C@H]1CC Amb25302320 [0,1,0,1,0,0|2,0,0]=4 9706 B9R1.22 C[C@@H]1CC(=O)N[C@H]1CI Amb24629581 [0,1,0,1,0,0|1,0,0]=3 9707 B9R1.22 C[C@@H]1CC(=O)O[C@@H]1CO Amb25176497 [0,1,0,1,0,0|0,0,0]=2 9708 B9R1.22 C[C@@H]1CC(O)O[C@@H]1CC Amb25343890 [0,1,0,1,0,0|0,0,2]=4 9709 B9R1.22 C[C@@H]1NC(=N)O[C@H]1CC Amb24516121 [0,1,0,1,0,0|2,0,0]=4 9710 B9R1.22 C[C@@H]1NC(=O)C[C@@H]1CO Amb24667931 [0,1,0,1,0,0|1,0,0]=3 9711 B9R1.22 C[C@@H]1NC(=O)OC1CC Amb25694156 [0,1,0,1,0,0|1,0,0]=3 9712 B9R1.22 C[C@@H]1NC(=O)O[C@@H]1C=C Amb24516597 [0,1,0,1,0,0|1,0,1]=4 9713 B9R1.22 C[C@@H]1OC(=O)C[C@H]1CO Amb25176881 [0,1,0,1,0,0|0,0,0]=2 9714 B9R1.22 C[C@@H]1OC(=O)C[C@H]1NC Amb24610195 [0,1,0,1,0,0|0,0,0]=2 9715 B9R1.22 C[C@@H]1OC(=O)C[C@H]1NN Amb24715077 [0,1,0,1,0,0|1,0,0]=3 9716 B9R1.22 C[C@@H]1OC(=O)NC1OC Amb24411516 [0,1,0,1,0,0|1,0,0]=3 9717 B9R1.22 C[C@@H]1OC(=O)N[C@@H]1C=C Amb25174990 [0,1,0,1,0,0|1,0,1]=4 9718 B9R1.22 C[C@@H]1OC(=O)N[C@H]1CC Amb24699385 [0,1,0,1,0,0|1,0,0]=3 9719 B9R1.22 C[C@H]1CC(=O)C[C@H]1CC Amb25179756 [0,1,0,1,0,0|1,0,0]=3 9720 B9R1.22 C[C@H]1CC(=O)N[C@H]1C#N Amb24760887 [0,1,0,1,0,0|1,0,1]=4 9721 B9R1.22 C[C@H]1CC(=O)N[C@H]1CI Amb24681330 [0,1,0,1,0,0|1,0,0]=3 9722 B9R1.22 C[C@H]1CC(=O)N[C@H]1CO Amb25175007 [0,1,0,1,0,0|1,0,0]=3 9723 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CBr Amb25210841 [0,1,0,1,0,0|0,0,0]=2 9724 B9R1.22 C[C@H]1CC(=O)O[C@H]1CCl Amb24554768 [0,1,0,1,0,0|0,0,0]=2 9725 B9R1.22 C[C@H]1CC(=O)O[C@H]1CO Amb25175374 [0,1,0,1,0,0|0,0,0]=2 9726 B9R1.22 C[C@H]1NC(=N)O[C@H]1CC Amb24516141 [0,1,0,1,0,0|2,0,0]=4 9727 B9R1.22 C[C@H]1NC(=O)O[C@@H]1CC Amb24713487 [0,1,0,1,0,0|1,0,0]=3 9728 B9R1.22 C[C@H]1OC(=O)C[C@H]1CO Amb25257020 [0,1,0,1,0,0|0,0,0]=2 9729 B9R1.22 C[C@H]1OC(=O)N[C@@H]1C=C Amb24550263 [0,1,0,1,0,0|1,0,1]=4 9730 B9R1.22 C[C@H]1OC(=O)N[C@@H]1OC Amb25376794 [0,1,0,1,0,0|1,0,0]=3 9731 B9R1.22 N[C@H]1CC(=O)N[C@H]1CO Amb25258095 [0,1,0,1,0,0|2,0,0]=4 9732 B9R1.22 O=C1OC(=O)CC1CBr Amb24480245 [0,1,0,1,0,0|1,0,1]=4 9733 B9R1.22 OC1CC(=O)OC1CO Amb24356603 [0,1,0,1,0,0|1,0,0]=3 9734 B9R1.22 OC1NC(=O)OC1CO Amb24387758 [0,1,0,1,0,0|2,0,0]=4 9735 B9R1.22 O[C@@H]1CC(=O)O[C@@H]1CO Amb24515317 [0,1,0,1,0,0|1,0,0]=3 9736 B9R1.22 O[C@@H]1CC(=O)O[C@H]1CBr Amb24555733 [0,1,0,1,0,0|1,0,0]=3 9737 B9R1.22 O[C@@H]1CC(=O)O[C@H]1CO Amb22748461 [0,1,0,1,0,0|1,0,0]=3 9738 B9R1.22 O[C@H]1CC(=O)N[C@@H]1CO Amb24677654 [0,1,0,1,0,0|2,0,0]=4 9739 B9R1.22 O[C@H]1CC(=O)OC1CO Amb24404778 [0,1,0,1,0,0|1,0,0]=3 9740 B9R1.22 O[C@H]1CC(=O)O[C@@H]1CBr Amb25176060 [0,1,0,1,0,0|1,0,0]=3 9741 B9R1.22 O[C@H]1CC(=O)O[C@@H]1CO Amb20242107 [0,1,0,1,0,0|1,0,0]=3 9742 B9R1.22 O[C@H]1CC(=O)O[C@H]1CCl Amb24598576 [0,1,0,1,0,0|1,0,0]=3 9743 B9R1.25 CC(=O)C1C(CC)C1=C Amb24340210 [0,1,0,1,0,0|1,0,1]=4 9744 B9R1.25 CC/1C(\C1=C/C)C(O)=O Amb24532863 [0,1,0,1,0,0|0,0,1]=3 9745 B9R1.25 CC/1C(\C1=C\C)C(N)=O Amb24684957 [0,1,0,1,0,0|1,0,1]=4 9746 B9R1.25 CC1C(C=C)C1C(C)=O Amb25094320 [0,1,0,1,0,0|1,0,1]=4 9747 B9R1.25 CC1C(CO)C1C(O)=O Amb25131333 [0,1,0,1,0,0|0,0,0]=2 9748 B9R1.25 CC1C(OC)C1C(O)=O Amb24383463 [0,1,0,1,0,0|0,0,0]=2 9749 B9R1.25 CC=1C(C1CC)C(O)=O Amb25705170 [0,1,0,1,0,0|0,0,1]=3 9750 B9R1.25 CC[C@H]1[C@@H](C1=C)C(O)=O Amb24683736 [0,1,0,1,0,0|0,0,1]=3 9751 B9R1.25 C[C@@H]1[C@@H](CO)[C@@H]1C(O)=O Amb25264080 [0,1,0,1,0,0|0,0,0]=2 9752 B9R1.25 C[C@@H]1[C@@H](CO)[C@H]1C(O)=O Amb24560911 [0,1,0,1,0,0|0,0,0]=2 9753 B9R1.25 C[C@H]1[C@H](C=O)[C@@H]1C(O)=O Amb24622469 [0,1,0,1,0,0|0,0,1]=3 9754 B9R1.34 CC1=CC(=O)CC(C)N1 Amb25326469 [0,1,0,1,0,0|1,0,1]=4 9755 B9R1.34 CC1=CC(=O)CC(C)O1 Amb25267464 [0,1,0,1,0,0|1,0,1]=4 9756 B9R1.34 CC1=CC(=O)C[C@@H](C)N1 Amb24062635 [0,1,0,1,0,0|1,0,1]=4 9757 B9R1.34 CC1=CC(=O)C[C@@H](C)O1 Amb24380740 [0,1,0,1,0,0|1,0,1]=4 9758 B9R1.34 CC1CC(=O)C=[N+]([O-])C1 Amb25366372 [0,1,0,1,0,0|2,0,0]=4 9759 B9R1.34 CC1CC(=O)CC(=O)O1 Amb24422515 [0,1,0,1,0,0|1,0,1]=4 9760 B9R1.34 CC1CC(=O)CC(C)N1 Amb18642530 [0,1,0,1,0,0|1,0,0]=3 9761 B9R1.34 CC1CC(=O)CC(C)N1 Amb22228395 [0,1,0,1,0,0|1,0,0]=3 9762 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,1,0,1,0,0|1,0,1]=4 9763 B9R1.34 CC1CC(=S)CC(C)N1 Amb25706152 [0,1,0,1,0,0|1,1,0]=4 9764 B9R1.34 CC1CC(C)N=C(N)C1 Amb25766396 [0,1,0,1,0,0|2,0,0]=4 9765 B9R1.34 CC1CC(C)NC(=N)C1 Amb17616044 [0,1,0,1,0,0|2,0,0]=4 9766 B9R1.34 CC1CC(N)=NN(C)C1 Amb24062262 [0,1,0,1,0,0|2,0,0]=4 9767 B9R1.34 CC1CC(N)C=C(C)C1 Amb25721977 [0,1,0,1,0,0|2,0,0]=4 9768 B9R1.34 CC1CC(N)NC(=O)C1 Amb24590810 [0,1,0,1,0,0|1,0,0]=3 9769 B9R1.34 CC1CC(O)CC(=O)O1 Amb23455145 [0,1,0,1,0,0|1,0,0]=3 9770 B9R1.34 CC1CC(O)CC(C)C1 Amb19514923 [0,1,0,1,0,0|1,0,1]=4 9771 B9R1.34 CC1CC(O)CC(C)N1 Amb22899513 [0,1,0,1,0,0|1,0,1]=4 9772 B9R1.34 CC1CC(O)CC(C)O1 Amb19892414 [0,1,0,1,0,0|1,0,1]=4 9773 B9R1.34 CC1CC(O)CN(C1)C Amb1017305 [0,1,0,1,0,0|1,0,1]=4 9774 B9R1.34 CC1CN(C)CC(=O)C1 Amb2369958 [0,1,0,1,0,0|1,0,0]=3 9775 B9R1.34 CC1C[C@@H](O)CC(O)C1 Amb24747781 [0,1,0,1,0,0|1,0,1]=4 9776 B9R1.34 CC1C[C@H](O)C[C@@H](O)C1 Amb25246152 [0,1,0,1,0,0|1,0,1]=4 9777 B9R1.34 CC1NC(=O)NC(C)S1 Amb25146112 [0,1,0,1,0,0|2,0,0]=4 9778 B9R1.34 CC1NC(C)CC(C)=N1 Amb25131654 [0,1,0,1,0,0|2,0,0]=4 9779 B9R1.34 CC1OC(C)CC(=O)C1 Amb10072038 [0,1,0,1,0,0|1,0,0]=3 9780 B9R1.34 CC=1CC(C)OC(=O)C1 Amb24435023 [0,1,0,1,0,0|0,0,2]=4 9781 B9R1.34 CC=1C[C@@H](C)CC(=O)C1 Amb25044278 [0,1,0,1,0,0|1,0,0]=3 9782 B9R1.34 CC=1C[C@H](C)CC(=O)C1 Amb24631557 [0,1,0,1,0,0|1,0,0]=3 9783 B9R1.34 CN1CC(=CC(=O)C1)C Amb2369957 [0,1,0,1,0,0|2,0,0]=4 9784 B9R1.34 CN1CC(=O)OC(=O)C1 Amb24673917 [0,1,0,1,0,0|1,0,1]=4 9785 B9R1.34 C[C@@H]1CC(=O)CN(C)C1 Amb25298503 [0,1,0,1,0,0|1,0,0]=3 9786 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)N1 Amb25244740 [0,1,0,1,0,0|1,0,0]=3 9787 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Amb24056554 [0,1,0,1,0,0|1,0,0]=3 9788 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)C1 Amb24568269 [0,1,0,1,0,0|1,0,0]=3 9789 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)N1 Amb22751257 [0,1,0,1,0,0|1,0,0]=3 9790 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)O1 Amb24620055 [0,1,0,1,0,0|1,0,0]=3 9791 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)N1 Amb24580385 [0,1,0,1,0,0|1,0,1]=4 9792 B9R1.34 C[C@@H]1CC(O)C[C@H](C)N1 Amb25147213 [0,1,0,1,0,0|1,0,1]=4 9793 B9R1.34 C[C@@H]1C[C@@H](N)CC(=O)N1 Amb24566495 [0,1,0,1,0,0|2,0,0]=4 9794 B9R1.34 C[C@@H]1C[C@H](O)CC(=O)O1 Amb25246833 [0,1,0,1,0,0|1,0,0]=3 9795 B9R1.34 C[C@@H]1C[C@H](O)CN(C)C1 Amb25810142 [0,1,0,1,0,0|1,0,1]=4 9796 B9R1.34 C[C@@H]1C[C@H](O)C[C@H](C)C1 Amb25791561 [0,1,0,1,0,0|1,0,1]=4 9797 B9R1.34 C[C@H]1CC(=O)C=C(N)C1 Amb25162761 [0,1,0,1,0,0|1,0,1]=4 9798 B9R1.34 C[C@H]1CC(=O)CC(C)C1 Amb25849622 [0,1,0,1,0,0|1,0,0]=3 9799 B9R1.34 C[C@H]1CC(=O)C[C@H](C)N1 Amb24517463 [0,1,0,1,0,0|1,0,0]=3 9800 B9R1.34 C[C@H]1CC(=O)C[C@H](C)O1 Amb22737479 [0,1,0,1,0,0|1,0,0]=3 9801 B9R1.34 C[C@H]1CC(=O)OC(=O)N1 Amb24551060 [0,1,0,1,0,0|1,0,1]=4 9802 B9R1.34 C[C@H]1CC(O)CC(=O)O1 Amb24541561 [0,1,0,1,0,0|1,0,0]=3 9803 B9R1.34 C[C@H]1CC(O)C[C@H](C)C1 Amb24099374 [0,1,0,1,0,0|1,0,1]=4 9804 B9R1.34 C[C@H]1CC(O)C[C@H](C)O1 Amb25317612 [0,1,0,1,0,0|1,0,1]=4 9805 B9R1.34 C[C@H]1CC(O)O[C@@H](C)C1 Amb24675283 [0,1,0,1,0,0|0,0,2]=4 9806 B9R1.34 C[C@H]1C[C@@H](O)C=C(C)C1 Amb24694187 [0,1,0,1,0,0|1,0,1]=4 9807 B9R1.34 C[C@H]1C[C@@H](O)CC(=O)N1 Amb24586779 [0,1,0,1,0,0|2,0,0]=4 9808 B9R1.34 C[C@H]1C[C@@H](O)CC(=O)O1 Amb25220495 [0,1,0,1,0,0|1,0,0]=3 9809 B9R1.34 C[C@H]1C[C@H](O)CC(=O)N1 Amb24517205 [0,1,0,1,0,0|2,0,0]=4 9810 B9R1.34 C[C@H]1C[C@H](O)CC(=O)O1 Amb25176759 [0,1,0,1,0,0|1,0,0]=3 9811 B9R1.34 C[C@H]1C[C@H](O)C[C@@H](C)C1 Amb24431909 [0,1,0,1,0,0|1,0,1]=4 9812 B9R1.34 C[C@H]1O[C@@H](O)C[C@@H](C)O1 Amb24733316 [0,1,0,1,0,0|0,0,2]=4 9813 B9R1.34 NC1CC(=O)CC(N)C1 Amb25303940 [0,1,0,1,0,0|2,0,0]=4 9814 B9R1.34 NC1CC(=O)OC(=O)C1 Amb24477706 [0,1,0,1,0,0|1,0,1]=4 9815 B9R1.34 O=C1CC(O)C=C(O1)C Amb16231305 [0,1,0,1,0,0|1,0,1]=4 9816 B9R1.34 OC1CC(=O)OC(=O)C1 Amb24457409 [0,1,0,1,0,0|1,0,1]=4 9817 B9R1.38 CC1(Br)OC(=O)CC1Br Amb25126951 [0,1,0,1,0,0|1,0,0]=3 9818 B9R1.38 CC1(C)CC(=O)CC1O Amb25730215 [0,1,0,1,0,0|2,0,0]=4 9819 B9R1.38 CC1(C)OC(=O)CC1Br Amb25831430 [0,1,0,1,0,0|1,0,0]=3 9820 B9R1.38 CC1(C)OC(=O)CC1Cl Amb24552388 [0,1,0,1,0,0|1,0,0]=3 9821 B9R1.38 CC1(C)OC(=O)CC1O Amb25198591 [0,1,0,1,0,0|1,0,0]=3 9822 B9R1.38 CC1(C)OC(=O)NC1N Amb24561447 [0,1,0,1,0,0|2,0,0]=4 9823 B9R1.38 CC1=CC(=O)C[C@]1(C)O Amb24545666 [0,1,0,1,0,0|1,0,1]=4 9824 B9R1.38 CC1CC(=O)NC1(C)C Amb19516972 [0,1,0,1,0,0|1,0,0]=3 9825 B9R1.38 CC1CC(N)P(O)(=O)O1 Amb25843150 [0,1,0,1,0,0|2,0,0]=4 9826 B9R1.38 CC1CC(O)OC1(C)C Amb25271492 [0,1,0,1,0,0|0,0,2]=4 9827 B9R1.38 CC1CC(S(=O)(=O)C1)C Amb2227622 [0,1,0,1,0,0|1,0,1]=4 9828 B9R1.38 CC1NC(=O)CC1(C)C Amb24618176 [0,1,0,1,0,0|1,0,0]=3 9829 B9R1.38 CC1NC(=O)CC1(C)O Amb25233455 [0,1,0,1,0,0|1,0,0]=3 9830 B9R1.38 CC1OC(=O)NC1(C)C Amb24481994 [0,1,0,1,0,0|1,0,0]=3 9831 B9R1.38 CC1OC(C)CC1(C)O Amb25251325 [0,1,0,1,0,0|1,0,1]=4 9832 B9R1.38 CN1CC(=O)NC1(C)C Amb24354186 [0,1,0,1,0,0|2,0,0]=4 9833 B9R1.38 C[C@@H]1NC(=O)C[C@@]1(C)O Amb25340649 [0,1,0,1,0,0|1,0,0]=3 9834 B9R1.38 C[C@@H]1NC(=O)C[C@]1(C)O Amb24585121 [0,1,0,1,0,0|1,0,0]=3 9835 B9R1.38 C[C@@H]1NC(=O)OC1(C)C Amb24553743 [0,1,0,1,0,0|1,0,0]=3 9836 B9R1.38 C[C@H]1NC(=O)OC1(C)C Amb25268161 [0,1,0,1,0,0|1,0,0]=3 9837 B9R1.38 O=C1C=C(C(C1)(C)C)C Amb16191973 [0,1,0,1,0,0|1,0,1]=4 9838 B9R1.44 CC1C[C@]1(N)CC(O)=O Amb25844887 [0,1,0,1,0,0|0,0,0]=2 9839 B9R1.44 C[C@@H]1C[C@@]1(N)CC(O)=O Amb24540980 [0,1,0,1,0,0|0,0,0]=2 9840 B9R1.48 CC1CC(=N)NCCC1 Amb25695240 [0,1,0,1,0,0|2,0,0]=4 9841 B9R1.48 CC1CC(=N)NCCS1 Amb24669595 [0,1,0,1,0,0|2,0,0]=4 9842 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,1,0,1,0,0|1,0,0]=3 9843 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,1,0,1,0,0|1,0,0]=3 9844 B9R1.48 CC1CC(C)=NCCN1 Amb22527040 [0,1,0,1,0,0|2,0,0]=4 9845 B9R1.48 CC1CC(O)CCNC1 Amb25725421 [0,1,0,1,0,0|1,0,1]=4 9846 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|1,0,0]=3 9847 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,1,0,0|2,0,0]=4 9848 B9R1.48 CC1CNC=CC(=O)C1 Amb24546980 [0,1,0,1,0,0|1,0,1]=4 9849 B9R1.48 CC=1CC(=O)CCCC1 Amb24686530 [0,1,0,1,0,0|1,0,1]=4 9850 B9R1.48 C[C@@H]1CC(=O)C=CCC1 Amb25353106 [0,1,0,1,0,0|1,0,0]=3 9851 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [0,1,0,1,0,0|1,0,0]=3 9852 B9R1.48 C[C@@H]1C[C@@H](O)CCCC1 Amb24593171 [0,1,0,1,0,0|1,0,1]=4 9853 B9R1.48 C[C@H]1CC(=O)C=CCC1 Amb24384662 [0,1,0,1,0,0|1,0,0]=3 9854 B9R1.48 C[C@H]1C[C@@H](O)C=CCC1 Amb24620795 [0,1,0,1,0,0|1,0,1]=4 9855 B9R1.48 C[C@H]1C[C@@H](O)CCCC1 Amb25221381 [0,1,0,1,0,0|1,0,1]=4 9856 B9R1.48 NC1CC(=O)NCCC1 Amb22229644 [0,1,0,1,0,0|2,0,0]=4 9857 B9R1.48 NC1CC(=O)NCCC1 Amb22276469 [0,1,0,1,0,0|2,0,0]=4 9858 B9R1.48 N[C@@H]1CC(=O)NCCC1 Amb24442197 [0,1,0,1,0,0|2,0,0]=4 9859 B9R1.48 O=C1CC(=O)NCCO1 Amb25810491 [0,1,0,1,0,0|1,0,1]=4 9860 B9R1.48 O=C1CC(Br)CCCC1 Amb25685402 [0,1,0,1,0,0|2,0,0]=4 9861 B9R1.48 O=C1CC(Cl)CCCC1 Amb25061378 [0,1,0,1,0,0|2,0,0]=4 9862 B9R1.48 O=C1CC(Cl)CCCN1 Amb25105399 [0,1,0,1,0,0|2,0,0]=4 9863 B9R1.48 O=C1COCCC(Cl)C1 Amb25102535 [0,1,0,1,0,0|1,0,0]=3 9864 B9R1.48 OC1CC(=O)NCCC1 Amb25147021 [0,1,0,1,0,0|2,0,0]=4 9865 B9R1.52 CC1CC(C)C1C(O)=O Amb25047286 [0,1,0,1,0,0|0,0,0]=2 9866 B9R1.52 CC1CC(C)N1C(N)=O Amb25215581 [0,1,0,1,0,0|2,0,0]=4 9867 B9R1.53 CC(=O)CC1CN(C)C1 Amb25249609 [0,1,0,1,0,0|1,0,0]=3 9868 B9R1.53 CC(=O)CN1CC(O)C1 Amb25231501 [0,1,0,1,0,0|2,0,0]=4 9869 B9R1.53 CC(=O)OC1CC(Cl)C1 Amb25123136 [0,1,0,1,0,0|2,0,0]=4 9870 B9R1.53 CC(=O)O[C@@H]1C[C@@H](Cl)C1 Amb25725070 [0,1,0,1,0,0|2,0,0]=4 9871 B9R1.53 CC(=O)O[C@@H]1C[C@@H](O)C1 Amb25777769 [0,1,0,1,0,0|2,0,0]=4 9872 B9R1.53 CC(=O)O[C@H]1C[C@@H](Cl)C1 Amb25109325 [0,1,0,1,0,0|2,0,0]=4 9873 B9R1.53 CC(=O)SC1CC(O)C1 Amb24732003 [0,1,0,1,0,0|2,0,0]=4 9874 B9R1.53 CC(=O)S[C@@H]1C[C@@H](O)C1 Amb25344944 [0,1,0,1,0,0|2,0,0]=4 9875 B9R1.53 CC1CC(C1)=CC(O)=O Amb25134976 [0,1,0,1,0,0|0,0,2]=4 9876 B9R1.53 CC1CC(C1)NC(N)=O Amb23538249 [0,1,0,1,0,0|2,0,0]=4 9877 B9R1.53 C[C@@H]1C[C@H](CC(O)=O)C1 Amb24372826 [0,1,0,1,0,0|0,0,0]=2 9878 B9R1.53 C[C@H]1C[C@H](C1)CC(C)=O Amb24722132 [0,1,0,1,0,0|1,0,0]=3 9879 B9R1.53 NC(=O)CN1CC(O)C1 Amb24761040 [0,1,0,1,0,0|2,0,0]=4 9880 B9R1.53 NC1CC(C1)OC(N)=O Amb25040399 [0,1,0,1,0,0|2,0,0]=4 9881 B9R1.53 NC1CC(CC(O)=O)C1 Amb23440231 [0,1,0,1,0,0|0,0,0]=2 9882 B9R1.53 NC1CN(C1)CC(O)=O Amb25347187 [0,1,0,1,0,0|1,0,0]=3 9883 B9R1.53 N[C@@H]1C[C@@H](CC(O)=O)C1 Amb23440233 [0,1,0,1,0,0|0,0,0]=2 9884 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb23440232 [0,1,0,1,0,0|0,0,0]=2 9885 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb24056536 [0,1,0,1,0,0|0,0,0]=2 9886 B9R1.53 O=C(Cl)CC1CC(Cl)C1 Amb25708345 [0,1,0,1,0,0|1,0,0]=3 9887 B9R1.53 OC(=O)CC1CC(=O)N1 Amb24351879 [0,1,0,1,0,0|1,0,1]=4 9888 B9R1.53 OC(=O)CC1CC(Cl)C1 Amb25145965 [0,1,0,1,0,0|0,0,0]=2 9889 B9R1.53 OC1CC(C1)CC(O)=O Amb24481941 [0,1,0,1,0,0|0,0,0]=2 9890 B9R1.53 OC1CN(C1)CC(O)=O Amb25339150 [0,1,0,1,0,0|1,0,0]=3 9891 B9R1.53 O[C@@H]1C[C@H](C1)CC(O)=O Amb25204858 [0,1,0,1,0,0|0,0,0]=2 9892 B9R1.59 C#CCC1OC1C(O)=O Amb25042774 [0,1,0,1,0,0|1,0,1]=4 9893 B9R1.59 CCCC1=CC1C(O)=O Amb24701359 [0,1,0,1,0,0|0,0,2]=4 9894 B9R1.59 CCCC1CC1B(O)O Amb24329445 [0,1,0,1,0,0|1,0,1]=4 9895 B9R1.59 CCCC1CC1C(N)=O Amb24473639 [0,1,0,1,0,0|1,0,0]=3 9896 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [0,1,0,1,0,0|0,0,0]=2 9897 B9R1.59 CCCC1OC1C(O)=O Amb24561183 [0,1,0,1,0,0|1,0,0]=3 9898 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [0,1,0,1,0,0|0,0,0]=2 9899 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|2,0,0]=4 9900 B9R1.59 CCOC1CC1C(N)=O Amb24450491 [0,1,0,1,0,0|1,0,0]=3 9901 B9R1.59 CNC[C@@H]1C[C@H]1C(O)=O Amb24744378 [0,1,0,1,0,0|0,0,0]=2 9902 B9R1.59 COCC1CC1B(O)O Amb25142153 [0,1,0,1,0,0|1,0,1]=4 9903 B9R1.59 COC[C@@H]1C[C@H]1B(O)O Amb24443354 [0,1,0,1,0,0|1,0,1]=4 9904 B9R1.59 OC(=O)C1CC1C#CCl Amb25789843 [0,1,0,1,0,0|0,0,2]=4 9905 B9R1.59 OC(=O)[C@@H]1C[C@H]1CCBr Amb24519204 [0,1,0,1,0,0|0,0,0]=2 9906 B9R1.59 OC(=O)[C@@H]1C[C@H]1\C=C\Cl Amb25260396 [0,1,0,1,0,0|0,0,2]=4 9907 B9R1.66 CC1(C)CC(=N)NCC1 Amb24481893 [0,1,0,1,0,0|2,0,0]=4 9908 B9R1.66 CC1(C)CC(=O)CCN1 Amb18832677 [0,1,0,1,0,0|2,0,0]=4 9909 B9R1.66 CC1(C)CC(=O)CCN1 Amb22756378 [0,1,0,1,0,0|2,0,0]=4 9910 B9R1.66 CC1(C)CC(=O)NCC1 Amb24451332 [0,1,0,1,0,0|1,0,0]=3 9911 B9R1.66 CC1(C)CCNC(=O)O1 Amb25083672 [0,1,0,1,0,0|2,0,0]=4 9912 B9R1.66 CC1(C)CSCC(=O)C1 Amb21927887 [0,1,0,1,0,0|2,0,0]=4 9913 B9R1.66 CC1(C)C[C@@H](O)CCC1 Amb24675497 [0,1,0,1,0,0|1,0,1]=4 9914 B9R1.66 CC1(C)C[C@H](O)CCC1 Amb24735248 [0,1,0,1,0,0|1,0,1]=4 9915 B9R1.66 CC1(F)CC(O)CCC1 Amb24515861 [0,1,0,1,0,0|1,0,1]=4 9916 B9R1.66 CC1(N)CC(=O)CCC1 Amb25290133 [0,1,0,1,0,0|1,0,0]=3 9917 B9R1.66 CC1(O)CC(=O)NCC1 Amb24548836 [0,1,0,1,0,0|1,0,0]=3 9918 B9R1.66 CC1(O)CC(O)OCC1 Amb24698599 [0,1,0,1,0,0|0,0,2]=4 9919 B9R1.66 CC1(O)CCCC(=O)N1 Amb25373927 [0,1,0,1,0,0|2,0,0]=4 9920 B9R1.66 CC1(O)CCOC(=O)[13CH2]1 Amb22353493 [0,1,0,1,0,0|0,0,0]=2 9921 B9R1.66 CC1(O)C[13CH2]CC(=O)C1 Amb22367566 [0,1,0,1,0,0|1,0,0]=3 9922 B9R1.66 CC1(S)CC(=O)CCC1 Amb24339898 [0,1,0,1,0,0|1,0,0]=3 9923 B9R1.66 CC1=NC(C)(C)CCO1 Amb22396066 [0,1,0,1,0,0|2,0,0]=4 9924 B9R1.66 CC1CC(C)(Cl)CCO1 Amb24552336 [0,1,0,1,0,0|1,0,1]=4 9925 B9R1.66 CC1CC(C)(O)CCN1 Amb25303339 [0,1,0,1,0,0|1,0,1]=4 9926 B9R1.66 CC1CCOS(=O)(=O)O1 Amb25111500 [0,1,0,1,0,0|2,0,0]=4 9927 B9R1.66 CC1CS(=O)(=O)CCN1 Amb19515399 [0,1,0,1,0,0|1,0,1]=4 9928 B9R1.66 CC=1CC(C)(C)CCC1 Amb24683640 [0,1,0,1,0,0|2,0,0]=4 9929 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb24652818 [0,1,0,1,0,0|1,0,1]=4 9930 B9R1.66 C[C@@H]1CS(=O)(=O)CCO1 Amb25072952 [0,1,0,1,0,0|1,0,1]=4 9931 B9R1.66 C[C@@]1(O)CC(=O)OCC1 Amb22800043 [0,1,0,1,0,0|0,0,0]=2 9932 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb25246713 [0,1,0,1,0,0|1,0,1]=4 9933 B9R1.66 C[C@]1(O)CC(=O)OCC1 Amb22388612 [0,1,0,1,0,0|0,0,0]=2 9934 B9R1.66 C[C@]1(O)CC(O)OCC1 Amb24591615 [0,1,0,1,0,0|0,0,2]=4 9935 B9R1.66 C[C@]1(O)C[C@@H](O)CCC1 Amb25219285 [0,1,0,1,0,0|1,0,1]=4 9936 B9R1.66 C[C@]1(O)C[C@H](O)CCC1 Amb25176552 [0,1,0,1,0,0|1,0,1]=4 9937 B9R1.66 C[C@]1(S)C[C@@H](O)CCC1 Amb24704354 [0,1,0,1,0,0|1,0,1]=4 9938 B9R1.66 O=C1CC(F)(F)CCC1 Amb24543971 [0,1,0,1,0,0|2,0,0]=4 9939 B9R1.66 O=C1CC(F)(F)CCN1 Amb24567328 [0,1,0,1,0,0|2,0,0]=4 9940 B9R1.66 O=C1CCCC(C1)(C)C Amb13883565 [0,1,0,1,0,0|1,0,0]=3 9941 B9R1.66 O=C1CCSC(C1)(C)C Amb17593636 [0,1,0,1,0,0|2,0,0]=4 9942 B9R1.66 OC1(Cl)CC(=O)CCC1 Amb24576033 [0,1,0,1,0,0|2,0,0]=4 9943 B9R1.66 [13CH3]C1(O)CC(=O)OCC1 Amb22367288 [0,1,0,1,0,0|0,0,0]=2 9944 B9R1.75 CC(CCC)CC1CO1 Amb25769573 [0,1,0,1,0,0|1,0,1]=4 9945 B9R1.75 CC(COC)CC1CO1 Amb24739366 [0,1,0,1,0,0|1,0,1]=4 9946 B9R1.136 CCOC1CC(C)(O)C1 Amb24451317 [0,1,0,1,0,0|1,0,1]=4 9947 B9R1.136 NCCC1CS(=O)(=O)C1 Amb25845705 [0,1,0,1,0,0|1,0,1]=4 9948 B9R1.136 O=S1(=O)CC(CCBr)C1 Amb24645610 [0,1,0,1,0,0|1,0,1]=4 9949 B9R1.136 O=S1(=O)CC(CCCl)C1 Amb25688873 [0,1,0,1,0,0|1,0,1]=4 9950 B9R1.136 O=S1(=O)CC(CCI)C1 Amb24654633 [0,1,0,1,0,0|1,0,1]=4 9951 B9R1.136 OCCC1CS(=O)(=O)C1 Amb25790952 [0,1,0,1,0,0|1,0,1]=4 9952 B9R1.137 CC(=O)CC(O)C1CC1 Amb25274131 [0,1,0,1,0,0|2,0,0]=4 9953 B9R1.137 CC(CC(C)=O)=C1CC1 Amb25718421 [0,1,0,1,0,0|1,0,1]=4 9954 B9R1.137 CC(CC(C)O)C1CC1 Amb25117501 [0,1,0,1,0,0|1,0,1]=4 9955 B9R1.137 CC(NC(C)=O)C1CC1 Amb25355157 [0,1,0,1,0,0|2,0,0]=4 9956 B9R1.137 CN(CC(N)=O)C1CC1 Amb25342036 [0,1,0,1,0,0|2,0,0]=4 9957 B9R1.137 C[C@H](OC(C)=O)C1CC1 Amb25767468 [0,1,0,1,0,0|2,0,0]=4 9958 B9R1.137 C\C(=C/C(=O)O)\C1CC1 Amb10609547 [0,1,0,1,0,0|0,0,2]=4 9959 B9R1.137 C\C(=C\C(=O)O)\C1CC1 Amb10718081 [0,1,0,1,0,0|0,0,2]=4 9960 B9R1.137 NC(CC(N)=O)C1CC1 Amb18988331 [0,1,0,1,0,0|2,0,0]=4 9961 B9R1.137 NC(CC(N)=O)C1CC1 Amb19307935 [0,1,0,1,0,0|2,0,0]=4 9962 B9R1.137 N[C@H](CC(N)=O)C1CC1 Amb25259754 [0,1,0,1,0,0|2,0,0]=4 9963 B9R1.137 N[C@H](CC(O)=O)C1CC1 Amb24349802 [0,1,0,1,0,0|1,0,0]=3 9964 B9R1.137 O=C(C1CC1)CC(=O)O Amb10576272 [0,1,0,1,0,0|1,0,1]=4 9965 B9R1.137 OC(=O)CS(=O)C1CC1 Amb25272361 [0,1,0,1,0,0|2,0,0]=4 9966 B9R1.137 OC(C1CC1)CC(=O)O Amb17231863 [0,1,0,1,0,0|1,0,0]=3 9967 B9R1.137 OC(CC(O)=O)C1CO1 Amb25854287 [0,1,0,1,0,0|1,0,0]=3 9968 B9R1.137 O[C@H](CC(O)=O)C1CC1 Amb25367343 [0,1,0,1,0,0|1,0,0]=3 9969 B9R1.137 [O-]C(=O)C[C@@H](O)[C@H]1CO1 Amb25302277 [0,1,0,1,0,0|1,0,1]=4 9970 B9R1.171 CC(=O)NC1(C)CCC1 Amb16229572 [0,1,0,1,0,0|2,0,0]=4 9971 B9R1.171 CC(=O)OC1(C)CCC1 Amb24481922 [0,1,0,1,0,0|2,0,0]=4 9972 B9R1.171 CC1(CC(N)=N)CCC1 Amb25195221 [0,1,0,1,0,0|2,0,0]=4 9973 B9R1.171 CC1(CC(N)=O)CCC1 Amb25772136 [0,1,0,1,0,0|1,0,0]=3 9974 B9R1.171 CC1(CC(O)=O)CCC1 Amb22735897 [0,1,0,1,0,0|0,0,0]=2 9975 B9R1.171 CC1(CCC1)OC(N)=O Amb25230380 [0,1,0,1,0,0|2,0,0]=4 9976 B9R1.171 CC1(COC1)CC(O)=O Amb20671333 [0,1,0,1,0,0|0,0,0]=2 9977 B9R1.171 NC(=O)CC1(N)CCC1 Amb20622461 [0,1,0,1,0,0|1,0,0]=3 9978 B9R1.171 NC(=O)CC1(N)CCC1 Amb22059756 [0,1,0,1,0,0|1,0,0]=3 9979 B9R1.171 NC(=O)CC1(N)COC1 Amb22039447 [0,1,0,1,0,0|2,0,0]=4 9980 B9R1.171 NC1(CC(O)=O)CCC1 Amb20623514 [0,1,0,1,0,0|0,0,0]=2 9981 B9R1.171 NC1(CC(O)=O)CCC1 Amb22059493 [0,1,0,1,0,0|0,0,0]=2 9982 B9R1.171 NC1(COC1)CC(O)=O Amb20671385 [0,1,0,1,0,0|1,0,0]=3 9983 B9R1.171 OC(=O)CC1(F)COC1 Amb24564061 [0,1,0,1,0,0|1,0,0]=3 9984 B9R1.171 OC(=O)CC1(O)CCC1 Amb18961452 [0,1,0,1,0,0|0,0,0]=2 9985 B9R1.171 OC(=O)CC1(O)CNC1 Amb25041173 [0,1,0,1,0,0|1,0,0]=3 9986 B9R1.171 [O-][N+](=O)CC1(O)CCC1 Amb19958573 [0,1,0,1,0,0|1,0,1]=4 9987 B9R1.177 CC1(CC=C)CC(=O)N1 Amb25081429 [0,1,0,1,0,0|1,0,1]=4 9988 B9R1.177 COCC1(C)CC(=O)C1 Amb25112540 [0,1,0,1,0,0|1,0,0]=3 9989 B9R1.183 CCCC(C)C1OC1C Amb24596468 [0,1,0,1,0,0|1,0,1]=4 9990 B9R1.2 C#C[C@H]1CC(=O)CCC1 Amb24378497 [0,1,0,1,0,0|1,0,1]=4 9991 B9R1.2 C=C1CC(CCO1)C=O Amb25837814 [0,1,0,1,0,0|1,0,1]=4 9992 B9R1.2 CC1=NC(CBr)CCO1 Amb25123982 [0,1,0,1,0,0|2,0,0]=4 9993 B9R1.2 CC1CC(C=C)=CCC1 Amb24481663 [0,1,0,1,0,0|2,0,0]=4 9994 B9R1.2 CC1CC(C=O)=CCC1 Amb18642246 [0,1,0,1,0,0|1,0,0]=3 9995 B9R1.2 CC1CC(C=O)OCC1 Amb25032291 [0,1,0,1,0,0|0,0,1]=3 9996 B9R1.2 CC1CC(C=O)OCO1 Amb25362501 [0,1,0,1,0,0|1,0,1]=4 9997 B9R1.2 CC1CC(CBr)=CCC1 Amb25804111 [0,1,0,1,0,0|2,0,0]=4 9998 B9R1.2 CC1CC(CCC1)C=O Amb22059519 [0,1,0,1,0,0|1,0,1]=4 9999 B9R1.2 CC1CC(CCO1)=NO Amb24425946 [0,1,0,1,0,0|2,0,0]=4 10000 B9R1.2 CC1CC(CCO1)CN Amb22059410 [0,1,0,1,0,0|1,0,1]=4 10001 B9R1.2 CC1CC(CCO1)CO Amb24679585 [0,1,0,1,0,0|1,0,1]=4 10002 B9R1.2 CC1CC(CO)CCC1 Amb20248640 [0,1,0,1,0,0|1,0,1]=4 10003 B9R1.2 CC1CC(CO)NCC1 Amb24571948 [0,1,0,1,0,0|1,0,1]=4 10004 B9R1.2 CC1CC(CO)OCC1 Amb24412052 [0,1,0,1,0,0|0,0,2]=4 10005 B9R1.2 CC1CCCC(CO)=C1 Amb25811041 [0,1,0,1,0,0|1,0,1]=4 10006 B9R1.2 CC1CCOC(C1)NC Amb24666173 [0,1,0,1,0,0|1,0,1]=4 10007 B9R1.2 CC1CN(CCC1)C=O Amb25066806 [0,1,0,1,0,0|2,0,0]=4 10008 B9R1.2 CC=1CC(CN)CCC1 Amb18642353 [0,1,0,1,0,0|2,0,0]=4 10009 B9R1.2 CC=1CC(CO)CCC1 Amb25320000 [0,1,0,1,0,0|2,0,0]=4 10010 B9R1.2 CCC1CC(=C)CCC1 Amb24420328 [0,1,0,1,0,0|2,0,0]=4 10011 B9R1.2 CCC1CC(=O)C=CS1 Amb25373158 [0,1,0,1,0,0|1,0,1]=4 10012 B9R1.2 CCC1CC(=O)CCC1 Amb19335038 [0,1,0,1,0,0|1,0,0]=3 10013 B9R1.2 CCC1CC(=O)CCN1 Amb22228813 [0,1,0,1,0,0|1,0,0]=3 10014 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|1,0,0]=3 10015 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|1,0,0]=3 10016 B9R1.2 CCC1CC(=O)NCC1 Amb25791122 [0,1,0,1,0,0|1,0,0]=3 10017 B9R1.2 CCC1CC(=O)OCC1 Amb24707973 [0,1,0,1,0,0|0,0,0]=2 10018 B9R1.2 CCC1CC(N)=NCC1 Amb25779626 [0,1,0,1,0,0|2,0,0]=4 10019 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|1,0,1]=4 10020 B9R1.2 CCC1CC(O)CCS1 Amb24464826 [0,1,0,1,0,0|1,0,1]=4 10021 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,1,0,1,0,0|2,0,0]=4 10022 B9R1.2 CCC1CCCC(C1)O Amb17593352 [0,1,0,1,0,0|1,0,1]=4 10023 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [0,1,0,1,0,0|2,0,0]=4 10024 B9R1.2 CCC1CNCC(=O)N1 Amb24427566 [0,1,0,1,0,0|2,0,0]=4 10025 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|1,0,0]=3 10026 B9R1.2 CCC1CSCC(=O)N1 Amb24476643 [0,1,0,1,0,0|1,1,0]=4 10027 B9R1.2 CCN1CC(=O)CCC1 Amb23440927 [0,1,0,1,0,0|2,0,0]=4 10028 B9R1.2 CCN1CC(=O)NCC1 Amb19516973 [0,1,0,1,0,0|2,0,0]=4 10029 B9R1.2 CCN1CC(=O)NCC1 Amb21961561 [0,1,0,1,0,0|2,0,0]=4 10030 B9R1.2 CCN1CC(=O)OCC1 Amb24367827 [0,1,0,1,0,0|1,0,0]=3 10031 B9R1.2 CC[C@@H]1CC(=O)CCC1 Amb25373198 [0,1,0,1,0,0|1,0,0]=3 10032 B9R1.2 CC[C@@H]1CC(=O)CCN1 Amb24558461 [0,1,0,1,0,0|1,0,0]=3 10033 B9R1.2 CC[C@@H]1CC(=O)CCO1 Amb25373176 [0,1,0,1,0,0|1,0,0]=3 10034 B9R1.2 CC[C@@H]1CCCC(=O)N1 Amb22746831 [0,1,0,1,0,0|2,0,0]=4 10035 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|1,0,0]=3 10036 B9R1.2 CC[C@@H]1C[C@@H](O)CCO1 Amb25175513 [0,1,0,1,0,0|1,0,1]=4 10037 B9R1.2 CC[C@H]1CC(=O)CCN1 Amb24652709 [0,1,0,1,0,0|1,0,0]=3 10038 B9R1.2 CC[C@H]1CC(=O)CCO1 Amb24633506 [0,1,0,1,0,0|1,0,0]=3 10039 B9R1.2 CC[C@H]1COCC(=O)N1 Amb25831485 [0,1,0,1,0,0|1,0,0]=3 10040 B9R1.2 CC[C@H]1C[C@H](O)CCO1 Amb25215427 [0,1,0,1,0,0|1,0,1]=4 10041 B9R1.2 CN1CC(=CCC1)C=O Amb17593300 [0,1,0,1,0,0|2,0,0]=4 10042 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|1,0,1]=4 10043 B9R1.2 CNC1CCNC(=O)N1 Amb25808930 [0,1,0,1,0,0|2,0,0]=4 10044 B9R1.2 CN[C@@H]1CC(C)=CCC1 Amb24630194 [0,1,0,1,0,0|2,0,0]=4 10045 B9R1.2 CN[C@H]1CC(C)=CCC1 Amb24623003 [0,1,0,1,0,0|2,0,0]=4 10046 B9R1.2 CN[C@H]1CCC[C@H](O)C1 Amb24712944 [0,1,0,1,0,0|1,0,1]=4 10047 B9R1.2 COC1=CCCN(C1)C Amb13952605 [0,1,0,1,0,0|2,0,0]=4 10048 B9R1.2 COC1CC(=C)CCC1 Amb24654634 [0,1,0,1,0,0|2,0,0]=4 10049 B9R1.2 COC1CC(=O)CCC1 Amb20671002 [0,1,0,1,0,0|1,0,0]=3 10050 B9R1.2 COC1CC=CC(=O)C1 Amb24636360 [0,1,0,1,0,0|1,0,1]=4 10051 B9R1.2 COC1CCCC(C1)O Amb13951102 [0,1,0,1,0,0|1,0,1]=4 10052 B9R1.2 COC1CCOC(O)C1 Amb25080534 [0,1,0,1,0,0|0,0,2]=4 10053 B9R1.2 COC=1CN(C)CCN1 Amb24071514 [0,1,0,1,0,0|2,0,0]=4 10054 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|1,0,1]=4 10055 B9R1.2 CSC1CC(=O)CCC1 Amb25328147 [0,1,0,1,0,0|1,0,0]=3 10056 B9R1.2 C[C@@H]1CCO[C@H](C1)NC Amb25174867 [0,1,0,1,0,0|1,0,1]=4 10057 B9R1.2 C[C@@H]1C[C@@H](CO)NCC1 Amb24586583 [0,1,0,1,0,0|1,0,1]=4 10058 B9R1.2 C[C@@H]1C[C@H](C=O)OCC1 Amb25366622 [0,1,0,1,0,0|0,0,1]=3 10059 B9R1.2 C[C@@H]1C[C@H](CO)CCC1 Amb25176090 [0,1,0,1,0,0|1,0,1]=4 10060 B9R1.2 C[C@@H]1C[C@H](CO)OCC1 Amb24630517 [0,1,0,1,0,0|0,0,2]=4 10061 B9R1.2 C[C@H]1CC(CCC1)C=O Amb24648931 [0,1,0,1,0,0|1,0,1]=4 10062 B9R1.2 C[C@H]1CCO[C@H](C1)NC Amb25174873 [0,1,0,1,0,0|1,0,1]=4 10063 B9R1.2 C[C@H]1C[C@H](C=O)OCC1 Amb25339741 [0,1,0,1,0,0|0,0,1]=3 10064 B9R1.2 C[C@H]1C[C@H](CO)CCC1 Amb24519733 [0,1,0,1,0,0|1,0,1]=4 10065 B9R1.2 C\C=C/1\CCOC(=O)N1 Amb25270019 [0,1,0,1,0,0|1,0,1]=4 10066 B9R1.2 ClCC1CCCC(=O)C1 Amb17593666 [0,1,0,1,0,0|1,0,0]=3 10067 B9R1.2 N#CC1CC(=O)CCC1 Amb18642100 [0,1,0,1,0,0|1,0,1]=4 10068 B9R1.2 NCC1CC(=O)NCC1 Amb18832611 [0,1,0,1,0,0|1,0,0]=3 10069 B9R1.2 NCC1CC(=O)NCC1 Amb22405878 [0,1,0,1,0,0|1,0,0]=3 10070 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,1,0,1,0,0|2,0,0]=4 10071 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,1,0,1,0,0|2,0,0]=4 10072 B9R1.2 NCC1COCC(=O)N1 Amb24481993 [0,1,0,1,0,0|2,0,0]=4 10073 B9R1.2 O=C1CCCC(CCl)N1 Amb19374373 [0,1,0,1,0,0|2,0,0]=4 10074 B9R1.2 O=C1CCCC(CI)O1 Amb24675480 [0,1,0,1,0,0|2,0,0]=4 10075 B9R1.2 O=C1CCC[C@@H](CCl)O1 Amb24408738 [0,1,0,1,0,0|2,0,0]=4 10076 B9R1.2 O=C1COCC(CF)N1 Amb25316026 [0,1,0,1,0,0|2,0,0]=4 10077 B9R1.2 O=CC1CC(=O)CCC1 Amb18642402 [0,1,0,1,0,0|1,0,1]=4 10078 B9R1.2 O=S1OC(CCl)CCO1 Amb24340240 [0,1,0,1,0,0|2,0,0]=4 10079 B9R1.2 OC1CC(CCl)CCC1 Amb25342173 [0,1,0,1,0,0|1,0,1]=4 10080 B9R1.2 OC1CC(CF)CCC1 Amb25222936 [0,1,0,1,0,0|1,0,1]=4 10081 B9R1.2 OC1CC(CI)CCC1 Amb25144515 [0,1,0,1,0,0|1,0,1]=4 10082 B9R1.2 OC1CCCC(C1)CO Amb24429742 [0,1,0,1,0,0|1,0,1]=4 10083 B9R1.2 OCC1CC(=O)CCN1 Amb25147026 [0,1,0,1,0,0|2,0,0]=4 10084 B9R1.2 OCC1CC(=O)NCC1 Amb21960758 [0,1,0,1,0,0|1,0,0]=3 10085 B9R1.2 OCC1CCCC(=O)C1 Amb16231079 [0,1,0,1,0,0|1,0,0]=3 10086 B9R1.2 OCC1CCCC(=O)N1 Amb13886257 [0,1,0,1,0,0|2,0,0]=4 10087 B9R1.2 OCC1CCOC(=S)O1 Amb24752278 [0,1,0,1,0,0|1,1,0]=4 10088 B9R1.2 OCC1COCC(=O)N1 Amb22236095 [0,1,0,1,0,0|2,0,0]=4 10089 B9R1.2 OCC1COCC(=O)O1 Amb25246215 [0,1,0,1,0,0|2,0,0]=4 10090 B9R1.2 OC[C@@H]1CC(=O)CCC1 Amb22748907 [0,1,0,1,0,0|1,0,0]=3 10091 B9R1.2 OC[C@@H]1CC=CC(=O)C1 Amb24658579 [0,1,0,1,0,0|1,0,1]=4 10092 B9R1.2 OC[C@@H]1CCCC(=O)N1 Amb22745829 [0,1,0,1,0,0|2,0,0]=4 10093 B9R1.2 OC[C@@H]1CCCC(=O)O1 Amb25045754 [0,1,0,1,0,0|2,0,0]=4 10094 B9R1.2 OC[C@H]1CCCC(=O)N1 Amb25187085 [0,1,0,1,0,0|2,0,0]=4 10095 B9R1.2 OC[C@H]1COCC(=O)N1 Amb25050078 [0,1,0,1,0,0|2,0,0]=4 10096 B9R1.2 O\N=C\1/CC(Cl)CCC1 Amb25114780 [0,1,0,1,0,0|2,0,0]=4 10097 B9R1.124 CCC1(CC(=O)N1)CC Amb25837293 [0,1,0,1,0,0|1,0,0]=3 10098 B9R1.124 CCC1(CO)CC(=O)N1 Amb25208650 [0,1,0,1,0,0|1,0,0]=3 10099 B9R1.124 CSC1(CN)CC(=O)C1 Amb25106808 [0,1,0,1,0,0|2,0,0]=4 10100 B9R1.128 C#CC1(CC(O)=O)CC1 Amb24524235 [0,1,0,1,0,0|0,0,1]=3 10101 B9R1.128 CC(=O)NC1(CBr)CC1 Amb24481801 [0,1,0,1,0,0|2,0,0]=4 10102 B9R1.128 CC(=O)NC1(CCl)CC1 Amb25032185 [0,1,0,1,0,0|2,0,0]=4 10103 B9R1.128 CC(=O)NC1(CN)CC1 Amb25140115 [0,1,0,1,0,0|2,0,0]=4 10104 B9R1.128 CC(=O)NC1(CO)CC1 Amb25189003 [0,1,0,1,0,0|2,0,0]=4 10105 B9R1.128 CC(O)CC1(CN)CC1 Amb25677874 [0,1,0,1,0,0|1,0,1]=4 10106 B9R1.128 CCC1(CC(O)=O)CC1 Amb18832628 [0,1,0,1,0,0|0,0,0]=2 10107 B9R1.128 CCC1(CC1)NC(N)=O Amb24634185 [0,1,0,1,0,0|2,0,0]=4 10108 B9R1.128 CCC1(CO1)CC(C)=O Amb24378943 [0,1,0,1,0,0|1,0,0]=3 10109 B9R1.128 NC(=N)CC1(CO)CC1 Amb24679569 [0,1,0,1,0,0|2,0,0]=4 10110 B9R1.128 NC(=O)CC1(CS)CC1 Amb25809450 [0,1,0,1,0,0|1,0,0]=3 10111 B9R1.128 NC(=O)NC1(CO)CC1 Amb25331641 [0,1,0,1,0,0|2,0,0]=4 10112 B9R1.128 NCC1(CC(O)=O)CC1 Amb24178895 [0,1,0,1,0,0|0,0,0]=2 10113 B9R1.128 NCC1(CC(O)=O)CC1 Amb24556109 [0,1,0,1,0,0|0,0,0]=2 10114 B9R1.128 NCC1(CS(=O)=O)CC1 Amb24559591 [0,1,0,1,0,0|1,0,1]=4 10115 B9R1.128 OC(=O)CC1(CBr)CC1 Amb24379039 [0,1,0,1,0,0|0,0,0]=2 10116 B9R1.128 OC(=O)CC1(CC1)C=S Amb24368221 [0,1,0,1,0,0|0,0,1]=3 10117 B9R1.128 OCC1(CC1)CC(=O)O Amb13883569 [0,1,0,1,0,0|0,0,0]=2 10118 B9R1.21 CCC1CC(CC1)C=O Amb25312233 [0,1,0,1,0,0|1,0,1]=4 10119 B9R1.21 CCC1CN(CC1)C=O Amb24475759 [0,1,0,1,0,0|2,0,0]=4 10120 B9R1.21 CC[C@@H]1C[C@H](CO)CC1 Amb25205088 [0,1,0,1,0,0|1,0,1]=4 10121 B9R1.21 CC[C@H]1COC(CCl)=N1 Amb24738239 [0,1,0,1,0,0|2,0,0]=4 10122 B9R1.21 CC[C@H]1C[C@@H](CO)NC1 Amb24547528 [0,1,0,1,0,0|1,0,1]=4 10123 B9R1.21 CC[C@H]1C[C@H](CO)CC1 Amb24719755 [0,1,0,1,0,0|1,0,1]=4 10124 B9R1.21 OCC=1CC(CC1)CO Amb24340095 [0,1,0,1,0,0|2,0,0]=4 10125 B9R1.21 ON=C1CC(CCl)CC1 Amb25287955 [0,1,0,1,0,0|2,0,0]=4 10126 B9R1.23 CC1CC(CC)NC1=O Amb20623299 [0,1,0,1,0,0|2,0,0]=4 10127 B9R1.23 CC1CN(CC1C)C=O Amb25340256 [0,1,0,1,0,0|2,0,0]=4 10128 B9R1.23 CCC1CC(=O)C(=O)C1 Amb25838664 [0,1,0,1,0,0|0,0,1]=3 10129 B9R1.23 CCC1CC(=O)C(O)=C1 Amb25706973 [0,1,0,1,0,0|0,0,1]=3 10130 B9R1.23 CCC1CC(Br)C(=O)O1 Amb25839843 [0,1,0,1,0,0|2,0,0]=4 10131 B9R1.23 CCC1CC(O)C(=O)N1 Amb24426760 [0,1,0,1,0,0|1,0,0]=3 10132 B9R1.23 CCC=1CC(=O)C(O)C1 Amb24522759 [0,1,0,1,0,0|0,0,2]=4 10133 B9R1.23 CCN1CC(C)C(=O)C1 Amb20667767 [0,1,0,1,0,0|2,0,0]=4 10134 B9R1.23 CC[C@@H]1C[C@H](N)C(=O)O1 Amb25163624 [0,1,0,1,0,0|2,0,0]=4 10135 B9R1.23 CC[C@H]1OC([C@@H](C1)C)C Amb10604665 [0,1,0,1,0,0|1,0,1]=4 10136 B9R1.23 CN1CC(CN)CC1=O Amb22587624 [0,1,0,1,0,0|2,0,0]=4 10137 B9R1.23 CNC1CC(=O)N(C)C1 Amb25142512 [0,1,0,1,0,0|2,0,0]=4 10138 B9R1.23 C[C@H]1OC(C=O)O[C@@H]1C Amb25257842 [0,1,0,1,0,0|1,0,1]=4 10139 B9R1.23 OCC1CC(=O)N(C1)C Amb10607401 [0,1,0,1,0,0|2,0,0]=4 10140 B9R1.23 O[C@@H]1C[C@H](CCl)OC1=O Amb25213067 [0,1,0,1,0,0|2,0,0]=4 10141 B9R1.23 O[C@@H]1C[C@H](CO)OC1=O Amb25324131 [0,1,0,1,0,0|2,0,0]=4 10142 B9R1.79 C#CC(=O)CC1CNC1 Amb25807932 [0,1,0,1,0,0|2,0,0]=4 10143 B9R1.79 C#CC(=O)CN1CCC1 Amb25133340 [0,1,0,1,0,0|2,0,0]=4 10144 B9R1.79 C#CC(=O)NC1CCC1 Amb24556686 [0,1,0,1,0,0|2,0,0]=4 10145 B9R1.79 C=CC(=O)CC1CCC1 Amb24746067 [0,1,0,1,0,0|1,0,0]=3 10146 B9R1.79 C=CC(=O)CC1CNC1 Amb25774002 [0,1,0,1,0,0|2,0,0]=4 10147 B9R1.79 C=CC(=O)CN1CCC1 Amb25027309 [0,1,0,1,0,0|2,0,0]=4 10148 B9R1.79 CC(CC1CCC1)CO Amb24402725 [0,1,0,1,0,0|1,0,1]=4 10149 B9R1.79 CCC(=O)CC1CNC1 Amb25060246 [0,1,0,1,0,0|2,0,0]=4 10150 B9R1.79 CCC(=O)CN1CCC1 Amb25842020 [0,1,0,1,0,0|2,0,0]=4 10151 B9R1.79 CCC(=O)NC1CCC1 Amb25693768 [0,1,0,1,0,0|2,0,0]=4 10152 B9R1.79 CCC(=O)OC1CCC1 Amb25851974 [0,1,0,1,0,0|2,0,0]=4 10153 B9R1.79 CCC(O)CC1CCC1 Amb24479921 [0,1,0,1,0,0|1,0,1]=4 10154 B9R1.79 CC[C@@H](O)CC1CCC1 Amb24700781 [0,1,0,1,0,0|1,0,1]=4 10155 B9R1.79 CC[C@H](O)CC1CCC1 Amb24481965 [0,1,0,1,0,0|1,0,1]=4 10156 B9R1.79 CNC(=N)CC1CCC1 Amb25126435 [0,1,0,1,0,0|2,0,0]=4 10157 B9R1.79 CNC(=O)CC1CCC1 Amb25679813 [0,1,0,1,0,0|1,0,0]=3 10158 B9R1.79 CNC(=O)CC1CNC1 Amb25188925 [0,1,0,1,0,0|2,0,0]=4 10159 B9R1.79 CNC(=O)NC1CCC1 Amb25830627 [0,1,0,1,0,0|2,0,0]=4 10160 B9R1.79 COC(=N)CC1CCC1 Amb25728236 [0,1,0,1,0,0|1,0,0]=3 10161 B9R1.79 COC(=N)CN1CCC1 Amb25713970 [0,1,0,1,0,0|2,0,0]=4 10162 B9R1.79 COC(=O)C=C1CCC1 Amb22232619 [0,1,0,1,0,0|0,0,2]=4 10163 B9R1.79 COC(=O)CC1CNC1 Amb21960730 [0,1,0,1,0,0|1,0,0]=3 10164 B9R1.79 COC(=O)CC1CNC1 Amb21962978 [0,1,0,1,0,0|1,0,0]=3 10165 B9R1.79 COC(=O)CC1CNC1 Amb22057369 [0,1,0,1,0,0|1,0,0]=3 10166 B9R1.79 COC(=O)CC1COC1 Amb21960725 [0,1,0,1,0,0|1,0,0]=3 10167 B9R1.79 COC(=O)CN1CCC1 Amb24481984 [0,1,0,1,0,0|1,0,0]=3 10168 B9R1.79 COC(=O)NC1CCC1 Amb24761329 [0,1,0,1,0,0|1,0,0]=3 10169 B9R1.79 NC(CC1CCC1)=NO Amb24479922 [0,1,0,1,0,0|1,0,0]=3 10170 B9R1.79 NC(CC1CCC1)CO Amb24601442 [0,1,0,1,0,0|1,0,1]=4 10171 B9R1.79 NCC(=O)CC1CCC1 Amb24680522 [0,1,0,1,0,0|1,0,0]=3 10172 B9R1.79 NCC(=O)NC1CCC1 Amb18961312 [0,1,0,1,0,0|2,0,0]=4 10173 B9R1.79 NCC(=O)OC1CCC1 Amb18295938 [0,1,0,1,0,0|2,0,0]=4 10174 B9R1.79 NN=C(N)CC1CCC1 Amb25339959 [0,1,0,1,0,0|2,0,0]=4 10175 B9R1.79 NNC(=O)CC1CCS1 Amb24615787 [0,1,0,1,0,0|2,0,0]=4 10176 B9R1.79 NNC(=O)NC1CCC1 Amb25686991 [0,1,0,1,0,0|2,0,0]=4 10177 B9R1.79 O=C(CBr)CC1CCC1 Amb24392754 [0,1,0,1,0,0|1,0,0]=3 10178 B9R1.79 O=C(CCl)CC1CCC1 Amb24655482 [0,1,0,1,0,0|1,0,0]=3 10179 B9R1.79 O=C(CF)NC1CCC1 Amb24377670 [0,1,0,1,0,0|2,0,0]=4 10180 B9R1.79 O=C(CS)NC1CCC1 Amb24478681 [0,1,0,1,0,0|1,1,0]=4 10181 B9R1.79 OC(CC1CCC1)CCl Amb24374081 [0,1,0,1,0,0|1,0,1]=4 10182 B9R1.79 OCC(=O)OC1CCC1 Amb25802506 [0,1,0,1,0,0|1,0,0]=3 10183 B9R1.79 OCC(=O)OC1COC1 Amb24683681 [0,1,0,1,0,0|2,0,0]=4 10184 B9R1.79 OCC(F)CC1CCC1 Amb24518712 [0,1,0,1,0,0|1,0,1]=4 10185 B9R1.79 ONC(=O)CC1CCC1 Amb24641259 [0,1,0,1,0,0|0,0,0]=2 10186 B9R1.79 ONC(=O)CC1CNC1 Amb24478635 [0,1,0,1,0,0|1,0,0]=3 10187 B9R1.88 CC(CC)C1OC1CO Amb25699932 [0,1,0,1,0,0|0,0,2]=4 10188 B9R1.88 CCC(=O)[C@@H]1O[C@H]1CC Amb24534297 [0,1,0,1,0,0|2,0,0]=4 10189 B9R1.88 CCC1CC1C(=O)C#C Amb25374204 [0,1,0,1,0,0|1,0,0]=3 10190 B9R1.88 CCC1CC1C(=O)NC Amb25264117 [0,1,0,1,0,0|1,0,0]=3 10191 B9R1.88 CCC1CC1C(=O)OC Amb24601476 [0,1,0,1,0,0|0,0,0]=2 10192 B9R1.88 CCC1CC1C(O)C=C Amb25024912 [0,1,0,1,0,0|1,0,1]=4 10193 B9R1.88 CC[C@@H]1C[C@H]1C(=O)C=C Amb25335783 [0,1,0,1,0,0|1,0,0]=3 10194 B9R1.88 CC[C@@H]1C[C@H]1C(=O)CN Amb25198853 [0,1,0,1,0,0|1,0,0]=3 10195 B9R1.88 COC(=O)C1CC1C=C Amb24387009 [0,1,0,1,0,0|0,0,2]=4 10196 B9R1.88 COC(=O)C1CC1C=O Amb24480363 [0,1,0,1,0,0|1,0,1]=4 10197 B9R1.88 COC(=O)C1CC1CBr Amb25122701 [0,1,0,1,0,0|1,0,0]=3 10198 B9R1.88 COC(=O)C1CC1CN Amb22011650 [0,1,0,1,0,0|1,0,0]=3 10199 B9R1.88 COC(=O)C1CC1CN Amb22546318 [0,1,0,1,0,0|1,0,0]=3 10200 B9R1.88 COC(=O)C1CC1CO Amb25185377 [0,1,0,1,0,0|1,0,0]=3 10201 B9R1.88 COC(=O)C1OC1CBr Amb25690928 [0,1,0,1,0,0|2,0,0]=4 10202 B9R1.88 COC(=O)[C@@H]1CC1CO Amb25831869 [0,1,0,1,0,0|1,0,0]=3 10203 B9R1.88 COC(=O)[C@@H]1C[C@@H]1C=O Amb24617207 [0,1,0,1,0,0|1,0,1]=4 10204 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CN Amb22900923 [0,1,0,1,0,0|1,0,0]=3 10205 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO Amb24575289 [0,1,0,1,0,0|1,0,0]=3 10206 B9R1.88 COC(=O)[C@@H]1C[C@H]1C#N Amb24579735 [0,1,0,1,0,0|1,0,1]=4 10207 B9R1.88 COC(=O)[C@@H]1C[C@H]1CN Amb24517267 [0,1,0,1,0,0|1,0,0]=3 10208 B9R1.88 COC(=O)[C@@H]1O[C@H]1CBr Amb25236632 [0,1,0,1,0,0|2,0,0]=4 10209 B9R1.88 COC(=O)[C@@H]1O[C@H]1CO Amb24107515 [0,1,0,1,0,0|2,0,0]=4 10210 B9R1.88 COC(=O)[C@H]1C[C@@H]1C=O Amb24722901 [0,1,0,1,0,0|1,0,1]=4 10211 B9R1.88 C[C@@H](CC)C1OC1CO Amb24384312 [0,1,0,1,0,0|0,0,2]=4 10212 B9R1.88 C[C@@H](CC)[C@@H]1O[C@H]1CO Amb24616273 [0,1,0,1,0,0|0,0,2]=4 10213 B9R1.88 NNC(=O)C1CC1CO Amb24576885 [0,1,0,1,0,0|2,0,0]=4 10214 B9R1.88 NNC(=O)[C@@H]1C[C@H]1CO Amb25177034 [0,1,0,1,0,0|2,0,0]=4 10215 B9R1.88 NNC(=O)[C@H]1C[C@H]1CO Amb24598763 [0,1,0,1,0,0|2,0,0]=4 10216 B9R1.113 CC1(CC(=C)CO)CC1 Amb25687574 [0,1,0,1,0,0|1,0,0]=3 10217 B9R1.113 CC1(CC(=O)NO)CC1 Amb25741100 [0,1,0,1,0,0|0,0,0]=2 10218 B9R1.113 CC1(CC(N)CO)CC1 Amb24120611 [0,1,0,1,0,0|1,0,1]=4 10219 B9R1.113 CC1(CC1)NC(=O)C#C Amb25204561 [0,1,0,1,0,0|2,0,0]=4 10220 B9R1.113 CC1(CC1)NC(=O)NN Amb25701277 [0,1,0,1,0,0|2,0,0]=4 10221 B9R1.113 CC1(C[C@H](N)CO)CC1 Amb25705265 [0,1,0,1,0,0|1,0,1]=4 10222 B9R1.113 CCC(=O)CC1(C)CO1 Amb25032167 [0,1,0,1,0,0|2,0,0]=4 10223 B9R1.113 CCC(=O)CC1(N)CC1 Amb24618272 [0,1,0,1,0,0|2,0,0]=4 10224 B9R1.113 CNC(=O)CC1(N)CC1 Amb24674318 [0,1,0,1,0,0|2,0,0]=4 10225 B9R1.113 COC(=O)CC1(N)CC1 Amb21962518 [0,1,0,1,0,0|1,0,0]=3 10226 B9R1.113 COC(=O)CC1(N)CC1 Amb22001404 [0,1,0,1,0,0|1,0,0]=3 10227 B9R1.113 NNC(=O)CC1(N)CC1 Amb25379157 [0,1,0,1,0,0|2,0,0]=4 10228 B9R1.187 C[C@H]1[C@@H](C1=C)C(=O)OC Amb24514937 [0,1,0,1,0,0|0,0,2]=4 10229 B9R1.36 CC1(O)CC(C)C(C)C1 Amb24477851 [0,1,0,1,0,0|1,0,1]=4 10230 B9R1.36 CC1CS(=O)(=O)CC1N Amb24340271 [0,1,0,1,0,0|1,0,1]=4 10231 B9R1.36 CC1OP(O)(=O)OC1C Amb25195066 [0,1,0,1,0,0|2,0,0]=4 10232 B9R1.36 CC1OS(=O)(=O)CC1C Amb25174069 [0,1,0,1,0,0|1,0,0]=3 10233 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@@H]1N Amb25124954 [0,1,0,1,0,0|1,0,1]=4 10234 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@H]1N Amb24587782 [0,1,0,1,0,0|1,0,1]=4 10235 B9R1.36 C[C@@H]1OP(=O)(Cl)O[C@H]1C Amb22801716 [0,1,0,1,0,0|2,0,0]=4 10236 B9R1.36 C[C@@H]1OS(=O)(=O)O[C@@H]1C Amb24733568 [0,1,0,1,0,0|2,0,0]=4 10237 B9R1.36 C[C@H]1CS(=O)(=O)C[C@H]1N Amb25222669 [0,1,0,1,0,0|1,0,1]=4 10238 B9R1.36 C[C@H]1OP(=O)(Cl)O[C@@H]1C Amb22350643 [0,1,0,1,0,0|2,0,0]=4 10239 B9R1.36 OC1CS(=O)(=O)CC1C Amb2233406 [0,1,0,1,0,0|1,0,1]=4 10240 B9R1.112 CC(C)C(C)CC1CO1 Amb24501686 [0,1,0,1,0,0|1,0,1]=4 10241 B9R1.139 CC(=O)C1C(Cl)C1(C)C Amb25685934 [0,1,0,1,0,0|2,0,0]=4 10242 B9R1.139 CC(=O)[C@@H]1[C@@H](Cl)C1(C)C Amb24356148 [0,1,0,1,0,0|2,0,0]=4 10243 B9R1.139 CC(=O)[C@@H]1[C@H](Br)C1(C)C Amb25372498 [0,1,0,1,0,0|2,0,0]=4 10244 B9R1.139 CC(=O)[C@@H]1[C@H](Cl)C1(C)C Amb25696574 [0,1,0,1,0,0|2,0,0]=4 10245 B9R1.139 CC1(C)C(C1=C)C(O)=O Amb25188905 [0,1,0,1,0,0|0,0,2]=4 10246 B9R1.139 CC1(C)C(Cl)C1C(O)=O Amb25772915 [0,1,0,1,0,0|1,0,0]=3 10247 B9R1.139 CC1(C)[C@@H](Br)[C@H]1C(O)=O Amb24593888 [0,1,0,1,0,0|1,0,0]=3 10248 B9R1.139 CC1(C)[C@H](Cl)[C@@H]1C(O)=O Amb24674137 [0,1,0,1,0,0|1,0,0]=3 10249 B9R1.139 CC1=C(C(O)=O)C1(C)C Amb24393001 [0,1,0,1,0,0|0,0,2]=4 10250 B9R1.139 CC1C(C(=O)Cl)C1(C)C Amb25088892 [0,1,0,1,0,0|1,0,0]=3 10251 B9R1.139 CC1C(C(=O)Cl)C1(F)F Amb25728049 [0,1,0,1,0,0|2,0,0]=4 10252 B9R1.139 CC1C(C(C)=O)C1(C)Cl Amb25701016 [0,1,0,1,0,0|1,0,0]=3 10253 B9R1.139 CC1C(C(C)=O)C1(Cl)Cl Amb24456530 [0,1,0,1,0,0|2,0,0]=4 10254 B9R1.139 CC1C(C(C)O)C1(C)C Amb25722239 [0,1,0,1,0,0|1,0,1]=4 10255 B9R1.139 CC1C(C(N)=O)C1(C)C Amb24700436 [0,1,0,1,0,0|1,0,0]=3 10256 B9R1.139 CC1C(C(O)=O)C1(C)C Amb25296484 [0,1,0,1,0,0|0,0,0]=2 10257 B9R1.139 CC1C(C(O)=O)C1(F)F Amb19515667 [0,1,0,1,0,0|1,0,0]=3 10258 B9R1.139 C[C@@H]1[C@@H](C(=O)Cl)C1(C)C Amb24691335 [0,1,0,1,0,0|1,0,0]=3 10259 B9R1.139 C[C@@H]1[C@@H](C(C)=O)[C@]1(C)Cl Amb24577773 [0,1,0,1,0,0|1,0,0]=3 10260 B9R1.139 C[C@@H]1[C@H](C(C)O)C1(C)C Amb24515422 [0,1,0,1,0,0|1,0,1]=4 10261 B9R1.139 C[C@H]1[C@H](C(O)=O)C1(Cl)Cl Amb25275824 [0,1,0,1,0,0|1,0,0]=3 10262 B9R1.152 CC(=C)C1(C)CC(=O)N1 Amb25791049 [0,1,0,1,0,0|1,0,1]=4 10263 B9R1.152 CC(=C)[C@@]1(C)CC(=O)N1 Amb24524194 [0,1,0,1,0,0|1,0,1]=4 10264 B9R1.152 CC(=O)[C@]1(C)CC(=O)O1 Amb24340260 [0,1,0,1,0,0|0,0,1]=3 10265 B9R1.152 CC(Cl)C1(C)CC(=O)O1 Amb25701611 [0,1,0,1,0,0|0,0,0]=2 10266 B9R1.161 CC(=C)[C@@H]1C[C@@H]1C(O)=O Amb24514832 [0,1,0,1,0,0|0,0,1]=3 10267 B9R1.161 CC(=O)C1C[C@H]1C(C)=O Amb25319021 [0,1,0,1,0,0|1,0,1]=4 10268 B9R1.161 CC(=O)C1OC1C(O)=O Amb25233192 [0,1,0,1,0,0|1,0,1]=4 10269 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [0,1,0,1,0,0|0,0,0]=2 10270 B9R1.161 CC(C)[C@@H]1C[C@@H]1C(C)=O Amb24610096 [0,1,0,1,0,0|1,0,0]=3 10271 B9R1.161 CC(C)[C@@H]1C[C@H]1C(C)=O Amb24621711 [0,1,0,1,0,0|1,0,0]=3 10272 B9R1.161 CC(C)[C@@H]1O[C@@H]1C(O)=O Amb24546994 [0,1,0,1,0,0|1,0,0]=3 10273 B9R1.161 CC(C)[C@H]1O[C@@H]1C(C)=O Amb25204929 [0,1,0,1,0,0|2,0,0]=4 10274 B9R1.161 CC(C)[C@H]1O[C@@H]1C(O)=O Amb25229035 [0,1,0,1,0,0|1,0,0]=3 10275 B9R1.161 CC(O)C1OC1C(O)=O Amb25227852 [0,1,0,1,0,0|1,0,0]=3 10276 B9R1.161 C[C@@H](O)[C@H]1O[C@@H]1C(O)=O Amb25224671 [0,1,0,1,0,0|1,0,0]=3 10277 B9R1.161 C[C@H](O)[C@@H]1O[C@@H]1C(O)=O Amb25368573 [0,1,0,1,0,0|1,0,0]=3 10278 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [0,1,0,1,0,0|1,0,1]=4 10279 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(O)=O Amb24623178 [0,1,0,1,0,0|1,0,1]=4 10280 B9R1.161 OC(=O)C1CC1C(=O)O Amb1350467 [0,1,0,1,0,0|1,0,1]=4 10281 B9R1.161 OC(=O)C1CC1C(F)F Amb25338314 [0,1,0,1,0,0|1,0,0]=3 10282 B9R1.161 OC(=O)[C@@H]1C[C@@H]1C(=O)Cl Amb25175103 [0,1,0,1,0,0|1,0,1]=4 10283 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(=O)Cl Amb24402096 [0,1,0,1,0,0|1,0,1]=4 10284 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(F)F Amb24654017 [0,1,0,1,0,0|1,0,0]=3 10285 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(O)=O Amb22901897 [0,1,0,1,0,0|1,0,1]=4 10286 B9R1.161 OC(=O)[C@H]1C[C@@H]1C(F)F Amb25360822 [0,1,0,1,0,0|1,0,0]=3 10287 B9R1.161 [O-][N+](=O)[C@@H]1C[C@H]1C(O)=O Amb25109456 [0,1,0,1,0,0|2,0,0]=4 10288 B9R1.161 [O-][N+](=O)[C@H]1C[C@H]1C(O)=O Amb25755764 [0,1,0,1,0,0|2,0,0]=4 10289 B9R1.164 CC(N)C1CS(=O)(=O)C1 Amb25196074 [0,1,0,1,0,0|1,0,1]=4 10290 B9R1.170 CC(=O)CC1CC1(C)C Amb24722807 [0,1,0,1,0,0|1,0,0]=3 10291 B9R1.170 CC(=O)CC1CC1(F)F Amb25370357 [0,1,0,1,0,0|2,0,0]=4 10292 B9R1.170 CC(=O)NC1CC1(C)C Amb25237099 [0,1,0,1,0,0|2,0,0]=4 10293 B9R1.170 CC1(C)CC1=CC(O)=O Amb25056977 [0,1,0,1,0,0|0,0,2]=4 10294 B9R1.170 CC1(C)CC1CC(O)=O Amb25145962 [0,1,0,1,0,0|0,0,0]=2 10295 B9R1.170 CC1(C)CC1NC(N)=O Amb25800580 [0,1,0,1,0,0|2,0,0]=4 10296 B9R1.170 CC1(C)O[C@H]1CC(O)=O Amb25719083 [0,1,0,1,0,0|1,0,0]=3 10297 B9R1.170 NC(=O)CC1CC1(F)F Amb24393874 [0,1,0,1,0,0|2,0,0]=4 10298 B9R1.170 OC(=O)CC1CC1(F)F Amb22411507 [0,1,0,1,0,0|1,0,0]=3 10299 B9R1.47 CC1CC1CS(=O)(=O)Cl Amb25709771 [0,1,0,1,0,0|1,0,1]=4 10300 B9R1.47 CC1CC1CS(N)(=O)=O Amb25342147 [0,1,0,1,0,0|1,0,1]=4 10301 B9R1.68 CC1CCC1S(=O)(=O)Cl Amb24532584 [0,1,0,1,0,0|1,0,1]=4 10302 B9R1.68 CC1CCC1S(N)(=O)=O Amb25833817 [0,1,0,1,0,0|1,0,1]=4 10303 B9R1.87 CCC1CC1S(=O)(=O)Cl Amb24116962 [0,1,0,1,0,0|1,0,1]=4 10304 B9R1.87 NCC1CC1S(O)(=O)=O Amb24513720 [0,1,0,1,0,0|2,0,0]=4 10305 B9R1.87 NC[C@@H]1C[C@H]1S(O)(=O)=O Amb25307974 [0,1,0,1,0,0|2,0,0]=4 10306 B9R1.87 NC[C@H]1C[C@H]1S(O)(=O)=O Amb24562931 [0,1,0,1,0,0|2,0,0]=4 10307 B9R1.114 NS(=O)(=O)CC1CCC1 Amb22059636 [0,1,0,1,0,0|1,0,1]=4 10308 B9R1.114 O=S(=O)(Cl)CC1CCC1 Amb22001639 [0,1,0,1,0,0|1,0,1]=4 10309 B9R1.146 CC1(Br)CCS(=O)(=O)C1 Amb2548450 [0,1,0,1,0,0|1,0,1]=4 10310 B9R1.146 CC1(C)CCC(C)(O)C1 Amb25103316 [0,1,0,1,0,0|1,0,1]=4 10311 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb1152696 [0,1,0,1,0,0|1,0,1]=4 10312 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb17913039 [0,1,0,1,0,0|1,0,1]=4 10313 B9R1.146 C[C@]1(N)CS(=O)(=O)CC1 Amb24745885 [0,1,0,1,0,0|1,0,1]=4 10314 B9R1.146 [O-][S+]1(=O)CCC(C1)(C)[NH3+] Amb10236889 [0,1,0,1,0,0|1,0,1]=4 10315 B9R1.156 CC(C)(CO)C1OC1=O Amb17942848 [0,1,0,1,0,0|1,0,0]=3 10316 B9R1.156 CC(C)(CO)[C@H]1OC1=O Amb24532903 [0,1,0,1,0,0|1,0,0]=3 10317 B9R1.156 OCC([C@@H]1OC1=O)(C)C Amb10603242 [0,1,0,1,0,0|1,0,0]=3 10318 B9R1.166 CC(=O)C1CCC1(C)F Amb24582230 [0,1,0,1,0,0|1,0,0]=3 10319 B9R1.166 CC(=O)N1CCC1(C)C Amb24481904 [0,1,0,1,0,0|2,0,0]=4 10320 B9R1.166 CC(O)C1CCC1(C)C Amb24518053 [0,1,0,1,0,0|1,0,1]=4 10321 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [0,1,0,1,0,0|0,0,0]=2 10322 B9R1.166 CC1(C)CCN1C(N)=O Amb24354806 [0,1,0,1,0,0|2,0,0]=4 10323 B9R1.166 CC1(C)CNC1C(O)=O Amb24117326 [0,1,0,1,0,0|1,0,0]=3 10324 B9R1.166 NC(=O)C1CCC1(F)F Amb25355623 [0,1,0,1,0,0|2,0,0]=4 10325 B9R1.166 OC(=O)C1CCC1(F)F Amb24452747 [0,1,0,1,0,0|1,0,0]=3 10326 B9R2.18 CC1C2CNC(=O)C21 Amb24516348 [0,0,0,2,0,0|1,0,0]=3 10327 B9R2.18 CC1[C@H]2[C@H](O)CC[C@H]21 Amb25235724 [0,0,0,2,0,0|1,0,1]=4 10328 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [0,0,0,2,0,0|1,0,1]=4 10329 B9R2.20 O=C1C=C[C@@H]2CC[C@H]12 Amb25373394 [0,0,0,2,0,0|1,0,1]=4 10330 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,0,0,2,0,0|1,0,0]=3 10331 B9R2.20 OC1CCC2CCC21 Amb24395686 [0,0,0,2,0,0|1,0,1]=4 10332 B9R2.20 OC1CC[C@@H]2CC[C@@H]21 Amb24642457 [0,0,0,2,0,0|1,0,1]=4 10333 B9R2.31 C[C@@H]1[C@@H]2C[C@H]1CC2=O Amb24588878 [0,0,0,2,0,0|1,0,0]=3 10334 B9R2.31 C[C@H]1[C@@H]2C[C@H]1C[C@H]2O Amb24550216 [0,0,0,2,0,0|1,0,1]=4 10335 B9R2.31 O=C1CC2CC1C2Cl Amb24753521 [0,0,0,2,0,0|2,0,0]=4 10336 B9R2.33 O=C1C[C@@H]2CC[C@H]2C1 Amb24614774 [0,0,0,2,0,0|1,0,0]=3 10337 B9R2.33 O=C1C[C@H]2CC[C@@H]2C1 Amb24724072 [0,0,0,2,0,0|1,0,0]=3 10338 B9R2.39 C[C@@H]1CN2CC[C@@H]1O2 Amb24574991 [0,0,0,2,0,0|2,0,0]=4 10339 B9R2.39 C[C@H]1C[C@@H]2CC[C@H]1O2 Amb24586711 [0,0,0,2,0,0|1,0,1]=4 10340 B9R2.39 O=C1CC2CC1CN2 Amb24376697 [0,0,0,2,0,0|2,0,0]=4 10341 B9R2.39 O=C1CC2CCC1O2 Amb25322815 [0,0,0,2,0,0|2,0,0]=4 10342 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,0,0,2,0,0|2,0,0]=4 10343 B9R2.39 O=C1CN2CC1CC2 Amb10067112 [0,0,0,2,0,0|2,0,0]=4 10344 B9R2.39 O=C1CN2CC1CC2 Amb20171539 [0,0,0,2,0,0|2,0,0]=4 10345 B9R2.39 O=C1C[C@@H]2CC[C@H]1N2 Amb25259133 [0,0,0,2,0,0|2,0,0]=4 10346 B9R2.39 O=C1C[C@@H]2CC[C@H]1O2 Amb25233773 [0,0,0,2,0,0|2,0,0]=4 10347 B9R2.39 O=C1C[C@@H]2C[C@@H]1CC2 Amb25205819 [0,0,0,2,0,0|1,0,0]=3 10348 B9R2.39 O=C1C[C@@H]2C[C@H]1CC2 Amb24583541 [0,0,0,2,0,0|1,0,0]=3 10349 B9R2.39 O=C1C[C@H]2CO[C@@H]1C2 Amb24571771 [0,0,0,2,0,0|2,0,0]=4 10350 B9R2.39 O=C1NC2CC1CC2 Amb20623082 [0,0,0,2,0,0|2,0,0]=4 10351 B9R2.39 O=C1N[C@H]2CC1CC2 Amb25857407 [0,0,0,2,0,0|2,0,0]=4 10352 B9R2.39 O=C1N[C@H]2C[C@@H]1CC2 Amb25174368 [0,0,0,2,0,0|2,0,0]=4 10353 B9R2.39 OC1C[C@@H]2C[C@H]1CC2 Amb24556818 [0,0,0,2,0,0|1,0,1]=4 10354 B9R2.39 ON1CC2CC1CC2 Amb25376585 [0,0,0,2,0,0|2,0,0]=4 10355 B9R2.39 O[C@@H]1CC2CC1CC2 Amb22363271 [0,0,0,2,0,0|1,0,1]=4 10356 B9R2.39 O[C@@H]1CC2C[C@H]1CC2 Amb25266771 [0,0,0,2,0,0|1,0,1]=4 10357 B9R2.39 O[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25176323 [0,0,0,2,0,0|1,0,1]=4 10358 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CC2 Amb10844941 [0,0,0,2,0,0|1,0,1]=4 10359 B9R2.39 O[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22744882 [0,0,0,2,0,0|1,0,1]=4 10360 B9R2.39 O[C@H]1CC2CC1CC2 Amb25759926 [0,0,0,2,0,0|1,0,1]=4 10361 B9R2.39 O[C@H]1C[C@@H]2C[C@@H]1CC2 Amb25204244 [0,0,0,2,0,0|1,0,1]=4 10362 B9R2.39 O[C@H]1C[C@H]2C[C@@H]1CC2 Amb24567063 [0,0,0,2,0,0|1,0,1]=4 10363 B9R2.54 CC1C2CC(O)CC21 Amb24705654 [0,0,0,2,0,0|1,0,1]=4 10364 B9R2.54 C[C@@H]1[C@@H]2CC(=O)C[C@@H]21 Amb24602923 [0,0,0,2,0,0|1,0,0]=3 10365 B9R2.54 C[C@@H]1[C@H]2CC(=O)C[C@H]21 Amb24645439 [0,0,0,2,0,0|1,0,0]=3 10366 B9R2.68 C1ON2CC1CCC2 Amb24333259 [0,0,0,2,0,0|2,0,0]=4 10367 B9R2.68 C1ON2C[C@@H]1CCC2 Amb25760706 [0,0,0,2,0,0|2,0,0]=4 10368 B9R2.110 OC12CC(CC1)CC2 Amb22235809 [0,0,0,2,0,0|1,0,1]=4 10369 B9R2.139 C=C1CC2(CC1)CC2 Amb24483142 [0,0,0,2,0,0|2,0,0]=4 10370 B9R2.139 CC1CC2(CO2)CC1 Amb25678922 [0,0,0,2,0,0|1,0,1]=4 10371 B9R2.139 O=C1CC2(CO1)CC2 Amb25662215 [0,0,0,2,0,0|0,0,0]=2 10372 B9R2.139 O=C1CCC2(N1)CC2 Amb16186647 [0,0,0,2,0,0|2,0,0]=4 10373 B9R2.139 O=C1NC2(CN1)CC2 Amb24482030 [0,0,0,2,0,0|2,0,0]=4 10374 B9R2.139 O=C1NC2(CO1)CC2 Amb24572471 [0,0,0,2,0,0|1,0,0]=3 10375 B9R2.139 O=C1NCC2(CC2)O1 Amb25789822 [0,0,0,2,0,0|2,0,0]=4 10376 B9R2.8 O=C1CC2CC(C1)C2 Amb25706934 [0,0,0,2,0,0|1,0,0]=3 10377 B9R2.8 O=C1NC2CC(C2)O1 Amb24524286 [0,0,0,2,0,0|1,0,0]=3 10378 B9R2.8 OC1CC2CC(C1)C2 Amb24719737 [0,0,0,2,0,0|1,0,1]=4 10379 B9R2.21 CC1CCC2C(C1)O2 Amb1141335 [0,0,0,2,0,0|1,0,1]=4 10380 B9R2.21 O=C1CC2OC2CC1 Amb24408509 [0,0,0,2,0,0|2,0,0]=4 10381 B9R2.21 O=C1C[C@@H]2C[C@H]2CC1 Amb25294409 [0,0,0,2,0,0|1,0,0]=3 10382 B9R2.21 O=C1N[C@H]2C[C@H]2CO1 Amb24630201 [0,0,0,2,0,0|1,0,0]=3 10383 B9R2.21 OC1CC2CC2CC1 Amb25169523 [0,0,0,2,0,0|1,0,1]=4 10384 B9R2.21 OC1C[C@@H]2C[C@H]2CC1 Amb25307522 [0,0,0,2,0,0|1,0,1]=4 10385 B9R2.21 O[C@@H]1C[C@H]2C[C@H]2CC1 Amb25288224 [0,0,0,2,0,0|1,0,1]=4 10386 B9R2.21 O[C@H]1C[C@@H]2C[C@@H]2CC1 Amb25024733 [0,0,0,2,0,0|1,0,1]=4 10387 B9R2.21 O[C@H]1C[C@H]2C[C@H]2CC1 Amb24556801 [0,0,0,2,0,0|1,0,1]=4 10388 B9R2.25 CC1=CC(=O)C2CC12 Amb25833652 [0,0,0,2,0,0|1,0,1]=4 10389 B9R2.25 C[C@@H]1CC(=O)[C@H]2O[C@H]21 Amb25348559 [0,0,0,2,0,0|2,0,0]=4 10390 B9R2.25 O=C1OC(=O)C2C1C2 Amb2445133 [0,0,0,2,0,0|1,0,1]=4 10391 B9R2.25 OC1OC(=O)C2CC21 Amb25809854 [0,0,0,2,0,0|1,0,0]=3 10392 B9R2.29 OC1CC2NC(=O)C21 Amb25272666 [0,0,0,2,0,0|2,0,0]=4 10393 B9R2.38 CC12CC1CC(=O)C2 Amb24357249 [0,0,0,2,0,0|1,0,0]=3 10394 B9R2.38 NC12CC1NC(=O)C2 Amb25848870 [0,0,0,2,0,0|2,0,0]=4 10395 B9R2.109 C=C1CCCC2CC12 Amb25790226 [0,0,0,2,0,0|2,0,0]=4 10396 B9R2.109 O=C1CCCC2C1C2 Amb17593139 [0,0,0,2,0,0|1,0,0]=3 10397 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|2,0,0]=4 10398 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [0,0,0,2,0,0|1,0,0]=3 10399 B9R2.109 O=C1CCC[C@@H]2O[C@@H]12 Amb25373140 [0,0,0,2,0,0|2,0,0]=4 10400 B9R2.109 O=C1CCC[C@@H]2O[C@H]12 Amb24631684 [0,0,0,2,0,0|2,0,0]=4 10401 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [0,0,0,2,0,0|1,0,0]=3 10402 B9R2.109 O=C1CCC[C@H]2O[C@@H]12 Amb25252262 [0,0,0,2,0,0|2,0,0]=4 10403 B9R2.109 O=C1CCOC2CC12 Amb25729127 [0,0,0,2,0,0|2,0,0]=4 10404 B9R2.109 O=C1NCCC2CC12 Amb25717930 [0,0,0,2,0,0|1,0,0]=3 10405 B9R2.109 O=C1NCCC2OC12 Amb25790016 [0,0,0,2,0,0|2,0,0]=4 10406 B9R2.109 O=C1NCC[C@H]2O[C@@H]12 Amb24579393 [0,0,0,2,0,0|2,0,0]=4 10407 B9R2.109 OC1OCC[C@H]2C[C@H]21 Amb24580427 [0,0,0,2,0,0|0,0,2]=4 10408 B9R2.109 O[C@H]1CCCC2C[C@H]21 Amb25175056 [0,0,0,2,0,0|1,0,1]=4 10409 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [0,0,0,2,0,0|1,0,0]=3 10410 B9R2.150 OC(=O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|0,0,0]=2 10411 B9R2.150 OC(=O)C1NC2CC12 Amb25376606 [0,0,0,2,0,0|1,0,0]=3 10412 B9R2.137 CC1CC2(CO2)C1C Amb24721116 [0,0,0,2,0,0|1,0,1]=4 10413 B9R2.144 NC(=O)C12CC1CC2 Amb25678261 [0,0,0,2,0,0|1,0,0]=3 10414 B9R2.147 OC(=O)C1[C@@H]2C[C@H]1C2 Amb24409084 [0,0,0,2,0,0|0,0,0]=2 10415 B9R2.138 O=C1CC2(C1)CCC2 Amb20668529 [0,0,0,2,0,0|1,0,0]=3 10416 B9R2.138 O=C1CC2(CCC2)N1 Amb19149093 [0,0,0,2,0,0|1,0,0]=3 10417 B9R2.138 O=C1CC2(CNC2)C1 Amb25747338 [0,0,0,2,0,0|2,0,0]=4 10418 B9R2.138 O=C1CC2(CNC2)N1 Amb25119349 [0,0,0,2,0,0|2,0,0]=4 10419 B9R2.138 O=C1CC2(COC2)C1 Amb22406126 [0,0,0,2,0,0|2,0,0]=4 10420 B9R2.138 O=C1CC2(COC2)N1 Amb24592907 [0,0,0,2,0,0|2,0,0]=4 10421 B9R2.138 O=C1CC2(CSC2)C1 Amb22406070 [0,0,0,2,0,0|2,0,0]=4 10422 B9R2.138 OC1CC2(C1)CCC2 Amb25113635 [0,0,0,2,0,0|1,0,1]=4 10423 B9R2.148 CC(=O)[C@@H]1[C@H]2CC[C@H]21 Amb24708035 [0,0,0,2,0,0|1,0,0]=3 10424 B9R2.148 OC(=O)C1C2CCC21 Amb24350799 [0,0,0,2,0,0|0,0,0]=2 10425 B9R2.148 OC(=O)[C@@H]1[C@@H]2CC[C@@H]21 Amb24568902 [0,0,0,2,0,0|0,0,0]=2 10426 B9R2.143 CC(=O)C1CC12CC2 Amb24725286 [0,0,0,2,0,0|1,0,0]=3 10427 B9R2.143 C[C@@H](O)[C@@H]1CC12CC2 Amb25345029 [0,0,0,2,0,0|1,0,1]=4 10428 B9R2.143 C[C@H](O)[C@@H]1CC12CC2 Amb25266779 [0,0,0,2,0,0|1,0,1]=4 10429 B9R2.120 CC1(O)CCC2CC12 Amb25696393 [0,0,0,2,0,0|1,0,1]=4 10430 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [1,0,0,0,1,0|2,0,0]=4 10431 B5R0.5 CC(=C)C(O)=O Amb22230681 [1,0,0,0,1,0|0,0,2]=4 10432 B5R0.5 CC(=C)C(O)=O Amb22337777 [1,0,0,0,1,0|0,0,2]=4 10433 B5R0.5 CC(=C)C(O)=O Amb22351305 [1,0,0,0,1,0|0,0,2]=4 10434 B5R0.5 CC(=C)C(O)=O Amb22351871 [1,0,0,0,1,0|0,0,2]=4 10435 B5R0.5 CC(=C)C(O)=O Amb22351927 [1,0,0,0,1,0|0,0,2]=4 10436 B5R0.5 CC(=O)C(F)C Amb10841897 [1,0,0,0,1,0|2,0,0]=4 10437 B5R0.5 CC(=O)C(N)C Amb17593029 [1,0,0,0,1,0|2,0,0]=4 10438 B5R0.5 CC(Br)C(N)=O Amb22491874 [1,0,0,0,1,0|2,0,0]=4 10439 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [1,0,0,0,1,0|1,0,0]=3 10440 B5R0.5 CC(C(=O)N)C Amb1153145 [1,0,0,0,1,0|1,0,0]=3 10441 B5R0.5 CC(C(=O)N)Cl Amb1151918 [1,0,0,0,1,0|2,0,0]=4 10442 B5R0.5 CC(C(=O)O)F Amb10605770 [1,0,0,0,1,0|1,0,0]=3 10443 B5R0.5 CC(C)C(=C)Br Amb22583736 [1,0,0,0,1,0|2,0,0]=4 10444 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,1,0|1,0,0]=3 10445 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,1,0|1,0,0]=3 10446 B5R0.5 CC(C)C(O)O Amb25662421 [1,0,0,0,1,0|0,0,2]=4 10447 B5R0.5 CC(C)C(S)=S Amb25200225 [1,0,0,0,1,0|0,2,0]=4 10448 B5R0.5 CC(C)C([O-])=O Amb22045473 [1,0,0,0,1,0|0,0,1]=3 10449 B5R0.5 CC(C)C([O-])=O Amb22730398 [1,0,0,0,1,0|0,0,1]=3 10450 B5R0.5 CC(C)C([O-])=O Amb22734686 [1,0,0,0,1,0|0,0,1]=3 10451 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,1,0|2,0,0]=4 10452 B5R0.5 CC(C)S([O-])=O Amb19929129 [1,0,0,0,1,0|1,0,1]=4 10453 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [1,0,0,0,1,0|2,0,0]=4 10454 B5R0.5 CC(F)C(=O)Cl Amb24472500 [1,0,0,0,1,0|2,0,0]=4 10455 B5R0.5 CC(I)C(=O)Cl Amb24559615 [1,0,0,0,1,0|2,0,0]=4 10456 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,0,0,1,0|2,0,0]=4 10457 B5R0.5 CC(N)C(=O)Br Amb25184851 [1,0,0,0,1,0|2,0,0]=4 10458 B5R0.5 CC(N)C(C)=O Amb19148817 [1,0,0,0,1,0|2,0,0]=4 10459 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,0,0,1,0|2,0,0]=4 10460 B5R0.5 CC(N)P(O)=O Amb25147710 [1,0,0,0,1,0|2,0,0]=4 10461 B5R0.5 CC(N)[13C](O)=O Amb22336671 [1,0,0,0,1,0|1,0,0]=3 10462 B5R0.5 CC(O)C(=O)Cl Amb25045690 [1,0,0,0,1,0|2,0,0]=4 10463 B5R0.5 CC(O)C(O)=O Amb22350027 [1,0,0,0,1,0|1,0,0]=3 10464 B5R0.5 CC(O)C([O-])=O Amb17942960 [1,0,0,0,1,0|1,0,1]=4 10465 B5R0.5 CC(O)C([O-])=O Amb17943079 [1,0,0,0,1,0|1,0,1]=4 10466 B5R0.5 CC(O)C([O-])=O Amb20246816 [1,0,0,0,1,0|1,0,1]=4 10467 B5R0.5 CC(O)C([O-])=O Amb21936112 [1,0,0,0,1,0|1,0,1]=4 10468 B5R0.5 CC(O)C([O-])=O Amb22002445 [1,0,0,0,1,0|1,0,1]=4 10469 B5R0.5 CC(O)C([O-])=O Amb22054134 [1,0,0,0,1,0|1,0,1]=4 10470 B5R0.5 CC(O)C([O-])=O Amb22055552 [1,0,0,0,1,0|1,0,1]=4 10471 B5R0.5 CC(O)C([O-])=O Amb22167842 [1,0,0,0,1,0|1,0,1]=4 10472 B5R0.5 CC(O)C([O-])=O Amb22350448 [1,0,0,0,1,0|1,0,1]=4 10473 B5R0.5 CC(O)C([O-])=O Amb22730128 [1,0,0,0,1,0|1,0,1]=4 10474 B5R0.5 CC(O)C([O-])=O Amb22730326 [1,0,0,0,1,0|1,0,1]=4 10475 B5R0.5 CC(O)C([O-])=O Amb22731947 [1,0,0,0,1,0|1,0,1]=4 10476 B5R0.5 CC(O)C([O-])=O Amb22732237 [1,0,0,0,1,0|1,0,1]=4 10477 B5R0.5 CC(O)C([O-])=O Amb22732420 [1,0,0,0,1,0|1,0,1]=4 10478 B5R0.5 CC(O)C([O-])=O Amb22732487 [1,0,0,0,1,0|1,0,1]=4 10479 B5R0.5 CC(O)C([O-])=O Amb22732889 [1,0,0,0,1,0|1,0,1]=4 10480 B5R0.5 CC(O)C([O-])=O Amb22733874 [1,0,0,0,1,0|1,0,1]=4 10481 B5R0.5 CC(O)C([O-])=O Amb22733995 [1,0,0,0,1,0|1,0,1]=4 10482 B5R0.5 CC(O)P(O)=O Amb24333635 [1,0,0,0,1,0|2,0,0]=4 10483 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [1,0,0,0,1,0|1,0,1]=4 10484 B5R0.5 CC(P)C(N)=O Amb24715877 [1,0,0,0,1,0|2,0,0]=4 10485 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [1,0,0,0,1,0|1,0,0]=3 10486 B5R0.5 CC([O-])C([O-])=O Amb22045882 [1,0,0,0,1,0|1,0,1]=4 10487 B5R0.5 CN(C)C(=O)F Amb24660451 [1,0,0,0,1,0|2,0,0]=4 10488 B5R0.5 CN(C)C(C)=O Amb24323347 [1,0,0,0,1,0|2,0,0]=4 10489 B5R0.5 CN(C)C(N)=O Amb22739731 [1,0,0,0,1,0|2,0,0]=4 10490 B5R0.5 CN(C)C(O)=O Amb22348477 [1,0,0,0,1,0|1,0,0]=3 10491 B5R0.5 CN(C)C(O)=S Amb24477978 [1,0,0,0,1,0|1,1,0]=4 10492 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [1,0,0,0,1,0|2,0,0]=4 10493 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [1,0,0,0,1,0|1,0,0]=3 10494 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [1,0,0,0,1,0|1,0,0]=3 10495 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [1,0,0,0,1,0|2,0,0]=4 10496 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [1,0,0,0,1,0|1,0,0]=3 10497 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [1,0,0,0,1,0|2,0,0]=4 10498 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [1,0,0,0,1,0|2,0,0]=4 10499 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [1,0,0,0,1,0|2,0,0]=4 10500 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [1,0,0,0,1,0|2,0,0]=4 10501 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [1,0,0,0,1,0|2,0,0]=4 10502 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [1,0,0,0,1,0|1,0,0]=3 10503 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [1,0,0,0,1,0|1,0,1]=4 10504 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [1,0,0,0,1,0|1,0,1]=4 10505 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [1,0,0,0,1,0|2,0,0]=4 10506 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [1,0,0,0,1,0|2,0,0]=4 10507 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [1,0,0,0,1,0|1,0,0]=3 10508 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [1,0,0,0,1,0|2,0,0]=4 10509 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [1,0,0,0,1,0|2,0,0]=4 10510 B5R0.5 C[C@H](C(C)C)O Amb13952942 [1,0,0,0,1,0|1,0,1]=4 10511 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,0,0,1,0|2,0,0]=4 10512 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [1,0,0,0,1,0|1,0,0]=3 10513 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [1,0,0,0,1,0|1,0,0]=3 10514 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [1,0,0,0,1,0|2,0,0]=4 10515 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,0,0,1,0|2,0,0]=4 10516 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [1,0,0,0,1,0|2,0,0]=4 10517 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [1,0,0,0,1,0|2,0,0]=4 10518 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [1,0,0,0,1,0|1,0,1]=4 10519 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [1,0,0,0,1,0|1,0,1]=4 10520 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [1,0,0,0,1,0|1,0,1]=4 10521 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [1,0,0,0,1,0|1,0,1]=4 10522 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [1,0,0,0,1,0|1,0,0]=3 10523 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [1,0,0,0,1,0|1,0,0]=3 10524 B5R0.5 FC(C(=O)O)F Amb1953492 [1,0,0,0,1,0|2,0,0]=4 10525 B5R0.5 IC(C(=O)O)I Amb17612865 [1,0,0,0,1,0|2,0,0]=4 10526 B5R0.5 NC(=O)C(N)C Amb1156937 [1,0,0,0,1,0|2,0,0]=4 10527 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [1,0,0,0,1,0|2,0,0]=4 10528 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [1,0,0,0,1,0|2,0,0]=4 10529 B5R0.5 NC(Br)C(O)=O Amb25724348 [1,0,0,0,1,0|2,0,0]=4 10530 B5R0.5 NC(O)C(O)=O Amb24663706 [1,0,0,0,1,0|2,0,0]=4 10531 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [1,0,0,0,1,0|2,0,0]=4 10532 B5R0.5 OB(C(C)C)O Amb2447044 [1,0,0,0,1,0|1,0,1]=4 10533 B5R0.5 OC(=O)C(Br)F Amb10841090 [1,0,0,0,1,0|2,0,0]=4 10534 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [1,0,0,0,1,0|2,0,0]=4 10535 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [1,0,0,0,1,0|2,0,0]=4 10536 B5R0.5 OC(=O)C(Cl)F Amb10838714 [1,0,0,0,1,0|2,0,0]=4 10537 B5R0.5 OC(=O)C(F)S Amb25272480 [1,0,0,0,1,0|2,0,0]=4 10538 B5R0.5 OC(=O)C(I)Br Amb17610018 [1,0,0,0,1,0|2,0,0]=4 10539 B5R0.5 OC(=O)C(I)Cl Amb17610937 [1,0,0,0,1,0|2,0,0]=4 10540 B5R0.5 OC(=O)C(I)F Amb10838458 [1,0,0,0,1,0|2,0,0]=4 10541 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [1,0,0,0,1,0|2,0,0]=4 10542 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [1,0,0,0,1,0|2,0,0]=4 10543 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [1,0,0,0,1,0|2,0,0]=4 10544 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [1,0,0,0,1,0|2,0,0]=4 10545 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [1,0,0,0,1,0|2,0,0]=4 10546 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [1,0,0,0,1,0|2,0,0]=4 10547 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [1,0,0,0,1,0|1,0,0]=3 10548 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [1,0,0,0,1,0|1,0,0]=3 10549 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [1,0,0,0,1,0|1,0,0]=3 10550 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [1,0,0,0,1,0|1,0,0]=3 10551 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [1,0,0,0,1,0|1,0,1]=4 10552 B9R0.1 CC(C#N)SCCC(O)=O Amb18800092 [0,0,0,0,0,2|1,0,1]=4 10553 B9R0.1 CC(C=C)NCCC(O)=O Amb24662882 [0,0,0,0,0,2|0,0,2]=4 10554 B9R0.1 CC(C=C)ONCC(O)=O Amb24658665 [0,0,0,0,0,2|0,0,2]=4 10555 B9R0.1 CC(C=C)SCCC(O)=O Amb18182545 [0,0,0,0,0,2|0,0,2]=4 10556 B9R0.1 CC(C=C)\C=C\CC(O)=O Amb18643542 [0,0,0,0,0,2|0,0,2]=4 10557 B9R0.1 CC(CBr)=NOCC(O)=O Amb24747167 [0,0,0,0,0,2|1,0,1]=4 10558 B9R0.1 CC(CC)=NNCC(N)=O Amb24482886 [0,0,0,0,0,2|1,0,1]=4 10559 B9R0.1 CC(CC)=NNCC(O)=O Amb25162373 [0,0,0,0,0,2|0,0,1]=3 10560 B9R0.1 CC(CC)=NOCC(N)=O Amb24482942 [0,0,0,0,0,2|1,0,1]=4 10561 B9R0.1 CC(CC)=NOCC(O)=O Amb25266480 [0,0,0,0,0,2|0,0,1]=3 10562 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,0,0,0,0,2|1,0,1]=4 10563 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,0,0,0,0,2|0,0,2]=4 10564 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,0,0,0,0,2|1,0,0]=3 10565 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,0,0,0,0,2|1,0,0]=3 10566 B9R0.1 CC(CCl)CCOC(C)=O Amb25757561 [0,0,0,0,0,2|2,0,0]=4 10567 B9R0.1 CC(CN)CNCC(O)=O Amb25773527 [0,0,0,0,0,2|1,0,0]=3 10568 B9R0.1 CC(CN)NCCC(N)=O Amb24602322 [0,0,0,0,0,2|2,0,0]=4 10569 B9R0.1 CC(CN)NCCC(O)=O Amb24520910 [0,0,0,0,0,2|1,0,0]=3 10570 B9R0.1 CC(CN)OCCC(C)=O Amb18630514 [0,0,0,0,0,2|2,0,0]=4 10571 B9R0.1 CC(CN)OCCC(O)=O Amb18629690 [0,0,0,0,0,2|1,0,0]=3 10572 B9R0.1 CC(CNCC(N)=O)CN Amb25185175 [0,0,0,0,0,2|2,0,0]=4 10573 B9R0.1 CC(CNCC(O)=O)C#N Amb25027854 [0,0,0,0,0,2|1,0,1]=4 10574 B9R0.1 CC(CO)CSCC(C)=O Amb24702606 [0,0,0,0,0,2|2,0,0]=4 10575 B9R0.1 CC(CO)NCCC(O)=O Amb17719769 [0,0,0,0,0,2|1,0,0]=3 10576 B9R0.1 CC(CO)SCCC(C)=O Amb24393859 [0,0,0,0,0,2|2,0,0]=4 10577 B9R0.1 CC(CO)SCCC(N)=O Amb25146975 [0,0,0,0,0,2|2,0,0]=4 10578 B9R0.1 CC(C\C=C\C(O)=O)C#N Amb24670837 [0,0,0,0,0,2|1,0,1]=4 10579 B9R0.1 CC(C\C=C\C(O)=O)C=C Amb24598302 [0,0,0,0,0,2|0,0,2]=4 10580 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,0,0,0,0,2|1,0,1]=4 10581 B9R0.1 CCC(Br)CCNC(C)=O Amb24388776 [0,0,0,0,0,2|2,0,0]=4 10582 B9R0.1 CCC(C)C#CCC(C)=O Amb25047884 [0,0,0,0,0,2|1,0,0]=3 10583 B9R0.1 CCC(C)C#CCC(C)O Amb25344899 [0,0,0,0,0,2|1,0,1]=4 10584 B9R0.1 CCC(C)C=NNC(C)=O Amb25106422 [0,0,0,0,0,2|1,0,1]=4 10585 B9R0.1 CCC(C)CC#CC(O)=O Amb24661749 [0,0,0,0,0,2|0,0,0]=2 10586 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,0,0,0,0,2|2,0,0]=4 10587 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,0,0,0,0,2|1,0,0]=3 10588 B9R0.1 CCC(C)CCCC(N)=O Amb24350177 [0,0,0,0,0,2|1,0,0]=3 10589 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,0,0,0,0,2|0,0,0]=2 10590 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,0,0,0,0,2|1,0,0]=3 10591 B9R0.1 CCC(C)CCOC(N)=O Amb24478211 [0,0,0,0,0,2|1,0,0]=3 10592 B9R0.1 CCC(C)CNCC(=C)Br Amb25044418 [0,0,0,0,0,2|2,0,0]=4 10593 B9R0.1 CCC(C)CNCC(=C)Cl Amb18182593 [0,0,0,0,0,2|2,0,0]=4 10594 B9R0.1 CCC(C)CNCC(C)=C Amb24434834 [0,0,0,0,0,2|2,0,0]=4 10595 B9R0.1 CCC(C)CNC[C@@H](C)O Amb25045168 [0,0,0,0,0,2|1,0,1]=4 10596 B9R0.1 CCC(C)CON=C(C)C Amb24673290 [0,0,0,0,0,2|2,0,0]=4 10597 B9R0.1 CCC(C)CONC(C)=O Amb25097564 [0,0,0,0,0,2|1,0,0]=3 10598 B9R0.1 CCC(C)CSCC(=C)Cl Amb24449060 [0,0,0,0,0,2|2,0,0]=4 10599 B9R0.1 CCC(C)CSCC(C)=C Amb25209723 [0,0,0,0,0,2|2,0,0]=4 10600 B9R0.1 CCC(C)CSCC(C)O Amb25733215 [0,0,0,0,0,2|1,0,1]=4 10601 B9R0.1 CCC(C)CSCC(N)=N Amb25115224 [0,0,0,0,0,2|2,0,0]=4 10602 B9R0.1 CCC(C)CSCC(N)=O Amb25218767 [0,0,0,0,0,2|1,0,0]=3 10603 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,0,0,0,0,2|0,0,0]=2 10604 B9R0.1 CCC(C)NCCC(C)O Amb25093108 [0,0,0,0,0,2|1,0,1]=4 10605 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,0,0,0,0,2|1,0,0]=3 10606 B9R0.1 CCC(C)NCC[C@@H](C)O Amb25796571 [0,0,0,0,0,2|1,0,1]=4 10607 B9R0.1 CCC(C)NCC[C@H](C)O Amb25769129 [0,0,0,0,0,2|1,0,1]=4 10608 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,0,0,0,0,2|1,0,0]=3 10609 B9R0.1 CCC(C)OCCC(N)=N Amb25769907 [0,0,0,0,0,2|2,0,0]=4 10610 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,0,0,0,0,2|1,1,0]=4 10611 B9R0.1 CCC(C)O\C=C\C(C)=O Amb24690824 [0,0,0,0,0,2|1,0,1]=4 10612 B9R0.1 CCC(C)SCC=C(C)C Amb25740029 [0,0,0,0,0,2|2,0,0]=4 10613 B9R0.1 CCC(C)SCCC(N)=O Amb18798042 [0,0,0,0,0,2|1,0,0]=3 10614 B9R0.1 CCC(C)S\C=C\C(O)=O Amb24431541 [0,0,0,0,0,2|0,0,1]=3 10615 B9R0.1 CCC(C)\C=C/CC(C)=O Amb24708353 [0,0,0,0,0,2|1,0,0]=3 10616 B9R0.1 CCC(C)\C=C\CC(C)=O Amb24518460 [0,0,0,0,0,2|1,0,0]=3 10617 B9R0.1 CCC(Cl)CCCC(=O)Cl Amb25088358 [0,0,0,0,0,2|2,0,0]=4 10618 B9R0.1 CCC(Cl)CCNC(C)=O Amb24407934 [0,0,0,0,0,2|2,0,0]=4 10619 B9R0.1 CCC(Cl)CONC(N)=O Amb25102083 [0,0,0,0,0,2|2,0,0]=4 10620 B9R0.1 CCC(F)CCCC(C)=O Amb25320248 [0,0,0,0,0,2|2,0,0]=4 10621 B9R0.1 CCC(F)CONC(C)=O Amb24482758 [0,0,0,0,0,2|2,0,0]=4 10622 B9R0.1 CCC(F)CONC(N)=O Amb25057369 [0,0,0,0,0,2|2,0,0]=4 10623 B9R0.1 CCC(N)CCNC(C)=O Amb25369840 [0,0,0,0,0,2|2,0,0]=4 10624 B9R0.1 CCC(N)COCC(C)=O Amb18103858 [0,0,0,0,0,2|2,0,0]=4 10625 B9R0.1 CCC(N)COCC(N)=O Amb25776983 [0,0,0,0,0,2|2,0,0]=4 10626 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,0,0,0,0,2|1,0,0]=3 10627 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [0,0,0,0,0,2|2,0,0]=4 10628 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,0,0,0,0,2|1,0,0]=3 10629 B9R0.1 CCC(O)CCOC(C)=O Amb25345386 [0,0,0,0,0,2|2,0,0]=4 10630 B9R0.1 CCC(O)CCSC(C)=O Amb24379978 [0,0,0,0,0,2|2,0,0]=4 10631 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,0,0,0,0,2|1,0,0]=3 10632 B9R0.1 CCC(O)CONC(N)=O Amb24685077 [0,0,0,0,0,2|2,0,0]=4 10633 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,0,0,0,0,2|1,0,0]=3 10634 B9R0.1 CCN(C)CCNC(N)=O Amb25187364 [0,0,0,0,0,2|2,0,0]=4 10635 B9R0.1 CCN(C)C\C=C\C(O)=O Amb19020698 [0,0,0,0,0,2|1,0,0]=3 10636 B9R0.1 CCS(=O)CCCC(O)=O Amb18788302 [0,0,0,0,0,2|2,0,0]=4 10637 B9R0.1 CC[C@H](C)C#CCC(C)O Amb25788131 [0,0,0,0,0,2|1,0,1]=4 10638 B9R0.1 CC[C@H](C)CCCC(C)=O Amb25128211 [0,0,0,0,0,2|1,0,0]=3 10639 B9R0.1 CC[C@H](O)CNCC(N)=O Amb24658160 [0,0,0,0,0,2|2,0,0]=4 10640 B9R0.1 CC\C(\C)=C/CCC(C)=O Amb25138109 [0,0,0,0,0,2|1,0,1]=4 10641 B9R0.1 COC(C)CCCC(C)=O Amb25146522 [0,0,0,0,0,2|2,0,0]=4 10642 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,0,0,0,0,2|1,0,0]=3 10643 B9R0.1 COC(C)CCOC(=O)Cl Amb22168236 [0,0,0,0,0,2|2,0,0]=4 10644 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,0,0,0,0,2|2,0,0]=4 10645 B9R0.1 COC(C)CCOC(N)=O Amb25679672 [0,0,0,0,0,2|2,0,0]=4 10646 B9R0.1 COC(C)CNCC(O)=O Amb25695493 [0,0,0,0,0,2|1,0,0]=3 10647 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,0,0,0,0,2|1,0,0]=3 10648 B9R0.1 CSC(C)CCNC(N)=O Amb25685722 [0,0,0,0,0,2|2,0,0]=4 10649 B9R0.1 CSC(C)CNCC(N)=O Amb25766612 [0,0,0,0,0,2|2,0,0]=4 10650 B9R0.1 CSC(C)CNCC(O)=O Amb25137618 [0,0,0,0,0,2|1,0,0]=3 10651 B9R0.1 CSC(C)\C=C\CC(O)=O Amb18645413 [0,0,0,0,0,2|1,0,0]=3 10652 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,0,0,0,0,2|0,0,2]=4 10653 B9R0.1 C[C@@H](CO)CCOC(C)=O Amb24464645 [0,0,0,0,0,2|2,0,0]=4 10654 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,0,0,0,0,2|0,0,2]=4 10655 B9R0.1 C[C@H](CO)CCCC(C)=O Amb25335279 [0,0,0,0,0,2|2,0,0]=4 10656 B9R0.1 C[C@H](CO)CCNC(C)=O Amb24502371 [0,0,0,0,0,2|2,0,0]=4 10657 B9R0.1 C\C(\CBr)=N/OCC(O)=O Amb25350489 [0,0,0,0,0,2|1,0,1]=4 10658 B9R0.1 C\C(\CCCC(O)=O)=C\C Amb25063828 [0,0,0,0,0,2|0,0,2]=4 10659 B9R0.1 C\C(\CNCC(O)=O)=C/C Amb24351586 [0,0,0,0,0,2|0,0,2]=4 10660 B9R0.1 C\C(\CNCC(O)=O)=C\C Amb25175094 [0,0,0,0,0,2|0,0,2]=4 10661 B9R0.1 C\C(\COCC(O)=O)=C\C Amb25293393 [0,0,0,0,0,2|0,0,2]=4 10662 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,0,0,0,0,2|2,0,0]=4 10663 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,0,0,0,0,2|2,0,0]=4 10664 B9R0.1 NCC(N)COCC(O)=O Amb24677956 [0,0,0,0,0,2|2,0,0]=4 10665 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,0,0,0,0,2|2,0,0]=4 10666 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,0,0,0,0,2|2,0,0]=4 10667 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,0,0,0,0,2|2,0,0]=4 10668 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,0,0,0,0,2|2,0,0]=4 10669 B9R0.1 OC(=O)COCC(S)CS Amb18129098 [0,0,0,0,0,2|2,0,0]=4 10670 B9R0.1 OCC(O)C=NCC(O)=O Amb25113464 [0,0,0,0,0,2|2,0,0]=4 10671 B9R0.1 OCC(O)CNCC(O)=O Amb24360971 [0,0,0,0,0,2|2,0,0]=4 10672 B9R0.1 OCC(O)COCC(O)=O Amb24534716 [0,0,0,0,0,2|2,0,0]=4