0 B6R0.3 C#CC(=O)C(O)=O Amb25252554 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.3 C#CC(O)C(O)=O Amb22731622 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [0,0,0,0,0,0|1,0,3]=4 3 B6R0.3 C/C(=N\O)[N+]([O-])=O Amb17939341 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.3 C=C(C#N)C(N)=O Amb18638807 [0,0,0,0,0,0|2,0,2]=4 5 B6R0.3 C=C(C#N)C(O)=O Amb18638894 [0,0,0,0,0,0|1,0,2]=3 6 B6R0.3 C=C(C=C)C(O)=O Amb24394371 [0,0,0,0,0,0|0,0,2]=2 7 B6R0.3 C=C(CBr)C(N)=O Amb24709965 [0,0,0,0,0,0|2,0,2]=4 8 B6R0.3 C=C(CF)C(O)=O Amb25215375 [0,0,0,0,0,0|1,0,2]=3 9 B6R0.3 C=C(CI)C(O)=O Amb24419641 [0,0,0,0,0,0|1,0,2]=3 10 B6R0.3 C=C(CN)C(O)=O Amb25200864 [0,0,0,0,0,0|1,0,2]=3 11 B6R0.3 C=C(CO)C(=O)Cl Amb25169545 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.3 C=C(CO)C(O)=O Amb18121817 [0,0,0,0,0,0|1,0,2]=3 13 B6R0.3 C=C(Cl)\C(\Cl)=C/Cl Amb24527729 [0,0,0,0,0,0|4,0,0]=4 14 B6R0.3 C=CC(=C(F)F)Cl Amb10839865 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.3 C=CC(=C(F)F)F Amb10838414 [0,0,0,0,0,0|3,0,1]=4 16 B6R0.3 C=CC(=O)C(O)=O Amb22011796 [0,0,0,0,0,0|1,0,1]=2 17 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [0,0,0,0,0,0|1,0,2]=3 18 B6R0.3 C=CC(Cl)C(N)=O Amb24479818 [0,0,0,0,0,0|2,0,2]=4 19 B6R0.3 C=CC(N)C(N)=O Amb24689093 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.3 C=CC(N)C(O)=O Amb20240543 [0,0,0,0,0,0|1,0,2]=3 21 B6R0.3 C=CC(O)C(O)=O Amb24061247 [0,0,0,0,0,0|1,0,2]=3 22 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [0,0,0,0,0,0|1,0,2]=3 23 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [0,0,0,0,0,0|1,0,2]=3 24 B6R0.3 C=C[C@@H](O)C(N)=O Amb25791152 [0,0,0,0,0,0|2,0,2]=4 25 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [0,0,0,0,0,0|1,0,2]=3 26 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [0,0,0,0,0,0|1,0,2]=3 27 B6R0.3 C=NC(=O)C(N)=O Amb25062977 [0,0,0,0,0,0|3,0,1]=4 28 B6R0.3 CC(=C)C(=C)OC Amb24502709 [0,0,0,0,0,0|3,0,1]=4 29 B6R0.3 CC(=C)C(=O)NC Amb17934099 [0,0,0,0,0,0|4,0,0]=4 30 B6R0.3 CC(=C)C(=O)OC Amb22336447 [0,0,0,0,0,0|4,0,0]=4 31 B6R0.3 CC(=C)C(=O)OC Amb22353205 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.3 CC(=C)C(=O)OC Amb22733129 [0,0,0,0,0,0|4,0,0]=4 33 B6R0.3 CC(=C)C(=S)NC Amb24582626 [0,0,0,0,0,0|4,0,0]=4 34 B6R0.3 CC(=C)C(Br)=CCl Amb24614331 [0,0,0,0,0,0|4,0,0]=4 35 B6R0.3 CC(=C)C(F)=CCl Amb24525760 [0,0,0,0,0,0|4,0,0]=4 36 B6R0.3 CC(=C)\C(\Br)=C\Cl Amb25053901 [0,0,0,0,0,0|4,0,0]=4 37 B6R0.3 CC(=C)\C(\Cl)=C/Cl Amb24333226 [0,0,0,0,0,0|4,0,0]=4 38 B6R0.3 CC(=C)\C(\Cl)=C\Br Amb25831522 [0,0,0,0,0,0|4,0,0]=4 39 B6R0.3 CC(=C=C)C(=O)O Amb17593066 [0,0,0,0,0,0|0,0,2]=2 40 B6R0.3 CC(=C=C)C(N)=O Amb24632718 [0,0,0,0,0,0|1,0,2]=3 41 B6R0.3 CC(=C=C)P(O)=O Amb25328941 [0,0,0,0,0,0|1,0,2]=3 42 B6R0.3 CC(=C=S)C(C)=O Amb25143391 [0,0,0,0,0,0|2,0,1]=3 43 B6R0.3 CC(=CCl)B(Cl)Cl Amb24650015 [0,0,0,0,0,0|4,0,0]=4 44 B6R0.3 CC(=CCl)C(C)=C Amb25176038 [0,0,0,0,0,0|3,0,0]=3 45 B6R0.3 CC(=CCl)C(C)=O Amb25807396 [0,0,0,0,0,0|2,0,0]=2 46 B6R0.3 CC(=CCl)C(O)=O Amb25692582 [0,0,0,0,0,0|1,0,0]=1 47 B6R0.3 CC(=CCl)N(C)C Amb25147561 [0,0,0,0,0,0|4,0,0]=4 48 B6R0.3 CC(=CN)C(C)=O Amb25804374 [0,0,0,0,0,0|2,0,0]=2 49 B6R0.3 CC(=CN)C(O)=O Amb25375168 [0,0,0,0,0,0|1,0,0]=1 50 B6R0.3 CC(=CO)C(C)=O Amb25377802 [0,0,0,0,0,0|2,0,0]=2 51 B6R0.3 CC(=CO)C(O)=O Amb25745269 [0,0,0,0,0,0|1,0,0]=1 52 B6R0.3 CC(=NBr)C(O)=O Amb24518467 [0,0,0,0,0,0|2,0,0]=2 53 B6R0.3 CC(=NC)C(C)=O Amb25179556 [0,0,0,0,0,0|2,0,0]=2 54 B6R0.3 CC(=NC)C(N)=O Amb25339049 [0,0,0,0,0,0|2,0,0]=2 55 B6R0.3 CC(=NO)[N+]([O-])=O Amb25254890 [0,0,0,0,0,0|3,0,1]=4 56 B6R0.3 CC(=O)C(=C)C#N Amb24706747 [0,0,0,0,0,0|2,0,2]=4 57 B6R0.3 CC(=O)C(=C)CBr Amb24478554 [0,0,0,0,0,0|2,0,2]=4 58 B6R0.3 CC(=O)C(=C)CCl Amb25141482 [0,0,0,0,0,0|2,0,2]=4 59 B6R0.3 CC(=O)C(=C)CO Amb24571845 [0,0,0,0,0,0|2,0,2]=4 60 B6R0.3 CC(=O)C(=O)C=C Amb25169560 [0,0,0,0,0,0|2,0,1]=3 61 B6R0.3 CC(=O)C(=O)C=O Amb25281133 [0,0,0,0,0,0|3,0,0]=3 62 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,0,0,0,0,0|3,0,1]=4 63 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,0,0,0,0,0|3,0,1]=4 64 B6R0.3 CC(=O)C(=O)ON Amb25093731 [0,0,0,0,0,0|4,0,0]=4 65 B6R0.3 CC(=O)C(=O)O[K] Amb20246763 [0,0,0,0,0,0|4,0,0]=4 66 B6R0.3 CC(=O)C(=O)O[Na] Amb18511533 [0,0,0,0,0,0|4,0,0]=4 67 B6R0.3 CC(=O)C(Br)=CCl Amb25173100 [0,0,0,0,0,0|3,0,0]=3 68 B6R0.3 CC(=O)C(Br)=CO Amb25233141 [0,0,0,0,0,0|3,0,0]=3 69 B6R0.3 CC(=O)C(Br)=NO Amb25811082 [0,0,0,0,0,0|4,0,0]=4 70 B6R0.3 CC(=O)C(C)=C=O Amb25735802 [0,0,0,0,0,0|2,0,1]=3 71 B6R0.3 CC(=O)C(Cl)=CBr Amb25811590 [0,0,0,0,0,0|3,0,0]=3 72 B6R0.3 CC(=O)C(Cl)=CCl Amb24078667 [0,0,0,0,0,0|3,0,0]=3 73 B6R0.3 CC(=O)C(Cl)=NO Amb25790855 [0,0,0,0,0,0|4,0,0]=4 74 B6R0.3 CC(=O)C(N)=CO Amb25264865 [0,0,0,0,0,0|3,0,0]=3 75 B6R0.3 CC(=O)C(O)=CO Amb25302267 [0,0,0,0,0,0|3,0,0]=3 76 B6R0.3 CC(=O)C(O)C=O Amb24715304 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [0,0,0,0,0,0|3,0,1]=4 78 B6R0.3 CC(=O)N(C)CCl Amb24428489 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.3 CC(=O)N(C)N=O Amb25259815 [0,0,0,0,0,0|4,0,0]=4 80 B6R0.3 CC(=O)[C@@H](O)C=C Amb25662172 [0,0,0,0,0,0|2,0,2]=4 81 B6R0.3 CC(=O)[C@H](O)C=C Amb24480657 [0,0,0,0,0,0|2,0,2]=4 82 B6R0.3 CC(=O)\C(=C\O)\Br Amb17232510 [0,0,0,0,0,0|3,0,0]=3 83 B6R0.3 CC(=O)\C(\Br)=C\N Amb25710227 [0,0,0,0,0,0|3,0,0]=3 84 B6R0.3 CC(=O)\C(\Br)=N\O Amb25233762 [0,0,0,0,0,0|4,0,0]=4 85 B6R0.3 CC(=O)\C(\Cl)=C/C Amb24736181 [0,0,0,0,0,0|2,0,0]=2 86 B6R0.3 CC(=O)\C(\Cl)=N/O Amb24436488 [0,0,0,0,0,0|4,0,0]=4 87 B6R0.3 CC(=O)\C(\O)=C\O Amb24621662 [0,0,0,0,0,0|3,0,0]=3 88 B6R0.3 CC(C#C)C(O)=O Amb25085390 [0,0,0,0,0,0|0,0,3]=3 89 B6R0.3 CC(C#N)=C(C)Cl Amb25338138 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.3 CC(C#N)=C(C)N Amb24616957 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.3 CC(C#N)C(N)=O Amb25336872 [0,0,0,0,0,0|2,0,2]=4 92 B6R0.3 CC(C#N)C([O-])=O Amb22057371 [0,0,0,0,0,0|1,0,3]=4 93 B6R0.3 CC(C#N)S(O)=O Amb25745526 [0,0,0,0,0,0|2,0,2]=4 94 B6R0.3 CC(C(=O)C)CO Amb10844844 [0,0,0,0,0,0|2,0,2]=4 95 B6R0.3 CC(C(=O)O)C#N Amb17210512 [0,0,0,0,0,0|1,0,2]=3 96 B6R0.3 CC(C)=C(Br)C=O Amb18645747 [0,0,0,0,0,0|4,0,0]=4 97 B6R0.3 CC(C)=C(C)C=O Amb18639155 [0,0,0,0,0,0|3,0,0]=3 98 B6R0.3 CC(C)=C(C)CBr Amb25257988 [0,0,0,0,0,0|3,0,1]=4 99 B6R0.3 CC(C)=C(C)CN Amb18121233 [0,0,0,0,0,0|3,0,1]=4 100 B6R0.3 CC(C)=C(C)CO Amb25107300 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.3 CC(C)=C(Cl)C=O Amb18640665 [0,0,0,0,0,0|4,0,0]=4 102 B6R0.3 CC(C)C(C)=CBr Amb24333014 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.3 CC(C=C)C(C)=C Amb22228297 [0,0,0,0,0,0|2,0,2]=4 104 B6R0.3 CC(C=C)C(O)=O Amb21618706 [0,0,0,0,0,0|0,0,2]=2 105 B6R0.3 CC(C=O)=C(C)Br Amb25309571 [0,0,0,0,0,0|3,0,0]=3 106 B6R0.3 CC(C=O)=C(C)S Amb24513083 [0,0,0,0,0,0|2,1,0]=3 107 B6R0.3 CC(C=O)C(C)=C Amb18639176 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.3 CC(C=O)C(C)=O Amb18639572 [0,0,0,0,0,0|2,0,1]=3 109 B6R0.3 CC(C=O)C(N)=O Amb24479831 [0,0,0,0,0,0|2,0,1]=3 110 B6R0.3 CC(CBr)C(C)=O Amb25296678 [0,0,0,0,0,0|2,0,2]=4 111 B6R0.3 CC(CBr)C(O)=O Amb22002601 [0,0,0,0,0,0|1,0,2]=3 112 B6R0.3 CC(CC)C(O)Br Amb24635628 [0,0,0,0,0,0|1,0,3]=4 113 B6R0.3 CC(CCl)=C(Cl)Cl Amb25839931 [0,0,0,0,0,0|3,0,1]=4 114 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [0,0,0,0,0,0|2,0,2]=4 115 B6R0.3 CC(CCl)C(=O)S Amb24410197 [0,0,0,0,0,0|1,1,2]=4 116 B6R0.3 CC(CCl)C(N)=O Amb25061744 [0,0,0,0,0,0|2,0,2]=4 117 B6R0.3 CC(CCl)C(O)=O Amb18522181 [0,0,0,0,0,0|1,0,2]=3 118 B6R0.3 CC(CF)C(C)=O Amb25253758 [0,0,0,0,0,0|2,0,2]=4 119 B6R0.3 CC(CF)C(O)=O Amb24432331 [0,0,0,0,0,0|1,0,2]=3 120 B6R0.3 CC(CI)C(O)=O Amb25695307 [0,0,0,0,0,0|1,0,2]=3 121 B6R0.3 CC(CN)=C(Cl)Cl Amb25213024 [0,0,0,0,0,0|3,0,1]=4 122 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [0,0,0,0,0,0|2,0,2]=4 123 B6R0.3 CC(CN)C(C)=O Amb18639690 [0,0,0,0,0,0|2,0,2]=4 124 B6R0.3 CC(CO)C([O-])=O Amb24123145 [0,0,0,0,0,0|1,0,3]=4 125 B6R0.3 CC(CS)C(C)=O Amb25830693 [0,0,0,0,0,0|2,0,2]=4 126 B6R0.3 CC(CS)C(N)=O Amb25759660 [0,0,0,0,0,0|2,0,2]=4 127 B6R0.3 CC(Cl)C(C)=CCl Amb25662810 [0,0,0,0,0,0|3,0,1]=4 128 B6R0.3 CC(Cl)\C(\C)=C/Cl Amb24635525 [0,0,0,0,0,0|3,0,1]=4 129 B6R0.3 CC(N=C)C(O)=O Amb24591339 [0,0,0,0,0,0|1,0,2]=3 130 B6R0.3 CC(NBr)C(O)=O Amb24677636 [0,0,0,0,0,0|2,0,1]=3 131 B6R0.3 CC(NCl)C(O)=O Amb25267473 [0,0,0,0,0,0|2,0,1]=3 132 B6R0.3 CC(NN)C(O)=O Amb18640367 [0,0,0,0,0,0|2,0,1]=3 133 B6R0.3 CC(O)=C(Br)C=O Amb25810089 [0,0,0,0,0,0|3,0,0]=3 134 B6R0.3 CC(O)=C(O)C=O Amb25747147 [0,0,0,0,0,0|3,0,0]=3 135 B6R0.3 CC(O)C(C)=NO Amb24379868 [0,0,0,0,0,0|3,0,1]=4 136 B6R0.3 CC(O)\C(\C)=C\Br Amb25689239 [0,0,0,0,0,0|2,0,1]=3 137 B6R0.3 CC(OC)C(C)O Amb22757090 [0,0,0,0,0,0|2,0,2]=4 138 B6R0.3 CC(OC)[C@@H](C)O Amb25831986 [0,0,0,0,0,0|2,0,2]=4 139 B6R0.3 CC(ON)C(O)=O Amb24479235 [0,0,0,0,0,0|2,0,1]=3 140 B6R0.3 CC(SC)C(C)O Amb25326277 [0,0,0,0,0,0|2,0,2]=4 141 B6R0.3 CC=C(C)C(C)O Amb22232295 [0,0,0,0,0,0|1,0,1]=2 142 B6R0.3 CCC(=C(F)F)F Amb10840895 [0,0,0,0,0,0|3,0,1]=4 143 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [0,0,0,0,0,0|1,0,2]=3 144 B6R0.3 CCC(=C)C(C)O Amb24414973 [0,0,0,0,0,0|1,0,3]=4 145 B6R0.3 CCC(=C)C(N)=O Amb24480748 [0,0,0,0,0,0|1,0,2]=3 146 B6R0.3 CCC(=C)C(O)=O Amb18639591 [0,0,0,0,0,0|0,0,2]=2 147 B6R0.3 CCC(=C)[C@@H](C)O Amb24363621 [0,0,0,0,0,0|1,0,3]=4 148 B6R0.3 CCC(=O)C(=C)Br Amb24406631 [0,0,0,0,0,0|3,0,1]=4 149 B6R0.3 CCC(=O)C(=C)Cl Amb24646425 [0,0,0,0,0,0|3,0,1]=4 150 B6R0.3 CCC(=O)C(C)O Amb24479536 [0,0,0,0,0,0|2,0,2]=4 151 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,0,0|2,0,1]=3 152 B6R0.3 CCC(=O)C(N)=S Amb24447086 [0,0,0,0,0,0|2,1,1]=4 153 B6R0.3 CCC(=O)C(O)=O Amb22274199 [0,0,0,0,0,0|1,0,1]=2 154 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [0,0,0,0,0,0|1,0,2]=3 155 B6R0.3 CCC(=O)N(C)O Amb24628846 [0,0,0,0,0,0|3,0,1]=4 156 B6R0.3 CCC(B(O)O)C Amb10071974 [0,0,0,0,0,0|1,0,3]=4 157 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,0,0,0,0|2,0,2]=4 158 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,0,0,0,0|2,0,2]=4 159 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [0,0,0,0,0,0|2,0,2]=4 160 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [0,0,0,0,0,0|2,0,2]=4 161 B6R0.3 CCC(C(=O)N)Br Amb13952819 [0,0,0,0,0,0|2,0,2]=4 162 B6R0.3 CCC(C(=O)N)N Amb1914080 [0,0,0,0,0,0|2,0,2]=4 163 B6R0.3 CCC(C(=O)O)S Amb17501370 [0,0,0,0,0,0|1,0,2]=3 164 B6R0.3 CCC(C)C(=C)Br Amb22583745 [0,0,0,0,0,0|2,0,2]=4 165 B6R0.3 CCC(C)S([O-])=O Amb19893328 [0,0,0,0,0,0|1,0,3]=4 166 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,0,0,0,0|2,0,2]=4 167 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,0,0,0,0|2,0,2]=4 168 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,0,0,0,0|2,0,2]=4 169 B6R0.3 CCC(F)C(C)=O Amb24736393 [0,0,0,0,0,0|2,0,2]=4 170 B6R0.3 CCC(F)C(N)=O Amb25811426 [0,0,0,0,0,0|2,0,2]=4 171 B6R0.3 CCC(F)C(O)=O Amb25716167 [0,0,0,0,0,0|1,0,2]=3 172 B6R0.3 CCC(I)C(N)=O Amb25131171 [0,0,0,0,0,0|2,0,2]=4 173 B6R0.3 CCC(N)C(=O)S Amb24479075 [0,0,0,0,0,0|1,1,2]=4 174 B6R0.3 CCC(N)C(C)=O Amb18202785 [0,0,0,0,0,0|2,0,2]=4 175 B6R0.3 CCC(N)P(O)=O Amb25269903 [0,0,0,0,0,0|2,0,2]=4 176 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,0,0,0,0|2,0,2]=4 177 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,0,0,0,0|2,0,2]=4 178 B6R0.3 CCC(O)C(O)=O Amb22352315 [0,0,0,0,0,0|1,0,2]=3 179 B6R0.3 CCC(O)C(O)=O Amb22360643 [0,0,0,0,0,0|1,0,2]=3 180 B6R0.3 CCC(O)C([O-])=O Amb17943026 [0,0,0,0,0,0|1,0,3]=4 181 B6R0.3 CCC(O)C([O-])=O Amb24325325 [0,0,0,0,0,0|1,0,3]=4 182 B6R0.3 CCC(O)P(O)=O Amb25169578 [0,0,0,0,0,0|2,0,2]=4 183 B6R0.3 CCC(S)C(N)=O Amb24479879 [0,0,0,0,0,0|2,0,2]=4 184 B6R0.3 CCN(C)C(C)=N Amb25107219 [0,0,0,0,0,0|3,0,1]=4 185 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,0,0,0,0,0|2,0,1]=3 186 B6R0.3 CCN(O)C(N)=O Amb24669876 [0,0,0,0,0,0|3,0,1]=4 187 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [0,0,0,0,0,0|2,0,2]=4 188 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [0,0,0,0,0,0|2,0,2]=4 189 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [0,0,0,0,0,0|1,0,2]=3 190 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [0,0,0,0,0,0|1,0,2]=3 191 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,0,0,0,0|2,0,2]=4 192 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [0,0,0,0,0,0|1,0,2]=3 193 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [0,0,0,0,0,0|1,0,2]=3 194 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,0,0,0,0|2,0,2]=4 195 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,0,0,0,0|2,0,2]=4 196 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [0,0,0,0,0,0|2,0,2]=4 197 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [0,0,0,0,0,0|1,0,2]=3 198 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [0,0,0,0,0,0|2,0,2]=4 199 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [0,0,0,0,0,0|1,0,2]=3 200 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [0,0,0,0,0,0|1,0,2]=3 201 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,0,0,0,0,0|1,0,3]=4 202 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [0,0,0,0,0,0|1,0,2]=3 203 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [0,0,0,0,0,0|1,1,2]=4 204 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [0,0,0,0,0,0|2,0,2]=4 205 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [0,0,0,0,0,0|1,0,2]=3 206 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [0,0,0,0,0,0|1,0,2]=3 207 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [0,0,0,0,0,0|2,0,2]=4 208 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [0,0,0,0,0,0|2,0,2]=4 209 B6R0.3 CN(CCl)C(=O)Cl Amb25076174 [0,0,0,0,0,0|3,0,1]=4 210 B6R0.3 CN(N=O)C(N)=O Amb22727977 [0,0,0,0,0,0|4,0,0]=4 211 B6R0.3 CN=C(C)C(C)Cl Amb25242430 [0,0,0,0,0,0|3,0,1]=4 212 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [0,0,0,0,0,0|2,0,0]=2 213 B6R0.3 CNC(=C)C(O)=O Amb25743212 [0,0,0,0,0,0|1,0,1]=2 214 B6R0.3 CNC(=N)C(O)=O Amb18639921 [0,0,0,0,0,0|2,0,0]=2 215 B6R0.3 CNC(=N)S(O)=O Amb24436462 [0,0,0,0,0,0|3,0,0]=3 216 B6R0.3 CNC(=O)C(=C)Cl Amb24721854 [0,0,0,0,0,0|4,0,0]=4 217 B6R0.3 CNC(=O)C(=O)C Amb17399787 [0,0,0,0,0,0|3,0,0]=3 218 B6R0.3 CNC(=O)C(O)=S Amb25265217 [0,0,0,0,0,0|2,1,0]=3 219 B6R0.3 CNC(=S)C(N)=O Amb24436379 [0,0,0,0,0,0|3,0,0]=3 220 B6R0.3 CNC(=S)C(O)=O Amb24479905 [0,0,0,0,0,0|2,0,0]=2 221 B6R0.3 CNC(=S)N(C)O Amb24479524 [0,0,0,0,0,0|4,0,0]=4 222 B6R0.3 CNC(C)C(C)=C Amb22231024 [0,0,0,0,0,0|3,0,1]=4 223 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,0,0,0,0,0|2,0,1]=3 224 B6R0.3 CNC(C)C(N)=N Amb24719013 [0,0,0,0,0,0|3,0,1]=4 225 B6R0.3 CNC(C)C(O)=O Amb19373699 [0,0,0,0,0,0|1,0,1]=2 226 B6R0.3 CNN(C)C(N)=N Amb25859142 [0,0,0,0,0,0|4,0,0]=4 227 B6R0.3 CNN(C)C(N)=S Amb24744906 [0,0,0,0,0,0|3,1,0]=4 228 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,0,0,0,0|2,0,1]=3 229 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,0,0,0,0|2,0,1]=3 230 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,0,0,0,0|2,0,1]=3 231 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,0,0,0,0|2,0,1]=3 232 B6R0.3 CN[N+](C)=C(C)N Amb24387819 [0,0,0,0,0,0|4,0,0]=4 233 B6R0.3 COC(=C)C(N)=O Amb24356386 [0,0,0,0,0,0|2,0,1]=3 234 B6R0.3 COC(=C)C(O)=O Amb18639906 [0,0,0,0,0,0|1,0,1]=2 235 B6R0.3 COC(=N)C(N)=O Amb25327814 [0,0,0,0,0,0|3,0,0]=3 236 B6R0.3 COC(=O)B(O)O Amb25261590 [0,0,0,0,0,0|3,0,1]=4 237 B6R0.3 COC(=O)C(=C)Br Amb20621565 [0,0,0,0,0,0|4,0,0]=4 238 B6R0.3 COC(=O)C(=C)F Amb10605555 [0,0,0,0,0,0|4,0,0]=4 239 B6R0.3 COC(=O)C(=C)N Amb22011812 [0,0,0,0,0,0|4,0,0]=4 240 B6R0.3 COC(=O)C(N)=N Amb24708486 [0,0,0,0,0,0|4,0,0]=4 241 B6R0.3 COC(=O)C(N)=O Amb22167666 [0,0,0,0,0,0|3,0,0]=3 242 B6R0.3 COC(=O)C(N)=S Amb19514933 [0,0,0,0,0,0|3,1,0]=4 243 B6R0.3 COC(=O)C(N)O Amb24563989 [0,0,0,0,0,0|3,0,1]=4 244 B6R0.3 COC(=O)C(O)=O Amb22011503 [0,0,0,0,0,0|2,0,0]=2 245 B6R0.3 COC(=O)C(O)O Amb24397176 [0,0,0,0,0,0|2,0,2]=4 246 B6R0.3 COC(=O)C(O)S Amb24466220 [0,0,0,0,0,0|2,1,1]=4 247 B6R0.3 COC(=O)C([O-])=O Amb22058088 [0,0,0,0,0,0|2,0,1]=3 248 B6R0.3 COC(=O)C([O-])=O Amb22411428 [0,0,0,0,0,0|2,0,1]=3 249 B6R0.3 COC(=O)N(C)O Amb25823260 [0,0,0,0,0,0|4,0,0]=4 250 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,0,0,0,0,0|3,0,1]=4 251 B6R0.3 COC(C)C(N)=N Amb20622329 [0,0,0,0,0,0|3,0,1]=4 252 B6R0.3 COC(C)C(N)=N Amb22059004 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.3 COC(C)C(N)=S Amb20622535 [0,0,0,0,0,0|2,1,1]=4 254 B6R0.3 COC(N)C(N)=O Amb25178891 [0,0,0,0,0,0|3,0,1]=4 255 B6R0.3 COC(N)C(O)=O Amb24621851 [0,0,0,0,0,0|2,0,1]=3 256 B6R0.3 COC(O)C(O)=O Amb24479754 [0,0,0,0,0,0|2,0,1]=3 257 B6R0.3 CON(C)C(N)=O Amb25305178 [0,0,0,0,0,0|3,0,0]=3 258 B6R0.3 CON(C)S(C)=O Amb25177397 [0,0,0,0,0,0|4,0,0]=4 259 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [0,0,0,0,0,0|2,0,1]=3 260 B6R0.3 CSC(=O)C(N)=O Amb24428776 [0,0,0,0,0,0|3,0,0]=3 261 B6R0.3 CSC(=O)C(O)=O Amb24731100 [0,0,0,0,0,0|2,0,0]=2 262 B6R0.3 CSC(=S)C(N)=S Amb25841320 [0,0,0,0,0,0|3,1,0]=4 263 B6R0.3 CSC(=S)C(O)=O Amb25702678 [0,0,0,0,0,0|2,0,0]=2 264 B6R0.3 CSC(Br)C(O)=O Amb25169549 [0,0,0,0,0,0|2,0,1]=3 265 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [0,0,0,0,0,0|2,0,1]=3 266 B6R0.3 CSC(F)C(O)=O Amb25043740 [0,0,0,0,0,0|2,0,1]=3 267 B6R0.3 CSC(O)C(C)=O Amb24479166 [0,0,0,0,0,0|3,0,1]=4 268 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [0,0,0,0,0,0|1,0,1]=2 269 B6R0.3 C[13C](=O)C(=O)O[Na] Amb22351603 [0,0,0,0,0,0|4,0,0]=4 270 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [0,0,0,0,0,0|1,0,2]=3 271 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [0,0,0,0,0,0|1,0,1]=2 272 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [0,0,0,0,0,0|1,0,1]=2 273 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [0,0,0,0,0,0|2,0,1]=3 274 B6R0.3 C[C@@H](C=O)[C@@H](C)O Amb25714216 [0,0,0,0,0,0|2,0,2]=4 275 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [0,0,0,0,0,0|1,0,2]=3 276 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [0,0,0,0,0,0|1,0,3]=4 277 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [0,0,0,0,0,0|1,0,2]=3 278 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [0,0,0,0,0,0|2,0,2]=4 279 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [0,0,0,0,0,0|1,0,2]=3 280 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [0,0,0,0,0,0|2,0,1]=3 281 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [0,0,0,0,0,0|2,0,1]=3 282 B6R0.3 C[C@@H](O)C(C)=C=C Amb25716651 [0,0,0,0,0,0|1,0,3]=4 283 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [0,0,0,0,0,0|2,0,1]=3 284 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [0,0,0,0,0,0|1,0,2]=3 285 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [0,0,0,0,0,0|1,0,1]=2 286 B6R0.3 C[C@H](C=C)[C@@H](C)O Amb25167394 [0,0,0,0,0,0|1,0,3]=4 287 B6R0.3 C[C@H](C=C)[C@H](C)O Amb25284228 [0,0,0,0,0,0|1,0,3]=4 288 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [0,0,0,0,0,0|2,0,1]=3 289 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [0,0,0,0,0,0|1,0,3]=4 290 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,0,0,0,0|2,0,2]=4 291 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [0,0,0,0,0,0|1,0,2]=3 292 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [0,0,0,0,0,0|1,0,2]=3 293 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [0,0,0,0,0,0|1,0,2]=3 294 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [0,0,0,0,0,0|1,0,2]=3 295 B6R0.3 C[C@H](NC)[C@@H](C)O Amb25113372 [0,0,0,0,0,0|2,0,2]=4 296 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [0,0,0,0,0,0|2,0,1]=3 297 B6R0.3 C[C@H](O)C(=C)C=C Amb25098591 [0,0,0,0,0,0|1,0,3]=4 298 B6R0.3 C[C@H](O)C(=O)C=C Amb24686568 [0,0,0,0,0,0|2,0,2]=4 299 B6R0.3 C[C@H](O)C(C)=C=C Amb24733100 [0,0,0,0,0,0|1,0,3]=4 300 B6R0.3 C[C@H](OC)[C@@H](C)O Amb25084361 [0,0,0,0,0,0|2,0,2]=4 301 B6R0.3 C[C@H](OC)[C@H](C)O Amb25167384 [0,0,0,0,0,0|2,0,2]=4 302 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [0,0,0,0,0,0|2,0,1]=3 303 B6R0.3 C\C(=C/Br)\C(=O)Cl Amb25299886 [0,0,0,0,0,0|2,0,0]=2 304 B6R0.3 C\C(=C/Br)\C(C)=O Amb25061221 [0,0,0,0,0,0|2,0,0]=2 305 B6R0.3 C\C(=C/N)\C(C)=O Amb24551470 [0,0,0,0,0,0|2,0,0]=2 306 B6R0.3 C\C(=C/N)\C(O)=O Amb24507602 [0,0,0,0,0,0|1,0,0]=1 307 B6R0.3 C\C(=C/N)\[N+]([O-])=O Amb25374071 [0,0,0,0,0,0|2,0,1]=3 308 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [0,0,0,0,0,0|1,0,0]=1 309 B6R0.3 C\C(=C\Br)\C(N)=O Amb25362058 [0,0,0,0,0,0|2,0,0]=2 310 B6R0.3 C\C(=C\C)\C(=O)Cl Amb25173910 [0,0,0,0,0,0|1,0,0]=1 311 B6R0.3 C\C(=C\C)\C(C)=O Amb25718935 [0,0,0,0,0,0|1,0,0]=1 312 B6R0.3 C\C(=C\Cl)\C(N)=O Amb25259193 [0,0,0,0,0,0|2,0,0]=2 313 B6R0.3 C\C(=C\O)\C(C)=O Amb24361303 [0,0,0,0,0,0|2,0,0]=2 314 B6R0.3 C\C(=C\O)\C(N)=O Amb24479832 [0,0,0,0,0,0|2,0,0]=2 315 B6R0.3 C\C(=N/O)\C(N)=O Amb24680733 [0,0,0,0,0,0|3,0,0]=3 316 B6R0.3 C\C(=N\Br)\C(O)=O Amb25745370 [0,0,0,0,0,0|2,0,0]=2 317 B6R0.3 C\C(=N\O)\C(O)=O Amb23523075 [0,0,0,0,0,0|2,0,0]=2 318 B6R0.3 C\C(\C=O)=C(/C)\Br Amb18645749 [0,0,0,0,0,0|3,0,0]=3 319 B6R0.3 C\C(\C=O)=C(/C)\Cl Amb18641884 [0,0,0,0,0,0|3,0,0]=3 320 B6R0.3 C\C(\C=O)=C(/C)\S Amb18641908 [0,0,0,0,0,0|2,1,0]=3 321 B6R0.3 C\C(\C=O)=C(\C)/Br Amb25257629 [0,0,0,0,0,0|3,0,0]=3 322 B6R0.3 C\C(\O)=C(/O)\SC Amb24332975 [0,0,0,0,0,0|3,0,0]=3 323 B6R0.3 C\C(\O)=C(\O)/C=O Amb25119300 [0,0,0,0,0,0|3,0,0]=3 324 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [0,0,0,0,0,0|1,0,0]=1 325 B6R0.3 C\C=C(/C)\C(C)O Amb24406752 [0,0,0,0,0,0|1,0,1]=2 326 B6R0.3 C\C=C(/C)\[N+]([O-])=O Amb24745378 [0,0,0,0,0,0|1,0,1]=2 327 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [0,0,0,0,0,0|1,0,0]=1 328 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [0,0,0,0,0,0|1,0,0]=1 329 B6R0.3 C\C=C(\Br)/C(C)O Amb24406032 [0,0,0,0,0,0|2,0,1]=3 330 B6R0.3 C\C=C(\Br)/[C@@H](C)Cl Amb25701571 [0,0,0,0,0,0|3,0,1]=4 331 B6R0.3 C\C=C(\C)/B(O)O Amb25373747 [0,0,0,0,0,0|1,0,1]=2 332 B6R0.3 C\C=C(\C)/C(C)Br Amb25116198 [0,0,0,0,0,0|2,0,1]=3 333 B6R0.3 C\C=C(\C)/C(C)C Amb22731816 [0,0,0,0,0,0|2,0,1]=3 334 B6R0.3 C\C=C(\C)/C(C)N Amb25680794 [0,0,0,0,0,0|2,0,1]=3 335 B6R0.3 C\C=C(\C)/C(C)O Amb25025357 [0,0,0,0,0,0|1,0,1]=2 336 B6R0.3 C\C=C(\C)/[C@@H](C)O Amb25136106 [0,0,0,0,0,0|1,0,1]=2 337 B6R0.3 C\C=C(\Cl)/C(C)Cl Amb24553944 [0,0,0,0,0,0|3,0,1]=4 338 B6R0.3 C\C=C(\N)/C(N)=O Amb24681313 [0,0,0,0,0,0|2,0,0]=2 339 B6R0.3 C\C=C(\O)/C(N)=O Amb25314423 [0,0,0,0,0,0|2,0,0]=2 340 B6R0.3 NC(=O)C(=O)CBr Amb24085874 [0,0,0,0,0,0|3,0,1]=4 341 B6R0.3 NC(=O)C(=O)NO Amb24453454 [0,0,0,0,0,0|4,0,0]=4 342 B6R0.3 NC(=O)C(=S)NN Amb25324196 [0,0,0,0,0,0|4,0,0]=4 343 B6R0.3 NC(=O)C(Br)=CCl Amb24479758 [0,0,0,0,0,0|3,0,0]=3 344 B6R0.3 NC(=O)C(Cl)=CBr Amb25074058 [0,0,0,0,0,0|3,0,0]=3 345 B6R0.3 NC(=O)N(O)C=O Amb24479864 [0,0,0,0,0,0|4,0,0]=4 346 B6R0.3 NC(=O)\C(\Cl)=C/Cl Amb24427307 [0,0,0,0,0,0|3,0,0]=3 347 B6R0.3 NC(=O)\C(\Cl)=C/N Amb25190050 [0,0,0,0,0,0|3,0,0]=3 348 B6R0.3 NC(=O)\C(\I)=N\O Amb25132216 [0,0,0,0,0,0|4,0,0]=4 349 B6R0.3 NC(C#N)C(O)=O Amb25328320 [0,0,0,0,0,0|2,0,2]=4 350 B6R0.3 NC(C(=O)O)CF Amb10839589 [0,0,0,0,0,0|2,0,2]=4 351 B6R0.3 NC(C(=O)O)CS Amb13961966 [0,0,0,0,0,0|2,0,2]=4 352 B6R0.3 NC(C=O)C(O)=O Amb24349579 [0,0,0,0,0,0|2,0,1]=3 353 B6R0.3 NC(C=S)C(O)=O Amb25227802 [0,0,0,0,0,0|2,0,1]=3 354 B6R0.3 NC(CCl)C(O)=O Amb19651457 [0,0,0,0,0,0|2,0,2]=4 355 B6R0.3 NC(CCl)C(O)=O Amb21961077 [0,0,0,0,0,0|2,0,2]=4 356 B6R0.3 NC(CI)C(O)=O Amb25177412 [0,0,0,0,0,0|2,0,2]=4 357 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [0,0,0,0,0,0|2,0,2]=4 358 B6R0.3 NC(CS)C(O)=O Amb22489523 [0,0,0,0,0,0|2,0,2]=4 359 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [0,0,0,0,0,0|2,0,2]=4 360 B6R0.3 NCC(=O)C(O)=O Amb24361938 [0,0,0,0,0,0|2,0,1]=3 361 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [0,0,0,0,0,0|2,0,2]=4 362 B6R0.3 NCC(C(=O)O)S Amb17593238 [0,0,0,0,0,0|2,0,2]=4 363 B6R0.3 NCC(F)C(O)=O Amb22733051 [0,0,0,0,0,0|2,0,2]=4 364 B6R0.3 NCC(N)C(O)=O Amb22899095 [0,0,0,0,0,0|2,0,2]=4 365 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [0,0,0,0,0,0|2,0,2]=4 366 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [0,0,0,0,0,0|2,0,2]=4 367 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [0,0,0,0,0,0|2,0,2]=4 368 B6R0.3 NOC(F)C(O)=O Amb24446310 [0,0,0,0,0,0|3,0,1]=4 369 B6R0.3 NOC(O)C(O)=O Amb24735537 [0,0,0,0,0,0|3,0,1]=4 370 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [0,0,0,0,0,0|2,0,2]=4 371 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [0,0,0,0,0,0|2,0,2]=4 372 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [0,0,0,0,0,0|2,0,2]=4 373 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [0,0,0,0,0,0|2,0,2]=4 374 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [0,0,0,0,0,0|2,0,2]=4 375 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [0,0,0,0,0,0|2,0,2]=4 376 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [0,0,0,0,0,0|2,0,2]=4 377 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [0,0,0,0,0,0|2,0,2]=4 378 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [0,0,0,0,0,0|2,0,2]=4 379 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [0,0,0,0,0,0|2,0,2]=4 380 B6R0.3 N\C(=N/O)\C(=O)N Amb16186552 [0,0,0,0,0,0|4,0,0]=4 381 B6R0.3 N\C(=N/O)\C(O)=O Amb24670890 [0,0,0,0,0,0|3,0,0]=3 382 B6R0.3 O=C(Cl)C(F)=CCl Amb25377847 [0,0,0,0,0,0|3,0,0]=3 383 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [0,0,0,0,0,0|3,0,1]=4 384 B6R0.3 O=CC(F)=C(F)F Amb24444460 [0,0,0,0,0,0|4,0,0]=4 385 B6R0.3 OC(=CBr)C(O)=O Amb24479759 [0,0,0,0,0,0|2,0,0]=2 386 B6R0.3 OC(=CS)C(O)=O Amb25340519 [0,0,0,0,0,0|2,0,0]=2 387 B6R0.3 OC(=O)C(=O)C=O Amb25836179 [0,0,0,0,0,0|2,0,0]=2 388 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [0,0,0,0,0,0|2,0,1]=3 389 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [0,0,0,0,0,0|2,0,1]=3 390 B6R0.3 OC(=O)C(=O)CF Amb22008247 [0,0,0,0,0,0|2,0,1]=3 391 B6R0.3 OC(=O)C(=O)CF Amb22274202 [0,0,0,0,0,0|2,0,1]=3 392 B6R0.3 OC(=O)C(=O)CS Amb22360785 [0,0,0,0,0,0|2,0,1]=3 393 B6R0.3 OC(=O)C(=O)OCl Amb24684116 [0,0,0,0,0,0|3,0,0]=3 394 B6R0.3 OC(=O)C(Br)=CCl Amb24429120 [0,0,0,0,0,0|2,0,0]=2 395 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [0,0,0,0,0,0|2,0,2]=4 396 B6R0.3 OC(=O)C(CF)Br Amb10605519 [0,0,0,0,0,0|2,0,2]=4 397 B6R0.3 OC(=O)C(Cl)=CBr Amb24478967 [0,0,0,0,0,0|2,0,0]=2 398 B6R0.3 OC(=O)C(Cl)=NO Amb25839923 [0,0,0,0,0,0|3,0,0]=3 399 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [0,0,0,0,0,0|2,0,1]=3 400 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [0,0,0,0,0,0|2,0,2]=4 401 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [0,0,0,0,0,0|2,0,2]=4 402 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [0,0,0,0,0,0|2,0,2]=4 403 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [0,0,0,0,0,0|2,0,2]=4 404 B6R0.3 OC(=O)C(F)=CBr Amb24651069 [0,0,0,0,0,0|2,0,0]=2 405 B6R0.3 OC(=O)C(F)=CCl Amb25805817 [0,0,0,0,0,0|2,0,0]=2 406 B6R0.3 OC(=O)C(F)C=O Amb22055301 [0,0,0,0,0,0|2,0,1]=3 407 B6R0.3 OC(=O)C(F)CF Amb24746801 [0,0,0,0,0,0|2,0,2]=4 408 B6R0.3 OC(=O)C(S)=CS Amb24480963 [0,0,0,0,0,0|2,0,0]=2 409 B6R0.3 OC(=O)C(S)=NO Amb24479775 [0,0,0,0,0,0|3,0,0]=3 410 B6R0.3 OC(=O)C(S)CS Amb18643295 [0,0,0,0,0,0|2,0,2]=4 411 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [0,0,0,0,0,0|2,0,2]=4 412 B6R0.3 OC(=O)\C(=C/Cl)\Cl Amb17593560 [0,0,0,0,0,0|2,0,0]=2 413 B6R0.3 OC(=O)\C(\Br)=C/Br Amb22469643 [0,0,0,0,0,0|2,0,0]=2 414 B6R0.3 OC(=O)\C(\Cl)=C/O Amb24479774 [0,0,0,0,0,0|2,0,0]=2 415 B6R0.3 OC(=O)\C(\F)=C\F Amb24393011 [0,0,0,0,0,0|2,0,0]=2 416 B6R0.3 OC(C=O)C(O)=O Amb18640325 [0,0,0,0,0,0|2,0,1]=3 417 B6R0.3 OC(CBr)C(O)=O Amb24061932 [0,0,0,0,0,0|2,0,2]=4 418 B6R0.3 OC(CS)C(O)=O Amb18642053 [0,0,0,0,0,0|2,0,2]=4 419 B6R0.3 OCC(=C(Cl)Cl)C Amb17593562 [0,0,0,0,0,0|3,0,1]=4 420 B6R0.3 OCC(Br)C(O)=O Amb18126327 [0,0,0,0,0,0|2,0,2]=4 421 B6R0.3 OCC(C(=O)O)F Amb17593117 [0,0,0,0,0,0|2,0,2]=4 422 B6R0.3 OCC(C(=O)O)O Amb17593103 [0,0,0,0,0,0|2,0,2]=4 423 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [0,0,0,0,0,0|2,0,2]=4 424 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [0,0,0,0,0,0|2,0,2]=4 425 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [0,0,0,0,0,0|1,0,2]=3 426 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [0,0,0,0,0,0|1,0,2]=3 427 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [0,0,0,0,0,0|2,0,2]=4 428 B6R0.3 ONC(O)C(O)=O Amb25832155 [0,0,0,0,0,0|3,0,1]=4 429 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [0,0,0,0,0,0|2,0,1]=3 430 B6R0.3 O[13C](=O)[13C](=O)O[Na] Amb22336731 [0,0,0,0,0,0|3,0,0]=3 431 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [0,0,0,0,0,0|2,0,2]=4 432 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [0,0,0,0,0,0|2,0,2]=4 433 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [0,0,0,0,0,0|2,0,2]=4 434 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [0,0,0,0,0,0|2,0,2]=4 435 B6R0.3 O\C(=N\O)\C(O)=O Amb24462565 [0,0,0,0,0,0|3,0,0]=3 436 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [0,0,0,0,0,0|1,0,2]=3 437 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [0,0,0,0,0,0|1,0,2]=3 438 B6R0.3 [13CH3][13C](=O)C(=O)O[Na] Amb22367015 [0,0,0,0,0,0|4,0,0]=4 439 B6R0.3 [13CH3][13C](=O)[13C](=O)O[Na] Amb22354039 [0,0,0,0,0,0|4,0,0]=4 440 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [0,0,0,0,0,0|2,0,2]=4 441 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [0,0,0,0,0,0|2,0,2]=4 442 B6R0.3 [NH4]OC(=O)C(N)=O Amb22346072 [0,0,0,0,0,0|4,0,0]=4 443 B6R0.3 [O-]C(=O)C(=O)CF Amb10839900 [0,0,0,0,0,0|2,0,2]=4 444 B6R0.3 [O-]C(=O)C(=O)CF Amb24074078 [0,0,0,0,0,0|2,0,2]=4 445 B6R0.3 [O-]C(=O)C(=O)CO Amb22360656 [0,0,0,0,0,0|2,0,2]=4 446 B6R0.3 [O-]C(=O)C(=O)CS Amb22547761 [0,0,0,0,0,0|2,0,2]=4 447 B6R0.3 [O-]\C=C(/C(=O)C)\C Amb17617704 [0,0,0,0,0,0|2,0,0]=2 448 B6R0.3 [O-]\C=C(\C(=O)C)/C Amb10552504 [0,0,0,0,0,0|2,0,0]=2 449 B5R0.1 BC(=O)NCC Amb22343194 [1,0,0,0,0,0|2,0,1]=4 450 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,0,0,0,0|1,0,0]=2 451 B5R0.1 C=C(Cl)\C=C\Cl Amb24525152 [1,0,0,0,0,0|3,0,0]=4 452 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,0,0,0,0|0,0,2]=3 453 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,0,0,0,0|2,0,1]=4 454 B5R0.1 CC#CC(=O)C Amb17593016 [1,0,0,0,0,0|1,0,2]=4 455 B5R0.1 CC#CC(=O)N Amb10552409 [1,0,0,0,0,0|1,0,2]=4 456 B5R0.1 CC(=C)\C=C/C Amb22733448 [1,0,0,0,0,0|2,0,0]=3 457 B5R0.1 CC(=C)\C=C/Cl Amb25123259 [1,0,0,0,0,0|3,0,0]=4 458 B5R0.1 CC(=C)\C=C\Br Amb25242010 [1,0,0,0,0,0|3,0,0]=4 459 B5R0.1 CC(=C)\C=C\Cl Amb24526409 [1,0,0,0,0,0|3,0,0]=4 460 B5R0.1 CC(=C)\C=C\I Amb25299248 [1,0,0,0,0,0|3,0,0]=4 461 B5R0.1 CC(=O)C=C=C Amb23447108 [1,0,0,0,0,0|1,0,2]=4 462 B5R0.1 CC(=O)C=C=N Amb25663158 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.1 CC(=O)CC=O Amb17666764 [1,0,0,0,0,0|2,0,1]=4 464 B5R0.1 CC(=O)NC=C Amb24323579 [1,0,0,0,0,0|2,0,1]=4 465 B5R0.1 CC(=O)NC=S Amb24390998 [1,0,0,0,0,0|3,0,0]=4 466 B5R0.1 CC(=O)OC=C Amb21618930 [1,0,0,0,0,0|2,0,1]=4 467 B5R0.1 CC(=O)OC=C Amb22338143 [1,0,0,0,0,0|2,0,1]=4 468 B5R0.1 CC(=O)OC=C Amb22338476 [1,0,0,0,0,0|2,0,1]=4 469 B5R0.1 CC(=O)OC=C Amb22366845 [1,0,0,0,0,0|2,0,1]=4 470 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,0,0,0,0|3,0,0]=4 471 B5R0.1 CC(=O)O[13CH]=[13CH2] Amb22351356 [1,0,0,0,0,0|2,0,1]=4 472 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,0,0,0,0|2,0,0]=3 473 B5R0.1 CC(=O)\C=C\Br Amb25803449 [1,0,0,0,0,0|2,0,0]=3 474 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,0,0,0,0|2,0,0]=3 475 B5R0.1 CC(=O)\C=C\I Amb25269482 [1,0,0,0,0,0|2,0,0]=3 476 B5R0.1 CC(C)=CC=C Amb22229813 [1,0,0,0,0,0|2,0,1]=4 477 B5R0.1 CC(C)\C=C/C Amb22731717 [1,0,0,0,0,0|2,0,1]=4 478 B5R0.1 CC(O)\C=C/Br Amb25809927 [1,0,0,0,0,0|2,0,1]=4 479 B5R0.1 CC(O)\C=C/Cl Amb24635620 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.1 CC(O)\C=C/I Amb24373761 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 CC(O)\C=C\Br Amb24519445 [1,0,0,0,0,0|2,0,1]=4 482 B5R0.1 CC(O)\C=C\Cl Amb25264104 [1,0,0,0,0,0|2,0,1]=4 483 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,0,0,0,0|1,0,0]=2 484 B5R0.1 CC=CC(C)N Amb19514513 [1,0,0,0,0,0|2,0,1]=4 485 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 486 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 487 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,2]=4 488 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,2]=4 489 B5R0.1 CCCC([O-])=O Amb17772223 [1,0,0,0,0,0|0,0,3]=4 490 B5R0.1 CCCC([O-])=O Amb22732283 [1,0,0,0,0,0|0,0,3]=4 491 B5R0.1 CCCC([O-])=O Amb22732651 [1,0,0,0,0,0|0,0,3]=4 492 B5R0.1 CCCS(O)=O Amb24615072 [1,0,0,0,0,0|1,0,2]=4 493 B5R0.1 CCC[13C](O)=O Amb22337992 [1,0,0,0,0,0|0,0,2]=3 494 B5R0.1 CCC[13C](O)=O Amb22338339 [1,0,0,0,0,0|0,0,2]=3 495 B5R0.1 CCNC(=O)Br Amb24563760 [1,0,0,0,0,0|2,0,1]=4 496 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,1]=4 497 B5R0.1 CCNC(O)=S Amb24612743 [1,0,0,0,0,0|1,1,1]=4 498 B5R0.1 CCOC([13CH3])=O Amb22363103 [1,0,0,0,0,0|2,0,1]=4 499 B5R0.1 CCOP(O)=O Amb22360741 [1,0,0,0,0,0|2,0,1]=4 500 B5R0.1 CCO[13C](C)=O Amb22363160 [1,0,0,0,0,0|2,0,1]=4 501 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [1,0,0,0,0,0|2,0,1]=4 502 B5R0.1 CCO[14C](N)=O Amb22732757 [1,0,0,0,0,0|2,0,1]=4 503 B5R0.1 CCSC(N)=O Amb24394612 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [1,0,0,0,0,0|0,0,2]=3 505 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [1,0,0,0,0,0|0,0,3]=4 506 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [1,0,0,0,0,0|0,0,2]=3 507 B5R0.1 CN=CC(C)=O Amb25746654 [1,0,0,0,0,0|2,0,0]=3 508 B5R0.1 CNCC(=O)C Amb17621974 [1,0,0,0,0,0|2,0,1]=4 509 B5R0.1 CNCC(=O)N Amb10610205 [1,0,0,0,0,0|2,0,1]=4 510 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,1]=4 511 B5R0.1 CNCC([O-])=O Amb20246714 [1,0,0,0,0,0|1,0,2]=4 512 B5R0.1 CNCP(O)=O Amb24478116 [1,0,0,0,0,0|2,0,1]=4 513 B5R0.1 CNOC(C)=O Amb24323679 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 CNOC(C)=O Amb24629247 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 COC=C(C)C Amb25063853 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 COCC(=O)Br Amb25282928 [1,0,0,0,0,0|2,0,1]=4 517 B5R0.1 COCC(=O)N Amb1153776 [1,0,0,0,0,0|2,0,1]=4 518 B5R0.1 CONC(=O)N Amb2417193 [1,0,0,0,0,0|3,0,0]=4 519 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 520 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,1]=4 521 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,1]=3 522 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,1]=4 523 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,1]=4 524 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 525 B5R0.1 CSNC(N)=O Amb25810134 [1,0,0,0,0,0|3,0,0]=4 526 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [1,0,0,0,0,0|0,0,3]=4 527 B5R0.1 C[C@@H](O)\C=C\I Amb24334105 [1,0,0,0,0,0|2,0,1]=4 528 B5R0.1 C\C(\Br)=C\C=O Amb18124620 [1,0,0,0,0,0|3,0,0]=4 529 B5R0.1 C\C(\Cl)=C/C=O Amb18640408 [1,0,0,0,0,0|3,0,0]=4 530 B5R0.1 C\C(\I)=C/C=O Amb25095164 [1,0,0,0,0,0|3,0,0]=4 531 B5R0.1 C\C(\I)=C\C=O Amb24424054 [1,0,0,0,0,0|3,0,0]=4 532 B5R0.1 C\C=C/B(O)O Amb24547752 [1,0,0,0,0,0|1,0,1]=3 533 B5R0.1 C\C=C/C(C)C Amb20618870 [1,0,0,0,0,0|2,0,1]=4 534 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,0]=2 535 B5R0.1 C\C=C\C(C)=C Amb22733185 [1,0,0,0,0,0|2,0,0]=3 536 B5R0.1 C\C=C\C(C)Br Amb24725263 [1,0,0,0,0,0|2,0,1]=4 537 B5R0.1 C\C=C\C(C)Cl Amb24377224 [1,0,0,0,0,0|2,0,1]=4 538 B5R0.1 C\C=C\C(C)F Amb24733620 [1,0,0,0,0,0|2,0,1]=4 539 B5R0.1 C\C=C\C(C)I Amb25061857 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 C\C=C\C(N)=N Amb25024644 [1,0,0,0,0,0|2,0,0]=3 541 B5R0.1 C\C=C\C([O-])=O Amb22231404 [1,0,0,0,0,0|0,0,1]=2 542 B5R0.1 C\C=C\[C@@H](C)Cl Amb24692647 [1,0,0,0,0,0|2,0,1]=4 543 B5R0.1 C\C=C\[C@H](C)Cl Amb24332071 [1,0,0,0,0,0|2,0,1]=4 544 B5R0.1 C\C=C\[C@H](C)O Amb25145549 [1,0,0,0,0,0|1,0,1]=3 545 B5R0.1 C\C=N\C(N)=S Amb25744557 [1,0,0,0,0,0|2,1,0]=4 546 B5R0.1 N#CCC(O)=O Amb20247050 [1,0,0,0,0,0|1,0,2]=4 547 B5R0.1 NC(=O)C=NO Amb25147466 [1,0,0,0,0,0|3,0,0]=4 548 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,0,0,0,0|1,0,2]=4 549 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 550 B5R0.1 NC(=O)OC=C Amb17621270 [1,0,0,0,0,0|2,0,1]=4 551 B5R0.1 NC(=O)\C=C/Br Amb25715916 [1,0,0,0,0,0|2,0,0]=3 552 B5R0.1 NC(=O)\C=C\Cl Amb10552376 [1,0,0,0,0,0|2,0,0]=3 553 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,2]=4 554 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,1]=4 555 B5R0.1 N\C=C/C(N)=O Amb22489591 [1,0,0,0,0,0|2,0,0]=3 556 B5R0.1 N\C=C/[N+]([O-])=O Amb21858881 [1,0,0,0,0,0|2,0,1]=4 557 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,0,0,0,0|2,0,0]=3 558 B5R0.1 O=C(Cl)\C=C/Br Amb24391538 [1,0,0,0,0,0|2,0,0]=3 559 B5R0.1 O=C(Cl)\C=C\Br Amb24512115 [1,0,0,0,0,0|2,0,0]=3 560 B5R0.1 O=C(Cl)\C=C\Cl Amb25025493 [1,0,0,0,0,0|2,0,0]=3 561 B5R0.1 O=C=CC(=O)C Amb10603952 [1,0,0,0,0,0|2,0,1]=4 562 B5R0.1 O=CC=C(Br)Br Amb25146355 [1,0,0,0,0,0|3,0,0]=4 563 B5R0.1 O=CC=C(Cl)Cl Amb24691205 [1,0,0,0,0,0|3,0,0]=4 564 B5R0.1 O=S(Cl)\C=C\Cl Amb25173159 [1,0,0,0,0,0|3,0,0]=4 565 B5R0.1 OB(O)\C=C\Cl Amb25241162 [1,0,0,0,0,0|2,0,1]=4 566 B5R0.1 OB(\C=C\C)O Amb2447259 [1,0,0,0,0,0|1,0,1]=3 567 B5R0.1 OC(=O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 568 B5R0.1 OC(=O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 569 B5R0.1 OC(=O)C#CI Amb25274128 [1,0,0,0,0,0|1,0,2]=4 570 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,0,0,0,0|1,0,1]=3 571 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 572 B5R0.1 OC(=O)CCF Amb10603694 [1,0,0,0,0,0|1,0,2]=4 573 B5R0.1 OC(=O)CI=O Amb25146428 [1,0,0,0,0,0|2,0,1]=4 574 B5R0.1 OC(=O)CNBr Amb25053433 [1,0,0,0,0,0|2,0,1]=4 575 B5R0.1 OC(=O)CNCl Amb24653229 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 OC(=O)CNI Amb25216175 [1,0,0,0,0,0|2,0,1]=4 577 B5R0.1 OC(=O)CSCl Amb24597301 [1,0,0,0,0,0|2,0,1]=4 578 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [1,0,0,0,0,0|2,0,1]=4 579 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,0]=2 580 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,0,0,0,0|1,0,0]=2 581 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,0,0,0,0|1,0,0]=2 582 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,0,0,0,0|2,0,0]=3 583 B5R0.1 ONCC(O)=O Amb24120360 [1,0,0,0,0,0|2,0,1]=4 584 B5R0.1 OP(=O)CC=O Amb25706451 [1,0,0,0,0,0|2,0,1]=4 585 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,0,0,0,0|2,0,0]=3 586 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,0,0,0,0|2,0,0]=3 587 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [1,0,0,0,0,0|0,0,3]=4 588 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [1,0,0,0,0,0|0,0,3]=4 589 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [1,0,0,0,0,0|0,0,3]=4 590 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [1,0,0,0,0,0|1,0,2]=4 591 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [1,0,0,0,0,0|1,0,2]=4 592 B5R0.1 [2H]C(=O)OCC Amb22336312 [1,0,0,0,0,0|2,0,1]=4 593 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,0,0,0,0|2,0,0]=3 594 B5R0.1 [O-][N+](=O)\C=C\Cl Amb25026231 [1,0,0,0,0,0|2,0,1]=4 595 B5R0.1 [O-]\C=C\C(=O)C Amb15772268 [1,0,0,0,0,0|2,0,0]=3 596 B5R0.1 [O-]\C=C\C(=O)C Amb2228039 [1,0,0,0,0,0|2,0,0]=3 597 B5R0.3 BrCC(=CBr)C Amb17612559 [1,0,0,0,0,0|2,0,1]=4 598 B5R0.3 C=C(C=C)C=C Amb25025458 [1,0,0,0,0,0|1,0,2]=4 599 B5R0.3 C=C(C=O)C#C Amb25811095 [1,0,0,0,0,0|0,0,3]=4 600 B5R0.3 C=C(C=O)C#N Amb25300417 [1,0,0,0,0,0|1,0,2]=4 601 B5R0.3 C=C(C=O)N=O Amb24640223 [1,0,0,0,0,0|2,0,1]=4 602 B5R0.3 C=C(CCl)C=O Amb25173687 [1,0,0,0,0,0|1,0,2]=4 603 B5R0.3 C=CC(=C)CO Amb25146300 [1,0,0,0,0,0|0,0,3]=4 604 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,0,0,0,0|2,0,1]=4 605 B5R0.3 C=CC(F)C=O Amb24552239 [1,0,0,0,0,0|1,0,2]=4 606 B5R0.3 C=CC(O)C=O Amb25066575 [1,0,0,0,0,0|1,0,2]=4 607 B5R0.3 C=C[C@H](O)C=O Amb24677118 [1,0,0,0,0,0|1,0,2]=4 608 B5R0.3 C=C\C(\Br)=C/Cl Amb24594925 [1,0,0,0,0,0|2,0,1]=4 609 B5R0.3 C=C\C(\Cl)=C/Br Amb25250443 [1,0,0,0,0,0|2,0,1]=4 610 B5R0.3 C=C\C(\Cl)=C/Cl Amb24652618 [1,0,0,0,0,0|2,0,1]=4 611 B5R0.3 CC(=CBr)CO Amb17610042 [1,0,0,0,0,0|1,0,1]=3 612 B5R0.3 CC(=CCl)C#N Amb25332370 [1,0,0,0,0,0|2,0,1]=4 613 B5R0.3 CC(C=C)C=C Amb22337672 [1,0,0,0,0,0|1,0,2]=4 614 B5R0.3 CC(C=C)C=O Amb25737956 [1,0,0,0,0,0|0,0,2]=3 615 B5R0.3 CC(C=O)=C=O Amb24478468 [1,0,0,0,0,0|1,0,1]=3 616 B5R0.3 CC(C=O)=CBr Amb25262258 [1,0,0,0,0,0|1,0,0]=2 617 B5R0.3 CC(C=O)=CCl Amb24333882 [1,0,0,0,0,0|1,0,0]=2 618 B5R0.3 CC(C=O)=NO Amb25746939 [1,0,0,0,0,0|2,0,0]=3 619 B5R0.3 CC(C=O)C#C Amb24557170 [1,0,0,0,0,0|0,0,3]=4 620 B5R0.3 CC(CBr)C=O Amb24478503 [1,0,0,0,0,0|1,0,2]=4 621 B5R0.3 CC(CCl)=NO Amb25147757 [1,0,0,0,0,0|2,0,1]=4 622 B5R0.3 CC(CCl)C=O Amb24691518 [1,0,0,0,0,0|1,0,2]=4 623 B5R0.3 CC(CF)C=O Amb24638421 [1,0,0,0,0,0|1,0,2]=4 624 B5R0.3 CC(CI)=CCl Amb24332691 [1,0,0,0,0,0|2,0,1]=4 625 B5R0.3 CC(CI)=NO Amb25025640 [1,0,0,0,0,0|2,0,1]=4 626 B5R0.3 CC(CN)=CBr Amb25663349 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.3 CC(CN)=NO Amb24604750 [1,0,0,0,0,0|2,0,1]=4 628 B5R0.3 CC(CO)=C=C Amb25839359 [1,0,0,0,0,0|0,0,3]=4 629 B5R0.3 CC(CO)=CI Amb24545825 [1,0,0,0,0,0|1,0,1]=3 630 B5R0.3 CC(CO)=NO Amb24443579 [1,0,0,0,0,0|2,0,1]=4 631 B5R0.3 CC(CO)C=C Amb22347861 [1,0,0,0,0,0|0,0,3]=4 632 B5R0.3 CC(CO)C=O Amb25745800 [1,0,0,0,0,0|1,0,2]=4 633 B5R0.3 CC(CS)=CCl Amb24391502 [1,0,0,0,0,0|1,1,1]=4 634 B5R0.3 CC(CS)C=O Amb25758635 [1,0,0,0,0,0|1,0,2]=4 635 B5R0.3 CC/C(C)=C/C Amb17940137 [1,0,0,0,0,0|1,0,1]=3 636 B5R0.3 CC=C(C)C#N Amb20622623 [1,0,0,0,0,0|1,0,1]=3 637 B5R0.3 CC=C(C)OC Amb25747357 [1,0,0,0,0,0|2,0,0]=3 638 B5R0.3 CCC(=C)C=O Amb17940102 [1,0,0,0,0,0|0,0,2]=3 639 B5R0.3 CCC(=N)NO Amb19515903 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.3 CCC(=N)NO Amb22266115 [1,0,0,0,0,0|2,0,1]=4 641 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,0,0,0,0|1,0,1]=3 642 B5R0.3 CCC(=O)CO Amb22227965 [1,0,0,0,0,0|1,0,2]=4 643 B5R0.3 CCC(Br)C=O Amb18124003 [1,0,0,0,0,0|1,0,2]=4 644 B5R0.3 CCC(C)=C=O Amb25788880 [1,0,0,0,0,0|0,0,2]=3 645 B5R0.3 CCC(C)=CI Amb25810062 [1,0,0,0,0,0|1,0,1]=3 646 B5R0.3 CCC(C)=NN Amb24528237 [1,0,0,0,0,0|2,0,1]=4 647 B5R0.3 CCC(Cl)=CCl Amb24553945 [1,0,0,0,0,0|2,0,1]=4 648 B5R0.3 CCC(Cl)=NO Amb24713413 [1,0,0,0,0,0|2,0,1]=4 649 B5R0.3 CCC(Cl)C=O Amb18122610 [1,0,0,0,0,0|1,0,2]=4 650 B5R0.3 CCC(F)C=O Amb24606916 [1,0,0,0,0,0|1,0,2]=4 651 B5R0.3 CCC(I)C=O Amb25365077 [1,0,0,0,0,0|1,0,2]=4 652 B5R0.3 CCC(O)C=O Amb25347970 [1,0,0,0,0,0|1,0,2]=4 653 B5R0.3 CCC(S)C=O Amb18122377 [1,0,0,0,0,0|1,0,2]=4 654 B5R0.3 CCN(C)C=O Amb20627285 [1,0,0,0,0,0|1,0,1]=3 655 B5R0.3 CCN(C)CO Amb24407447 [1,0,0,0,0,0|1,0,2]=4 656 B5R0.3 CCN(C)N=O Amb22055856 [1,0,0,0,0,0|2,0,1]=4 657 B5R0.3 CCN(N)C=O Amb24428031 [1,0,0,0,0,0|2,0,1]=4 658 B5R0.3 CC[C@@H](C)CO Amb22799907 [1,0,0,0,0,0|0,0,3]=4 659 B5R0.3 CC[C@@H](CO)C Amb10844611 [1,0,0,0,0,0|0,0,3]=4 660 B5R0.3 CC[C@@H](Cl)C=O Amb24645873 [1,0,0,0,0,0|1,0,2]=4 661 B5R0.3 CC[C@H](Cl)C=O Amb24478146 [1,0,0,0,0,0|1,0,2]=4 662 B5R0.3 CC[C@H](O)C=O Amb24333959 [1,0,0,0,0,0|1,0,2]=4 663 B5R0.3 CC\C(=N/O)\N Amb10609125 [1,0,0,0,0,0|2,0,1]=4 664 B5R0.3 CC\C(=N\O)\N Amb1125701 [1,0,0,0,0,0|2,0,1]=4 665 B5R0.3 CC\C(\C)=C/C Amb25332651 [1,0,0,0,0,0|1,0,1]=3 666 B5R0.3 CC\C(\Cl)=C/Cl Amb24652361 [1,0,0,0,0,0|2,0,1]=4 667 B5R0.3 CC\C(\N)=N\O Amb19883708 [1,0,0,0,0,0|2,0,1]=4 668 B5R0.3 CN(C=C)N=O Amb24333902 [1,0,0,0,0,0|2,0,1]=4 669 B5R0.3 CN(C=O)C=O Amb24098492 [1,0,0,0,0,0|2,0,0]=3 670 B5R0.3 CN(CCl)C=O Amb24478418 [1,0,0,0,0,0|2,0,1]=4 671 B5R0.3 CNC(=N)CO Amb23514994 [1,0,0,0,0,0|2,0,1]=4 672 B5R0.3 CNC(=O)N=O Amb25738596 [1,0,0,0,0,0|3,0,0]=4 673 B5R0.3 CNC(=O)NO Amb25185417 [1,0,0,0,0,0|3,0,0]=4 674 B5R0.3 CNC(C)=NO Amb24351564 [1,0,0,0,0,0|2,0,0]=3 675 B5R0.3 CNC(C)=S=O Amb24688517 [1,0,0,0,0,0|2,0,0]=3 676 B5R0.3 CNC(N)=NO Amb25821943 [1,0,0,0,0,0|3,0,0]=4 677 B5R0.3 CN\C(=N/C)\C Amb10552433 [1,0,0,0,0,0|3,0,0]=4 678 B5R0.3 CN\C(\C)=N/N Amb24738841 [1,0,0,0,0,0|3,0,0]=4 679 B5R0.3 COC(=C)CO Amb25345119 [1,0,0,0,0,0|1,0,2]=4 680 B5R0.3 COC(=O)C=C Amb22336504 [1,0,0,0,0,0|3,0,0]=4 681 B5R0.3 COC(=O)C=C Amb22338013 [1,0,0,0,0,0|3,0,0]=4 682 B5R0.3 COC(=O)C=C Amb22351400 [1,0,0,0,0,0|3,0,0]=4 683 B5R0.3 COC(=O)C=C Amb22353461 [1,0,0,0,0,0|3,0,0]=4 684 B5R0.3 COC(=O)NO Amb25210328 [1,0,0,0,0,0|3,0,0]=4 685 B5R0.3 COC(C)=CBr Amb24590077 [1,0,0,0,0,0|2,0,0]=3 686 B5R0.3 COC(C)=CCl Amb25065366 [1,0,0,0,0,0|2,0,0]=3 687 B5R0.3 COC(C)C=C Amb25232785 [1,0,0,0,0,0|2,0,1]=4 688 B5R0.3 COC(C)CO Amb19517078 [1,0,0,0,0,0|1,0,2]=4 689 B5R0.3 COC(Cl)=CBr Amb25361127 [1,0,0,0,0,0|3,0,0]=4 690 B5R0.3 COC(F)=CCl Amb24565713 [1,0,0,0,0,0|3,0,0]=4 691 B5R0.3 CON(C)C=O Amb22234045 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.3 CON(C)CO Amb25745642 [1,0,0,0,0,0|2,0,1]=4 693 B5R0.3 CSC(=C)CO Amb25334721 [1,0,0,0,0,0|1,0,2]=4 694 B5R0.3 CSC(=O)CO Amb25834913 [1,0,0,0,0,0|2,0,1]=4 695 B5R0.3 CSC(C)=NO Amb24589279 [1,0,0,0,0,0|2,0,0]=3 696 B5R0.3 CSC(C)CO Amb24438636 [1,0,0,0,0,0|1,0,2]=4 697 B5R0.3 CSC(Cl)=CCl Amb25025281 [1,0,0,0,0,0|3,0,0]=4 698 B5R0.3 CS[C@@H](C)CO Amb25255982 [1,0,0,0,0,0|1,0,2]=4 699 B5R0.3 CS[C@H](C)CO Amb25376268 [1,0,0,0,0,0|1,0,2]=4 700 B5R0.3 CS\C(\C)=N\O Amb22729825 [1,0,0,0,0,0|2,0,0]=3 701 B5R0.3 C[C@@H](CBr)C=O Amb25024867 [1,0,0,0,0,0|1,0,2]=4 702 B5R0.3 C[C@@H](CO)C=C Amb25145603 [1,0,0,0,0,0|0,0,3]=4 703 B5R0.3 C[C@@H](CO)C=O Amb24750144 [1,0,0,0,0,0|1,0,2]=4 704 B5R0.3 C[C@@H](OC)CO Amb10603218 [1,0,0,0,0,0|1,0,2]=4 705 B5R0.3 C\C(=C/Cl)\C#N Amb18120026 [1,0,0,0,0,0|2,0,1]=4 706 B5R0.3 C\C(=C/O)\C=O Amb25276378 [1,0,0,0,0,0|1,0,0]=2 707 B5R0.3 C\C(=C\N)\C=O Amb24090370 [1,0,0,0,0,0|1,0,0]=2 708 B5R0.3 C\C(\C=C)=C/I Amb24652456 [1,0,0,0,0,0|1,0,1]=3 709 B5R0.3 C\C(\C=C)=C\Cl Amb24751401 [1,0,0,0,0,0|1,0,1]=3 710 B5R0.3 C\C(\C=C)=C\I Amb24512122 [1,0,0,0,0,0|1,0,1]=3 711 B5R0.3 C\C(\C=C)=C\N Amb24560866 [1,0,0,0,0,0|1,0,1]=3 712 B5R0.3 C\C(\C=C)=C\O Amb25808114 [1,0,0,0,0,0|0,0,1]=2 713 B5R0.3 C\C(\C=O)=C/Cl Amb25275130 [1,0,0,0,0,0|1,0,0]=2 714 B5R0.3 C\C(\C=O)=C/I Amb25326015 [1,0,0,0,0,0|1,0,0]=2 715 B5R0.3 C\C(\C=O)=C\Cl Amb18640380 [1,0,0,0,0,0|1,0,0]=2 716 B5R0.3 C\C(\C=O)=N/O Amb24478401 [1,0,0,0,0,0|2,0,0]=3 717 B5R0.3 C\C(\CBr)=C/Br Amb24632388 [1,0,0,0,0,0|2,0,1]=4 718 B5R0.3 C\C(\CC)=C/C Amb22733177 [1,0,0,0,0,0|1,0,1]=3 719 B5R0.3 C\C(\CI)=C/Cl Amb25146418 [1,0,0,0,0,0|2,0,1]=4 720 B5R0.3 C\C(\CN)=C/Br Amb25839389 [1,0,0,0,0,0|2,0,1]=4 721 B5R0.3 C\C(\CN)=C\Br Amb25024438 [1,0,0,0,0,0|2,0,1]=4 722 B5R0.3 C\C(\CN)=N\O Amb24411534 [1,0,0,0,0,0|2,0,1]=4 723 B5R0.3 C\C(\CS)=N/O Amb22343051 [1,0,0,0,0,0|2,0,1]=4 724 B5R0.3 C\C(\NN)=N\O Amb23481618 [1,0,0,0,0,0|3,0,0]=4 725 B5R0.3 C\C=C(/Br)\C=O Amb24478125 [1,0,0,0,0,0|1,0,0]=2 726 B5R0.3 C\C=C(/Br)\CBr Amb25822740 [1,0,0,0,0,0|2,0,1]=4 727 B5R0.3 C\C=C(/Br)\CN Amb25231059 [1,0,0,0,0,0|2,0,1]=4 728 B5R0.3 C\C=C(/C)\C#N Amb22348345 [1,0,0,0,0,0|1,0,1]=3 729 B5R0.3 C\C=C(/C)\C=C Amb22347881 [1,0,0,0,0,0|1,0,0]=2 730 B5R0.3 C\C=C(/Cl)\C=O Amb18122386 [1,0,0,0,0,0|1,0,0]=2 731 B5R0.3 C\C=C(/Cl)\CBr Amb25811587 [1,0,0,0,0,0|2,0,1]=4 732 B5R0.3 C\C=C(/F)\C=O Amb24391675 [1,0,0,0,0,0|1,0,0]=2 733 B5R0.3 C\C=C(/F)\CBr Amb22546798 [1,0,0,0,0,0|2,0,1]=4 734 B5R0.3 C\C=C(/F)\CO Amb22546797 [1,0,0,0,0,0|1,0,1]=3 735 B5R0.3 C\C=C(\Br)/C#N Amb18638646 [1,0,0,0,0,0|2,0,1]=4 736 B5R0.3 C\C=C(\Br)/C=O Amb18124612 [1,0,0,0,0,0|1,0,0]=2 737 B5R0.3 C\C=C(\Br)/CO Amb25809972 [1,0,0,0,0,0|1,0,1]=3 738 B5R0.3 C\C=C(\C)/C#N Amb25067852 [1,0,0,0,0,0|1,0,1]=3 739 B5R0.3 C\C=C(\C)/C=C Amb24099382 [1,0,0,0,0,0|1,0,0]=2 740 B5R0.3 C\C=C(\C)/C=O Amb24333046 [1,0,0,0,0,0|0,0,0]=1 741 B5R0.3 C\C=C(\C)/CBr Amb24595225 [1,0,0,0,0,0|1,0,1]=3 742 B5R0.3 C\C=C(\C)/CI Amb24711603 [1,0,0,0,0,0|1,0,1]=3 743 B5R0.3 C\C=C(\C)/CN Amb25083555 [1,0,0,0,0,0|1,0,1]=3 744 B5R0.3 C\C=C(\C)/[Mg]Br Amb22338390 [1,0,0,0,0,0|2,0,0]=3 745 B5R0.3 C\C=C(\Cl)/C=O Amb24753590 [1,0,0,0,0,0|1,0,0]=2 746 B5R0.3 C\C=C(\Cl)/CBr Amb25024328 [1,0,0,0,0,0|2,0,1]=4 747 B5R0.3 C\C=C(\Cl)/CCl Amb25727694 [1,0,0,0,0,0|2,0,1]=4 748 B5R0.3 C\C=C(\F)/C=O Amb25746394 [1,0,0,0,0,0|1,0,0]=2 749 B5R0.3 C\C=C(\I)/CN Amb24519149 [1,0,0,0,0,0|2,0,1]=4 750 B5R0.3 C\C=C(\I)/CO Amb25046626 [1,0,0,0,0,0|1,0,1]=3 751 B5R0.3 C\C=C(\N)/C#N Amb25798875 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.3 NC(C=O)C=O Amb22751007 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.3 O=CC(=O)C=O Amb17593025 [1,0,0,0,0,0|2,0,0]=3 754 B5R0.3 O=CC(=O)CBr Amb18644452 [1,0,0,0,0,0|2,0,1]=4 755 B5R0.3 O=CC(=O)CCl Amb18122597 [1,0,0,0,0,0|2,0,1]=4 756 B5R0.3 O=CC(=O)CF Amb25145488 [1,0,0,0,0,0|2,0,1]=4 757 B5R0.3 O=CC(C=O)Br Amb2455922 [1,0,0,0,0,0|2,0,1]=4 758 B5R0.3 O=CC(C=O)C Amb17593026 [1,0,0,0,0,0|1,0,1]=3 759 B5R0.3 O=CC(C=O)O Amb17615780 [1,0,0,0,0,0|2,0,1]=4 760 B5R0.3 O=CC(F)C=O Amb22230729 [1,0,0,0,0,0|2,0,1]=4 761 B5R0.3 O=CC(I)C=O Amb24548139 [1,0,0,0,0,0|2,0,1]=4 762 B5R0.3 O=CN([Na])C=O Amb19884111 [1,0,0,0,0,0|3,0,0]=4 763 B5R0.3 O=C[C-](F)C=O Amb22008001 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.3 O=C\C(\Br)=C/Cl Amb24649105 [1,0,0,0,0,0|2,0,0]=3 765 B5R0.3 O=C\C(\Cl)=C/Cl Amb25810027 [1,0,0,0,0,0|2,0,0]=3 766 B5R0.3 O=C\C(\Cl)=C\Cl Amb18124305 [1,0,0,0,0,0|2,0,0]=3 767 B5R0.3 OCC(=O)C=O Amb17593031 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.3 OCC(Cl)=CCl Amb24567043 [1,0,0,0,0,0|2,0,1]=4 769 B5R0.3 OC\C(\Br)=C\Br Amb22348400 [1,0,0,0,0,0|2,0,1]=4 770 B5R0.3 OC\C(\F)=C/Cl Amb24423861 [1,0,0,0,0,0|2,0,1]=4 771 B5R0.3 O\C=C(/Br)\C=O Amb24478132 [1,0,0,0,0,0|2,0,0]=3 772 B5R0.3 O\C=C(/I)\C=O Amb25226806 [1,0,0,0,0,0|2,0,0]=3 773 B5R0.3 O\C=C(\Br)/C=O Amb24333812 [1,0,0,0,0,0|2,0,0]=3 774 B5R0.3 O\C=C(\O)/C=O Amb22731841 [1,0,0,0,0,0|2,0,0]=3 775 B5R0.3 O\C=C(\S)/C=O Amb24573083 [1,0,0,0,0,0|2,0,0]=3 776 B5R0.3 O\N=C(/Cl)\C=O Amb25275135 [1,0,0,0,0,0|3,0,0]=4 777 B5R0.3 [O-]\C=C(/F)\C=O Amb22735681 [1,0,0,0,0,0|2,0,0]=3 778 B5R0.5 BrC(=C)C(=O)C Amb17593709 [1,0,0,0,0,0|2,0,0]=3 779 B5R0.5 BrC(=C)C(=O)N Amb16233793 [1,0,0,0,0,0|2,0,0]=3 780 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [1,0,0,0,0,0|2,0,0]=3 781 B5R0.5 C=C(Br)C(O)=O Amb20620403 [1,0,0,0,0,0|1,0,0]=2 782 B5R0.5 C=C(Cl)C(=O)Cl Amb24478440 [1,0,0,0,0,0|2,0,0]=3 783 B5R0.5 C=C(Cl)C(O)=O Amb17933971 [1,0,0,0,0,0|1,0,0]=2 784 B5R0.5 C=C(F)C(=O)F Amb24382122 [1,0,0,0,0,0|2,0,0]=3 785 B5R0.5 C=C(F)C(N)=O Amb25312034 [1,0,0,0,0,0|2,0,0]=3 786 B5R0.5 C=C(F)C([O-])=O Amb22263484 [1,0,0,0,0,0|1,0,1]=3 787 B5R0.5 C=C(I)C(N)=O Amb24650953 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.5 CC(=C)B(O)O Amb21857146 [1,0,0,0,0,0|1,0,1]=3 789 B5R0.5 CC(=C)C(=O)F Amb22230833 [1,0,0,0,0,0|1,0,0]=2 790 B5R0.5 CC(=C)C(N)=N Amb24683875 [1,0,0,0,0,0|2,0,0]=3 791 B5R0.5 CC(=C)C(O)=O Amb22230681 [1,0,0,0,0,0|0,0,0]=1 792 B5R0.5 CC(=C)C(O)=O Amb22337777 [1,0,0,0,0,0|0,0,0]=1 793 B5R0.5 CC(=C)C(O)=O Amb22351305 [1,0,0,0,0,0|0,0,0]=1 794 B5R0.5 CC(=C)C(O)=O Amb22351871 [1,0,0,0,0,0|0,0,0]=1 795 B5R0.5 CC(=C)C(O)=O Amb22351927 [1,0,0,0,0,0|0,0,0]=1 796 B5R0.5 CC(=C)C(O)O Amb22228890 [1,0,0,0,0,0|0,0,2]=3 797 B5R0.5 CC(=C)C([O-])=O Amb17943044 [1,0,0,0,0,0|0,0,1]=2 798 B5R0.5 CC(=C)C([O-])=O Amb20240542 [1,0,0,0,0,0|0,0,1]=2 799 B5R0.5 CC(=C)C([O-])=O Amb20240585 [1,0,0,0,0,0|0,0,1]=2 800 B5R0.5 CC(=C)C([O-])=O Amb22045782 [1,0,0,0,0,0|0,0,1]=2 801 B5R0.5 CC(=C)C([O-])=O Amb22045789 [1,0,0,0,0,0|0,0,1]=2 802 B5R0.5 CC(=C)C([O-])=O Amb22229881 [1,0,0,0,0,0|0,0,1]=2 803 B5R0.5 CC(=C)C([O-])=O Amb22230829 [1,0,0,0,0,0|0,0,1]=2 804 B5R0.5 CC(=C)C([O-])=O Amb22231309 [1,0,0,0,0,0|0,0,1]=2 805 B5R0.5 CC(=C)C([O-])=O Amb22730162 [1,0,0,0,0,0|0,0,1]=2 806 B5R0.5 CC(=C)C([O-])=O Amb22730173 [1,0,0,0,0,0|0,0,1]=2 807 B5R0.5 CC(=C)C([O-])=O Amb22730220 [1,0,0,0,0,0|0,0,1]=2 808 B5R0.5 CC(=C)C([O-])=O Amb22730616 [1,0,0,0,0,0|0,0,1]=2 809 B5R0.5 CC(=C)C([O-])=O Amb22732008 [1,0,0,0,0,0|0,0,1]=2 810 B5R0.5 CC(=C)C([O-])=O Amb22732130 [1,0,0,0,0,0|0,0,1]=2 811 B5R0.5 CC(=C)C([O-])=O Amb22732965 [1,0,0,0,0,0|0,0,1]=2 812 B5R0.5 CC(=C)C([O-])=O Amb22733010 [1,0,0,0,0,0|0,0,1]=2 813 B5R0.5 CC(=C)C([O-])=O Amb22733228 [1,0,0,0,0,0|0,0,1]=2 814 B5R0.5 CC(=C)C([O-])=O Amb22733283 [1,0,0,0,0,0|0,0,1]=2 815 B5R0.5 CC(=C)C([O-])=O Amb22733711 [1,0,0,0,0,0|0,0,1]=2 816 B5R0.5 CC(=C)C([O-])=O Amb22734514 [1,0,0,0,0,0|0,0,1]=2 817 B5R0.5 CC(=C)[N+]([O-])=O Amb22228902 [1,0,0,0,0,0|1,0,1]=3 818 B5R0.5 CC(=N)N(C)C Amb20634458 [1,0,0,0,0,0|3,0,0]=4 819 B5R0.5 CC(=N)N(C)C Amb22059214 [1,0,0,0,0,0|3,0,0]=4 820 B5R0.5 CC(=O)C(=C)C Amb17593021 [1,0,0,0,0,0|1,0,0]=2 821 B5R0.5 CC(=O)C(=C)S Amb24721662 [1,0,0,0,0,0|2,0,0]=3 822 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [1,0,0,0,0,0|2,0,0]=3 823 B5R0.5 CC(=O)C(F)C Amb10841897 [1,0,0,0,0,0|2,0,1]=4 824 B5R0.5 CC(=O)C(N)=N Amb24409561 [1,0,0,0,0,0|3,0,0]=4 825 B5R0.5 CC(=O)C(N)=S Amb24581132 [1,0,0,0,0,0|2,1,0]=4 826 B5R0.5 CC(=O)C(N)C Amb17593029 [1,0,0,0,0,0|2,0,1]=4 827 B5R0.5 CC(=O)C(O)O Amb22436762 [1,0,0,0,0,0|1,0,2]=4 828 B5R0.5 CC(=O)C([O-])=O Amb22043412 [1,0,0,0,0,0|1,0,1]=3 829 B5R0.5 CC(=O)C([O-])=O Amb22053857 [1,0,0,0,0,0|1,0,1]=3 830 B5R0.5 CC(=O)C([O-])=O Amb22167358 [1,0,0,0,0,0|1,0,1]=3 831 B5R0.5 CC(=O)C([O-])=O Amb22733838 [1,0,0,0,0,0|1,0,1]=3 832 B5R0.5 CC(=O)N(C)O Amb24066817 [1,0,0,0,0,0|3,0,0]=4 833 B5R0.5 CC(=O)N(N)C Amb17593037 [1,0,0,0,0,0|3,0,0]=4 834 B5R0.5 CC(=O)P(O)=O Amb25368211 [1,0,0,0,0,0|2,0,0]=3 835 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [1,0,0,0,0,0|1,0,1]=3 836 B5R0.5 CC(Br)=C(C)Br Amb24741236 [1,0,0,0,0,0|3,0,0]=4 837 B5R0.5 CC(Br)C(N)=O Amb22491874 [1,0,0,0,0,0|2,0,1]=4 838 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [1,0,0,0,0,0|1,0,1]=3 839 B5R0.5 CC(C(=O)N)C Amb1153145 [1,0,0,0,0,0|1,0,1]=3 840 B5R0.5 CC(C(=O)N)Cl Amb1151918 [1,0,0,0,0,0|2,0,1]=4 841 B5R0.5 CC(C(=O)O)F Amb10605770 [1,0,0,0,0,0|1,0,1]=3 842 B5R0.5 CC(C)=C(C)Br Amb22228669 [1,0,0,0,0,0|2,0,0]=3 843 B5R0.5 CC(C)=[N+](C)[O-] Amb25088285 [1,0,0,0,0,0|2,0,1]=4 844 B5R0.5 CC(C)C(=C)Br Amb22583736 [1,0,0,0,0,0|2,0,1]=4 845 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,0,0|1,0,1]=3 846 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,0,0|1,0,1]=3 847 B5R0.5 CC(C)C(O)O Amb25662421 [1,0,0,0,0,0|0,0,3]=4 848 B5R0.5 CC(C)C(S)=S Amb25200225 [1,0,0,0,0,0|0,2,1]=4 849 B5R0.5 CC(C)C([O-])=O Amb22045473 [1,0,0,0,0,0|0,0,2]=3 850 B5R0.5 CC(C)C([O-])=O Amb22730398 [1,0,0,0,0,0|0,0,2]=3 851 B5R0.5 CC(C)C([O-])=O Amb22734686 [1,0,0,0,0,0|0,0,2]=3 852 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,0,0|2,0,1]=4 853 B5R0.5 CC(C)S([O-])=O Amb19929129 [1,0,0,0,0,0|1,0,2]=4 854 B5R0.5 CC(Cl)=C(Cl)Cl Amb22227671 [1,0,0,0,0,0|3,0,0]=4 855 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [1,0,0,0,0,0|2,0,1]=4 856 B5R0.5 CC(Cl)C(C)=C Amb24407204 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.5 CC(F)C(=O)Cl Amb24472500 [1,0,0,0,0,0|2,0,1]=4 858 B5R0.5 CC(I)C(=O)Cl Amb24559615 [1,0,0,0,0,0|2,0,1]=4 859 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,0,0,0,0|2,0,1]=4 860 B5R0.5 CC(N)=S(=O)=O Amb25142009 [1,0,0,0,0,0|2,0,1]=4 861 B5R0.5 CC(N)C(=O)Br Amb25184851 [1,0,0,0,0,0|2,0,1]=4 862 B5R0.5 CC(N)C(C)=C Amb23536625 [1,0,0,0,0,0|2,0,1]=4 863 B5R0.5 CC(N)C(C)=O Amb19148817 [1,0,0,0,0,0|2,0,1]=4 864 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.5 CC(N)P(O)=O Amb25147710 [1,0,0,0,0,0|2,0,1]=4 866 B5R0.5 CC(N)[13C](O)=O Amb22336671 [1,0,0,0,0,0|1,0,1]=3 867 B5R0.5 CC(O)C(=C)F Amb25695653 [1,0,0,0,0,0|2,0,1]=4 868 B5R0.5 CC(O)C(=C)I Amb24736518 [1,0,0,0,0,0|2,0,1]=4 869 B5R0.5 CC(O)C(=O)Cl Amb25045690 [1,0,0,0,0,0|2,0,1]=4 870 B5R0.5 CC(O)C(O)=O Amb22350027 [1,0,0,0,0,0|1,0,1]=3 871 B5R0.5 CC(O)C([O-])=O Amb17942960 [1,0,0,0,0,0|1,0,2]=4 872 B5R0.5 CC(O)C([O-])=O Amb17943079 [1,0,0,0,0,0|1,0,2]=4 873 B5R0.5 CC(O)C([O-])=O Amb20246816 [1,0,0,0,0,0|1,0,2]=4 874 B5R0.5 CC(O)C([O-])=O Amb21936112 [1,0,0,0,0,0|1,0,2]=4 875 B5R0.5 CC(O)C([O-])=O Amb22002445 [1,0,0,0,0,0|1,0,2]=4 876 B5R0.5 CC(O)C([O-])=O Amb22054134 [1,0,0,0,0,0|1,0,2]=4 877 B5R0.5 CC(O)C([O-])=O Amb22055552 [1,0,0,0,0,0|1,0,2]=4 878 B5R0.5 CC(O)C([O-])=O Amb22167842 [1,0,0,0,0,0|1,0,2]=4 879 B5R0.5 CC(O)C([O-])=O Amb22350448 [1,0,0,0,0,0|1,0,2]=4 880 B5R0.5 CC(O)C([O-])=O Amb22730128 [1,0,0,0,0,0|1,0,2]=4 881 B5R0.5 CC(O)C([O-])=O Amb22730326 [1,0,0,0,0,0|1,0,2]=4 882 B5R0.5 CC(O)C([O-])=O Amb22731947 [1,0,0,0,0,0|1,0,2]=4 883 B5R0.5 CC(O)C([O-])=O Amb22732237 [1,0,0,0,0,0|1,0,2]=4 884 B5R0.5 CC(O)C([O-])=O Amb22732420 [1,0,0,0,0,0|1,0,2]=4 885 B5R0.5 CC(O)C([O-])=O Amb22732487 [1,0,0,0,0,0|1,0,2]=4 886 B5R0.5 CC(O)C([O-])=O Amb22732889 [1,0,0,0,0,0|1,0,2]=4 887 B5R0.5 CC(O)C([O-])=O Amb22733874 [1,0,0,0,0,0|1,0,2]=4 888 B5R0.5 CC(O)C([O-])=O Amb22733995 [1,0,0,0,0,0|1,0,2]=4 889 B5R0.5 CC(O)P(O)=O Amb24333635 [1,0,0,0,0,0|2,0,1]=4 890 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [1,0,0,0,0,0|1,0,2]=4 891 B5R0.5 CC(P)C(N)=O Amb24715877 [1,0,0,0,0,0|2,0,1]=4 892 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [1,0,0,0,0,0|1,0,1]=3 893 B5R0.5 CC([O-])C([O-])=O Amb22045882 [1,0,0,0,0,0|1,0,2]=4 894 B5R0.5 CN(C(=S)N)C Amb1105826 [1,0,0,0,0,0|2,1,0]=4 895 B5R0.5 CN(C(=S)[S-])C Amb10552380 [1,0,0,0,0,0|1,2,0]=4 896 B5R0.5 CN(C(=S)[S-])C Amb10552527 [1,0,0,0,0,0|1,2,0]=4 897 B5R0.5 CN(C)C(=O)F Amb24660451 [1,0,0,0,0,0|2,0,0]=3 898 B5R0.5 CN(C)C(C)=O Amb24323347 [1,0,0,0,0,0|2,0,0]=3 899 B5R0.5 CN(C)C(N)=N Amb22227685 [1,0,0,0,0,0|3,0,0]=4 900 B5R0.5 CN(C)C(N)=O Amb22739731 [1,0,0,0,0,0|2,0,0]=3 901 B5R0.5 CN(C)C(O)=O Amb22348477 [1,0,0,0,0,0|1,0,0]=2 902 B5R0.5 CN(C)C(O)=S Amb24477978 [1,0,0,0,0,0|1,1,0]=3 903 B5R0.5 CN(C)C([S-])=S Amb21868021 [1,0,0,0,0,0|1,2,0]=4 904 B5R0.5 CN(C)C([S-])=S Amb21961876 [1,0,0,0,0,0|1,2,0]=4 905 B5R0.5 CN(C)C([S-])=S Amb22167891 [1,0,0,0,0,0|1,2,0]=4 906 B5R0.5 CN(C)C([S-])=S Amb22167919 [1,0,0,0,0,0|1,2,0]=4 907 B5R0.5 CN(C)C([S-])=S Amb22360776 [1,0,0,0,0,0|1,2,0]=4 908 B5R0.5 CN(C)C([S-])=S Amb22363094 [1,0,0,0,0,0|1,2,0]=4 909 B5R0.5 CN(C)C([S-])=S Amb22432644 [1,0,0,0,0,0|1,2,0]=4 910 B5R0.5 CN(C)C([S-])=S Amb22486651 [1,0,0,0,0,0|1,2,0]=4 911 B5R0.5 CN(C)C([S-])=S Amb22486840 [1,0,0,0,0,0|1,2,0]=4 912 B5R0.5 CN(C)C([S-])=S Amb22730337 [1,0,0,0,0,0|1,2,0]=4 913 B5R0.5 CN(C)C([S-])=S Amb22730563 [1,0,0,0,0,0|1,2,0]=4 914 B5R0.5 CN(C)S(=O)=O Amb20621751 [1,0,0,0,0,0|2,0,1]=4 915 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [1,0,0,0,0,0|2,0,0]=3 916 B5R0.5 CN(O)C(N)=O Amb22055740 [1,0,0,0,0,0|3,0,0]=4 917 B5R0.5 CN([No])C(N)=O Amb20621701 [1,0,0,0,0,0|3,0,0]=4 918 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [1,0,0,0,0,0|1,0,1]=3 919 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [1,0,0,0,0,0|1,0,1]=3 920 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [1,0,0,0,0,0|1,0,1]=3 921 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [1,0,0,0,0,0|2,0,0]=3 922 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [1,0,0,0,0,0|2,0,1]=4 923 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [1,0,0,0,0,0|1,0,1]=3 924 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [1,0,0,0,0,0|2,0,1]=4 925 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [1,0,0,0,0,0|2,0,1]=4 926 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [1,0,0,0,0,0|2,0,1]=4 927 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [1,0,0,0,0,0|2,0,1]=4 928 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [1,0,0,0,0,0|1,0,1]=3 929 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [1,0,0,0,0,0|2,0,1]=4 930 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [1,0,0,0,0,0|1,0,1]=3 931 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [1,0,0,0,0,0|1,0,2]=4 932 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [1,0,0,0,0,0|1,0,2]=4 933 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [1,0,0,0,0,0|2,0,1]=4 934 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [1,0,0,0,0,0|2,0,1]=4 935 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [1,0,0,0,0,0|1,0,1]=3 936 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [1,0,0,0,0,0|2,0,1]=4 937 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [1,0,0,0,0,0|2,0,1]=4 938 B5R0.5 C[C@H](C(C)C)O Amb13952942 [1,0,0,0,0,0|1,0,2]=4 939 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,0,0,0,0|2,0,1]=4 940 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [1,0,0,0,0,0|1,0,1]=3 941 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [1,0,0,0,0,0|1,0,1]=3 942 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [1,0,0,0,0,0|2,0,1]=4 943 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,0,0,0,0|2,0,1]=4 944 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [1,0,0,0,0,0|2,0,1]=4 945 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [1,0,0,0,0,0|1,0,1]=3 946 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [1,0,0,0,0,0|2,0,1]=4 947 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [1,0,0,0,0,0|1,0,2]=4 948 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [1,0,0,0,0,0|1,0,2]=4 949 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [1,0,0,0,0,0|1,0,2]=4 950 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [1,0,0,0,0,0|1,0,2]=4 951 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [1,0,0,0,0,0|1,0,1]=3 952 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [1,0,0,0,0,0|1,0,1]=3 953 B5R0.5 ClC(=O)C(=O)C Amb17593107 [1,0,0,0,0,0|2,0,0]=3 954 B5R0.5 FC(=C)C(=O)C Amb17593032 [1,0,0,0,0,0|2,0,0]=3 955 B5R0.5 FC(=C)C(=O)Cl Amb10838637 [1,0,0,0,0,0|2,0,0]=3 956 B5R0.5 FC(=O)C(=O)F Amb10840380 [1,0,0,0,0,0|3,0,0]=4 957 B5R0.5 FC(C(=O)O)F Amb1953492 [1,0,0,0,0,0|2,0,1]=4 958 B5R0.5 IC(C(=O)O)I Amb17612865 [1,0,0,0,0,0|2,0,1]=4 959 B5R0.5 N=C(S)C(O)=O Amb18640468 [1,0,0,0,0,0|2,0,0]=3 960 B5R0.5 NC(=N)C(=O)O Amb10549353 [1,0,0,0,0,0|2,0,0]=3 961 B5R0.5 NC(=O)C(=O)C Amb17593028 [1,0,0,0,0,0|2,0,0]=3 962 B5R0.5 NC(=O)C(=O)Cl Amb24377962 [1,0,0,0,0,0|3,0,0]=4 963 B5R0.5 NC(=O)C(N)C Amb1156937 [1,0,0,0,0,0|2,0,1]=4 964 B5R0.5 NC(=O)C([O-])=O Amb22053860 [1,0,0,0,0,0|2,0,1]=4 965 B5R0.5 NC(=O)C([O-])=O Amb22351608 [1,0,0,0,0,0|2,0,1]=4 966 B5R0.5 NC(=O)C([O-])=O Amb22730546 [1,0,0,0,0,0|2,0,1]=4 967 B5R0.5 NC(=O)C([O-])=S Amb24402142 [1,0,0,0,0,0|3,0,0]=4 968 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [1,0,0,0,0,0|2,0,1]=4 969 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [1,0,0,0,0,0|2,0,1]=4 970 B5R0.5 NC(Br)C(O)=O Amb25724348 [1,0,0,0,0,0|2,0,1]=4 971 B5R0.5 NC(O)C(O)=O Amb24663706 [1,0,0,0,0,0|2,0,1]=4 972 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [1,0,0,0,0,0|2,0,1]=4 973 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [1,0,0,0,0,0|2,1,0]=4 974 B5R0.5 O=[13C](Cl)[13C](=O)Cl Amb22353781 [1,0,0,0,0,0|3,0,0]=4 975 B5R0.5 OB(C(C)C)O Amb2447044 [1,0,0,0,0,0|1,0,2]=4 976 B5R0.5 OC(=O)C(=O)O Amb10608980 [1,0,0,0,0,0|2,0,0]=3 977 B5R0.5 OC(=O)C(=O)O Amb19134307 [1,0,0,0,0,0|2,0,0]=3 978 B5R0.5 OC(=O)C(=O)S Amb25375340 [1,0,0,0,0,0|2,0,0]=3 979 B5R0.5 OC(=O)C(Br)F Amb10841090 [1,0,0,0,0,0|2,0,1]=4 980 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [1,0,0,0,0,0|2,0,1]=4 981 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [1,0,0,0,0,0|2,0,1]=4 982 B5R0.5 OC(=O)C(Cl)F Amb10838714 [1,0,0,0,0,0|2,0,1]=4 983 B5R0.5 OC(=O)C(F)S Amb25272480 [1,0,0,0,0,0|2,0,1]=4 984 B5R0.5 OC(=O)C(I)Br Amb17610018 [1,0,0,0,0,0|2,0,1]=4 985 B5R0.5 OC(=O)C(I)Cl Amb17610937 [1,0,0,0,0,0|2,0,1]=4 986 B5R0.5 OC(=O)C(I)F Amb10838458 [1,0,0,0,0,0|2,0,1]=4 987 B5R0.5 OC(=O)C(O)=O Amb19374136 [1,0,0,0,0,0|2,0,0]=3 988 B5R0.5 OC(=O)C(O)=O Amb22002537 [1,0,0,0,0,0|2,0,0]=3 989 B5R0.5 OC(=O)C(O)=O Amb22231343 [1,0,0,0,0,0|2,0,0]=3 990 B5R0.5 OC(=O)C(O)=O Amb22352057 [1,0,0,0,0,0|2,0,0]=3 991 B5R0.5 OC(=O)C(O)=O Amb22353291 [1,0,0,0,0,0|2,0,0]=3 992 B5R0.5 OC(=O)C(O)=O Amb22360650 [1,0,0,0,0,0|2,0,0]=3 993 B5R0.5 OC(=O)C(O)=O Amb22360667 [1,0,0,0,0,0|2,0,0]=3 994 B5R0.5 OC(=O)C(O)=O Amb22363275 [1,0,0,0,0,0|2,0,0]=3 995 B5R0.5 OC(=O)C(O)=O Amb22363302 [1,0,0,0,0,0|2,0,0]=3 996 B5R0.5 OC(=O)C(O)=O Amb22394874 [1,0,0,0,0,0|2,0,0]=3 997 B5R0.5 OC(=O)C(O)=O Amb22436461 [1,0,0,0,0,0|2,0,0]=3 998 B5R0.5 OC(=O)C(O)=O Amb22731645 [1,0,0,0,0,0|2,0,0]=3 999 B5R0.5 OC(=O)C(O)=O Amb22731888 [1,0,0,0,0,0|2,0,0]=3 1000 B5R0.5 OC(=O)C(O)=O Amb22897045 [1,0,0,0,0,0|2,0,0]=3 1001 B5R0.5 OC(=O)C(O)=O Amb23412252 [1,0,0,0,0,0|2,0,0]=3 1002 B5R0.5 OC(=O)C(S)=S Amb25695615 [1,0,0,0,0,0|2,0,0]=3 1003 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [1,0,0,0,0,0|2,0,1]=4 1004 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [1,0,0,0,0,0|2,0,1]=4 1005 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [1,0,0,0,0,0|2,0,1]=4 1006 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [1,0,0,0,0,0|2,0,1]=4 1007 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [1,0,0,0,0,0|2,0,1]=4 1008 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [1,0,0,0,0,0|2,0,1]=4 1009 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [1,0,0,0,0,0|2,0,0]=3 1010 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [1,0,0,0,0,0|2,0,0]=3 1011 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [1,0,0,0,0,0|1,0,1]=3 1012 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [1,0,0,0,0,0|1,0,1]=3 1013 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [1,0,0,0,0,0|1,0,1]=3 1014 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [1,0,0,0,0,0|1,0,1]=3 1015 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [1,0,0,0,0,0|1,0,1]=3 1016 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [1,0,0,0,0,0|1,0,2]=4 1017 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [1,0,0,0,0,0|2,0,0]=3 1018 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [1,0,0,0,0,0|2,0,0]=3 1019 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [1,0,0,0,0,0|2,0,0]=3 1020 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [1,0,0,0,0,0|2,0,0]=3 1021 B5R0.5 [O-]C(=O)C([O-])=O Amb17678768 [1,0,0,0,0,0|2,0,1]=4 1022 B5R0.5 [O-]C(=O)C([O-])=O Amb17943075 [1,0,0,0,0,0|2,0,1]=4 1023 B5R0.5 [O-]C(=O)C([O-])=O Amb17943080 [1,0,0,0,0,0|2,0,1]=4 1024 B5R0.5 [O-]C(=O)C([O-])=O Amb19516140 [1,0,0,0,0,0|2,0,1]=4 1025 B5R0.5 [O-]C(=O)C([O-])=O Amb20246439 [1,0,0,0,0,0|2,0,1]=4 1026 B5R0.5 [O-]C(=O)C([O-])=O Amb20246440 [1,0,0,0,0,0|2,0,1]=4 1027 B5R0.5 [O-]C(=O)C([O-])=O Amb20246449 [1,0,0,0,0,0|2,0,1]=4 1028 B5R0.5 [O-]C(=O)C([O-])=O Amb20246450 [1,0,0,0,0,0|2,0,1]=4 1029 B5R0.5 [O-]C(=O)C([O-])=O Amb20246484 [1,0,0,0,0,0|2,0,1]=4 1030 B5R0.5 [O-]C(=O)C([O-])=O Amb20246489 [1,0,0,0,0,0|2,0,1]=4 1031 B5R0.5 [O-]C(=O)C([O-])=O Amb21963194 [1,0,0,0,0,0|2,0,1]=4 1032 B5R0.5 [O-]C(=O)C([O-])=O Amb22002099 [1,0,0,0,0,0|2,0,1]=4 1033 B5R0.5 [O-]C(=O)C([O-])=O Amb22008847 [1,0,0,0,0,0|2,0,1]=4 1034 B5R0.5 [O-]C(=O)C([O-])=O Amb22008848 [1,0,0,0,0,0|2,0,1]=4 1035 B5R0.5 [O-]C(=O)C([O-])=O Amb22045372 [1,0,0,0,0,0|2,0,1]=4 1036 B5R0.5 [O-]C(=O)C([O-])=O Amb22045383 [1,0,0,0,0,0|2,0,1]=4 1037 B5R0.5 [O-]C(=O)C([O-])=O Amb22045394 [1,0,0,0,0,0|2,0,1]=4 1038 B5R0.5 [O-]C(=O)C([O-])=O Amb22045421 [1,0,0,0,0,0|2,0,1]=4 1039 B5R0.5 [O-]C(=O)C([O-])=O Amb22045450 [1,0,0,0,0,0|2,0,1]=4 1040 B5R0.5 [O-]C(=O)C([O-])=O Amb22045454 [1,0,0,0,0,0|2,0,1]=4 1041 B5R0.5 [O-]C(=O)C([O-])=O Amb22045456 [1,0,0,0,0,0|2,0,1]=4 1042 B5R0.5 [O-]C(=O)C([O-])=O Amb22045460 [1,0,0,0,0,0|2,0,1]=4 1043 B5R0.5 [O-]C(=O)C([O-])=O Amb22045466 [1,0,0,0,0,0|2,0,1]=4 1044 B5R0.5 [O-]C(=O)C([O-])=O Amb22045574 [1,0,0,0,0,0|2,0,1]=4 1045 B5R0.5 [O-]C(=O)C([O-])=O Amb22045860 [1,0,0,0,0,0|2,0,1]=4 1046 B5R0.5 [O-]C(=O)C([O-])=O Amb22045877 [1,0,0,0,0,0|2,0,1]=4 1047 B5R0.5 [O-]C(=O)C([O-])=O Amb22052446 [1,0,0,0,0,0|2,0,1]=4 1048 B5R0.5 [O-]C(=O)C([O-])=O Amb22052448 [1,0,0,0,0,0|2,0,1]=4 1049 B5R0.5 [O-]C(=O)C([O-])=O Amb22052474 [1,0,0,0,0,0|2,0,1]=4 1050 B5R0.5 [O-]C(=O)C([O-])=O Amb22053405 [1,0,0,0,0,0|2,0,1]=4 1051 B5R0.5 [O-]C(=O)C([O-])=O Amb22053543 [1,0,0,0,0,0|2,0,1]=4 1052 B5R0.5 [O-]C(=O)C([O-])=O Amb22053546 [1,0,0,0,0,0|2,0,1]=4 1053 B5R0.5 [O-]C(=O)C([O-])=O Amb22053547 [1,0,0,0,0,0|2,0,1]=4 1054 B5R0.5 [O-]C(=O)C([O-])=O Amb22053562 [1,0,0,0,0,0|2,0,1]=4 1055 B5R0.5 [O-]C(=O)C([O-])=O Amb22053601 [1,0,0,0,0,0|2,0,1]=4 1056 B5R0.5 [O-]C(=O)C([O-])=O Amb22231460 [1,0,0,0,0,0|2,0,1]=4 1057 B5R0.5 [O-]C(=O)C([O-])=O Amb22264699 [1,0,0,0,0,0|2,0,1]=4 1058 B5R0.5 [O-]C(=O)C([O-])=O Amb22338348 [1,0,0,0,0,0|2,0,1]=4 1059 B5R0.5 [O-]C(=O)C([O-])=O Amb22338401 [1,0,0,0,0,0|2,0,1]=4 1060 B5R0.5 [O-]C(=O)C([O-])=O Amb22338445 [1,0,0,0,0,0|2,0,1]=4 1061 B5R0.5 [O-]C(=O)C([O-])=O Amb22363119 [1,0,0,0,0,0|2,0,1]=4 1062 B5R0.5 [O-]C(=O)C([O-])=O Amb22432231 [1,0,0,0,0,0|2,0,1]=4 1063 B5R0.5 [O-]C(=O)C([O-])=O Amb22730020 [1,0,0,0,0,0|2,0,1]=4 1064 B5R0.5 [O-]C(=O)C([O-])=O Amb22730044 [1,0,0,0,0,0|2,0,1]=4 1065 B5R0.5 [O-]C(=O)C([O-])=O Amb22732203 [1,0,0,0,0,0|2,0,1]=4 1066 B5R0.5 [O-]C(=O)C([O-])=O Amb22732260 [1,0,0,0,0,0|2,0,1]=4 1067 B5R0.5 [O-]C(=O)C([O-])=O Amb22732351 [1,0,0,0,0,0|2,0,1]=4 1068 B5R0.5 [O-]C(=O)C([O-])=O Amb22732671 [1,0,0,0,0,0|2,0,1]=4 1069 B5R0.5 [O-]C(=O)C([O-])=O Amb22732891 [1,0,0,0,0,0|2,0,1]=4 1070 B5R0.5 [O-]C(=O)C([O-])=O Amb22733764 [1,0,0,0,0,0|2,0,1]=4 1071 B5R0.5 [O-]C(=O)C([O-])=O Amb22734003 [1,0,0,0,0,0|2,0,1]=4 1072 B5R0.5 [O-][13C](=O)[13C]([O-])=O Amb22337921 [1,0,0,0,0,0|2,0,1]=4 1073 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [0,1,0,0,0,0|0,0,2]=3 1074 B7R0.5 C=C(CCBr)C(N)=O Amb24483117 [0,1,0,0,0,0|1,0,2]=4 1075 B7R0.5 C=C(CCCl)C(N)=O Amb24586928 [0,1,0,0,0,0|1,0,2]=4 1076 B7R0.5 C=C(CCO)C(N)=O Amb24548208 [0,1,0,0,0,0|1,0,2]=4 1077 B7R0.5 C=C(CON)C(O)=O Amb25778441 [0,1,0,0,0,0|1,0,2]=4 1078 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [0,1,0,0,0,0|1,0,2]=4 1079 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [0,1,0,0,0,0|1,0,2]=4 1080 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [0,1,0,0,0,0|1,0,2]=4 1081 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [0,1,0,0,0,0|1,0,2]=4 1082 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [0,1,0,0,0,0|1,0,2]=4 1083 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [0,1,0,0,0,0|1,0,2]=4 1084 B7R0.5 C=C\C=C(/Cl)\C(O)=O Amb18642910 [0,1,0,0,0,0|1,0,1]=3 1085 B7R0.5 C=C\C=C(/F)\C(O)=O Amb24402288 [0,1,0,0,0,0|1,0,1]=3 1086 B7R0.5 C=C\C=C(\N)/C(O)=O Amb25306109 [0,1,0,0,0,0|1,0,1]=3 1087 B7R0.5 CC#CC(C)C(C)=O Amb24481199 [0,1,0,0,0,0|1,0,2]=4 1088 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [0,1,0,0,0,0|0,0,2]=3 1089 B7R0.5 CC(=C)C(=O)\C=C/C Amb25838733 [0,1,0,0,0,0|3,0,0]=4 1090 B7R0.5 CC(=C)C(=O)\C=C\C Amb24422389 [0,1,0,0,0,0|3,0,0]=4 1091 B7R0.5 CC(=C)C(Cl)=CCCl Amb24526321 [0,1,0,0,0,0|3,0,0]=4 1092 B7R0.5 CC(=C=CC)C(O)=O Amb24481354 [0,1,0,0,0,0|0,0,0]=1 1093 B7R0.5 CC(=CC#N)C(N)=O Amb25290180 [0,1,0,0,0,0|1,0,1]=3 1094 B7R0.5 CC(=CC#N)C(O)=O Amb24475374 [0,1,0,0,0,0|0,0,1]=2 1095 B7R0.5 CC(=CC=O)C(C)=C Amb25254165 [0,1,0,0,0,0|2,0,1]=4 1096 B7R0.5 CC(=CC=O)C(N)=O Amb24548847 [0,1,0,0,0,0|1,0,1]=3 1097 B7R0.5 CC(=CCBr)C(O)=O Amb24551921 [0,1,0,0,0,0|0,0,0]=1 1098 B7R0.5 CC(=CCCl)C(Cl)Cl Amb25139372 [0,1,0,0,0,0|2,0,1]=4 1099 B7R0.5 CC(=CCCl)C(O)=O Amb25114258 [0,1,0,0,0,0|0,0,0]=1 1100 B7R0.5 CC(=CCN)C(O)=O Amb25845292 [0,1,0,0,0,0|0,0,0]=1 1101 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [0,1,0,0,0,0|0,0,0]=1 1102 B7R0.5 CC(=NNC)C(C)=O Amb25236974 [0,1,0,0,0,0|2,0,0]=3 1103 B7R0.5 CC(=NNC)C(N)=O Amb24761296 [0,1,0,0,0,0|2,0,0]=3 1104 B7R0.5 CC(=NOC)C(C)=O Amb25109810 [0,1,0,0,0,0|2,0,0]=3 1105 B7R0.5 CC(=O)C(=C)CC=C Amb25043218 [0,1,0,0,0,0|1,0,2]=4 1106 B7R0.5 CC(=O)C(=C)CCO Amb25831249 [0,1,0,0,0,0|1,0,2]=4 1107 B7R0.5 CC(=O)C(=C)COC Amb25796652 [0,1,0,0,0,0|1,0,2]=4 1108 B7R0.5 CC(=O)C(=C)\C=C\C Amb25712751 [0,1,0,0,0,0|1,0,1]=3 1109 B7R0.5 CC(=O)C(=O)C#CC Amb24481230 [0,1,0,0,0,0|2,0,1]=4 1110 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [0,1,0,0,0,0|3,0,0]=4 1111 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 1112 B7R0.5 CC(=O)C(=O)COC Amb24694271 [0,1,0,0,0,0|2,0,1]=4 1113 B7R0.5 CC(=O)C(=O)CSC Amb24623163 [0,1,0,0,0,0|2,0,1]=4 1114 B7R0.5 CC(=O)C(=O)\C=C\C Amb24625395 [0,1,0,0,0,0|2,0,0]=3 1115 B7R0.5 CC(=O)C(=O)\C=C\[O-] Amb25340571 [0,1,0,0,0,0|2,0,1]=4 1116 B7R0.5 CC(=O)N(C)CCS Amb25335665 [0,1,0,0,0,0|2,0,1]=4 1117 B7R0.5 CC(=O)\C(\Br)=C\CC Amb25205445 [0,1,0,0,0,0|2,0,0]=3 1118 B7R0.5 CC(=O)\C(\C)=C/C=O Amb18641685 [0,1,0,0,0,0|1,0,1]=3 1119 B7R0.5 CC(=O)\C(\C)=C\C=C Amb24518382 [0,1,0,0,0,0|1,0,1]=3 1120 B7R0.5 CC(=O)\C(\Cl)=C\C=C Amb24594261 [0,1,0,0,0,0|2,0,1]=4 1121 B7R0.5 CC(=O)\C(\Cl)=C\OC Amb24467033 [0,1,0,0,0,0|2,0,0]=3 1122 B7R0.5 CC(=O)\C(\Cl)=C\SC Amb24676545 [0,1,0,0,0,0|2,0,0]=3 1123 B7R0.5 CC(=O)\C(\F)=C/CC Amb24565632 [0,1,0,0,0,0|2,0,0]=3 1124 B7R0.5 CC(=O)\C(\O)=C/NC Amb24515912 [0,1,0,0,0,0|2,0,0]=3 1125 B7R0.5 CC(C(=O)C)CCO Amb13881368 [0,1,0,0,0,0|1,0,2]=4 1126 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [0,1,0,0,0,0|0,0,3]=4 1127 B7R0.5 CC(C(=O)O)CNC Amb13952364 [0,1,0,0,0,0|0,0,2]=3 1128 B7R0.5 CC(C)C(C)=CCBr Amb25179029 [0,1,0,0,0,0|2,0,1]=4 1129 B7R0.5 CC(C)C(C)=CCO Amb25662075 [0,1,0,0,0,0|2,0,1]=4 1130 B7R0.5 CC(C)\C(\C)=C\CBr Amb24526699 [0,1,0,0,0,0|2,0,1]=4 1131 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [0,1,0,0,0,0|1,0,1]=3 1132 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [0,1,0,0,0,0|0,0,3]=4 1133 B7R0.5 CC(CC=C)C(=O)Cl Amb25702960 [0,1,0,0,0,0|1,0,2]=4 1134 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [0,1,0,0,0,0|1,0,2]=4 1135 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [0,1,0,0,0,0|2,0,1]=4 1136 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [0,1,0,0,0,0|1,0,2]=4 1137 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|1,0,2]=4 1138 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [0,1,0,0,0,0|1,0,2]=4 1139 B7R0.5 CC(CCF)C(O)=O Amb24678386 [0,1,0,0,0,0|0,0,2]=3 1140 B7R0.5 CC(CCN)C(C)=O Amb18251071 [0,1,0,0,0,0|1,0,2]=4 1141 B7R0.5 CC(CCN)C(N)=O Amb18641900 [0,1,0,0,0,0|1,0,2]=4 1142 B7R0.5 CC(CCN)C(O)=O Amb20667970 [0,1,0,0,0,0|0,0,2]=3 1143 B7R0.5 CC(CCO)C(O)=O Amb18641949 [0,1,0,0,0,0|0,0,2]=3 1144 B7R0.5 CC(CCS)C(O)=O Amb25133689 [0,1,0,0,0,0|0,0,2]=3 1145 B7R0.5 CC(Cl)=C(C)CCO Amb25284773 [0,1,0,0,0,0|2,0,1]=4 1146 B7R0.5 CC(Cl)C(C)=CCCl Amb24567977 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.5 CC(N)=C(C)N=CN Amb25213221 [0,1,0,0,0,0|3,0,0]=4 1148 B7R0.5 CC(NC=O)C(C)=O Amb23442778 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.5 CC(NC=O)C(N)=O Amb24533730 [0,1,0,0,0,0|2,0,1]=4 1150 B7R0.5 CC(O)C(C)=CC#C Amb25832638 [0,1,0,0,0,0|1,0,2]=4 1151 B7R0.5 CC(O)C(C)=CCO Amb25144974 [0,1,0,0,0,0|1,0,1]=3 1152 B7R0.5 CC(O)C(Cl)=CCCl Amb25834647 [0,1,0,0,0,0|2,0,1]=4 1153 B7R0.5 CC(SC#N)C(O)=O Amb24372688 [0,1,0,0,0,0|1,0,2]=4 1154 B7R0.5 CC=CC(F)=C(F)F Amb22227672 [0,1,0,0,0,0|3,0,0]=4 1155 B7R0.5 CC=N[N+](C)=C(N)N Amb24430028 [0,1,0,0,0,0|3,0,0]=4 1156 B7R0.5 CCC=C(C)C(C)O Amb22229370 [0,1,0,0,0,0|1,0,1]=3 1157 B7R0.5 CCCC(=C)C(=O)Cl Amb25081936 [0,1,0,0,0,0|1,0,2]=4 1158 B7R0.5 CCCC(=C)C(N)=O Amb25189878 [0,1,0,0,0,0|1,0,2]=4 1159 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [0,1,0,0,0,0|0,0,2]=3 1160 B7R0.5 CCCC(=O)C(=O)Cl Amb24690783 [0,1,0,0,0,0|2,0,1]=4 1161 B7R0.5 CCCC(=O)C(N)=O Amb24473081 [0,1,0,0,0,0|2,0,1]=4 1162 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [0,1,0,0,0,0|1,0,1]=3 1163 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [0,1,0,0,0,0|1,0,1]=3 1164 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [0,1,0,0,0,0|1,0,2]=4 1165 B7R0.5 CCCC(C(=O)O)O Amb2582532 [0,1,0,0,0,0|1,0,2]=4 1166 B7R0.5 CCCC(F)C(O)=O Amb25842008 [0,1,0,0,0,0|1,0,2]=4 1167 B7R0.5 CCCC(S)C(O)=O Amb18124440 [0,1,0,0,0,0|1,0,2]=4 1168 B7R0.5 CCCN(C)C(C)=O Amb24451102 [0,1,0,0,0,0|2,0,1]=4 1169 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [0,1,0,0,0,0|1,0,2]=4 1170 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [0,1,0,0,0,0|1,0,2]=4 1171 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [0,1,0,0,0,0|1,0,2]=4 1172 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [0,1,0,0,0,0|1,0,2]=4 1173 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [0,1,0,0,0,0|1,0,2]=4 1174 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [0,1,0,0,0,0|1,0,2]=4 1175 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [0,1,0,0,0,0|1,0,1]=3 1176 B7R0.5 CCNC(=O)C(=O)C Amb17399798 [0,1,0,0,0,0|2,0,1]=4 1177 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|1,0,2]=4 1178 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [0,1,0,0,0,0|0,0,2]=3 1179 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [0,1,0,0,0,0|0,0,2]=3 1180 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|1,0,1]=3 1181 B7R0.5 CCOC(=S)C(=O)N Amb10604171 [0,1,0,0,0,0|2,0,1]=4 1182 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|1,0,2]=4 1183 B7R0.5 CCOC(O)C(O)=O Amb24680848 [0,1,0,0,0,0|1,0,2]=4 1184 B7R0.5 CCON(C)C(C)=O Amb25296888 [0,1,0,0,0,0|2,0,1]=4 1185 B7R0.5 CCO[13C](=O)C(C)=O Amb22056123 [0,1,0,0,0,0|2,0,1]=4 1186 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [0,1,0,0,0,0|0,0,2]=3 1187 B7R0.5 CCSC(=O)C(N)=O Amb25081710 [0,1,0,0,0,0|2,0,1]=4 1188 B7R0.5 CCSC(=S)C(N)=O Amb25109531 [0,1,0,0,0,0|2,0,1]=4 1189 B7R0.5 CCSC(=S)C(O)=O Amb25210892 [0,1,0,0,0,0|1,0,1]=3 1190 B7R0.5 CCSC(O)C(O)=O Amb24444218 [0,1,0,0,0,0|1,0,2]=4 1191 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [0,1,0,0,0,0|0,0,2]=3 1192 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [0,1,0,0,0,0|0,0,2]=3 1193 B7R0.5 CC\C=C(/N)\C(N)=O Amb25858729 [0,1,0,0,0,0|2,0,0]=3 1194 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [0,1,0,0,0,0|1,0,0]=2 1195 B7R0.5 CC\C=C(\C)/C(C)C Amb25290980 [0,1,0,0,0,0|2,0,1]=4 1196 B7R0.5 CC\C=C(\C)/C(C)O Amb25290807 [0,1,0,0,0,0|1,0,1]=3 1197 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [0,1,0,0,0,0|1,0,0]=2 1198 B7R0.5 CC\C=C(\N)/C(N)=O Amb24515060 [0,1,0,0,0,0|2,0,0]=3 1199 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [0,1,0,0,0,0|1,0,0]=2 1200 B7R0.5 CC\C=C(\S)/C(N)=O Amb25265251 [0,1,0,0,0,0|2,0,0]=3 1201 B7R0.5 CN(C(=O)C)CCN Amb17046786 [0,1,0,0,0,0|2,0,1]=4 1202 B7R0.5 CN(CCCl)C(=O)Cl Amb25285023 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.5 CN(CCN)C(N)=O Amb18953297 [0,1,0,0,0,0|2,0,1]=4 1204 B7R0.5 CNCC(=C)C(O)=O Amb24561619 [0,1,0,0,0,0|0,0,2]=3 1205 B7R0.5 CNCC(C(=O)O)N Amb10071505 [0,1,0,0,0,0|1,0,2]=4 1206 B7R0.5 CNCC(C(=O)O)N Amb10845350 [0,1,0,0,0,0|1,0,2]=4 1207 B7R0.5 CNCC(C)C(C)=O Amb25340555 [0,1,0,0,0,0|1,0,2]=4 1208 B7R0.5 CNCC(F)C(O)=O Amb24666017 [0,1,0,0,0,0|1,0,2]=4 1209 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [0,1,0,0,0,0|1,0,2]=4 1210 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [0,1,0,0,0,0|1,0,2]=4 1211 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [0,1,0,0,0,0|1,0,2]=4 1212 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [0,1,0,0,0,0|1,0,2]=4 1213 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [0,1,0,0,0,0|1,0,2]=4 1214 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [0,1,0,0,0,0|1,0,2]=4 1215 B7R0.5 CNN=C(N)C(O)=O Amb25684306 [0,1,0,0,0,0|2,0,0]=3 1216 B7R0.5 CNNC(C)C(O)=O Amb24070183 [0,1,0,0,0,0|1,0,1]=3 1217 B7R0.5 CN\C=C(\F)/C(N)=O Amb25363004 [0,1,0,0,0,0|2,0,0]=3 1218 B7R0.5 COCC(=C)C(N)=O Amb24668981 [0,1,0,0,0,0|1,0,2]=4 1219 B7R0.5 COCC(=O)C(O)=O Amb25304863 [0,1,0,0,0,0|1,0,1]=3 1220 B7R0.5 COCC(C(=O)O)Br Amb17594709 [0,1,0,0,0,0|1,0,2]=4 1221 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [0,1,0,0,0,0|1,0,2]=4 1222 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|1,0,2]=4 1223 B7R0.5 COCC(C)S(O)=O Amb25280974 [0,1,0,0,0,0|1,0,2]=4 1224 B7R0.5 COCC(F)C(O)=O Amb24526772 [0,1,0,0,0,0|1,0,2]=4 1225 B7R0.5 COCC(O)C(O)=O Amb18124273 [0,1,0,0,0,0|1,0,2]=4 1226 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [0,1,0,0,0,0|1,0,2]=4 1227 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [0,1,0,0,0,0|1,0,2]=4 1228 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [0,1,0,0,0,0|1,0,2]=4 1229 B7R0.5 CONC(=O)C(O)=O Amb25340523 [0,1,0,0,0,0|2,0,0]=3 1230 B7R0.5 CO\C=C(/Cl)\C(N)=O Amb24350201 [0,1,0,0,0,0|2,0,0]=3 1231 B7R0.5 CO\C=C(/F)\C(=O)Cl Amb22641619 [0,1,0,0,0,0|2,0,0]=3 1232 B7R0.5 CO\C=C(\Cl)/C(N)=O Amb24531651 [0,1,0,0,0,0|2,0,0]=3 1233 B7R0.5 CO\C=C(\Cl)/C(O)=O Amb24385677 [0,1,0,0,0,0|1,0,0]=2 1234 B7R0.5 CO\C=C(\F)/C(O)=O Amb22641708 [0,1,0,0,0,0|1,0,0]=2 1235 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [0,1,0,0,0,0|1,0,2]=4 1236 B7R0.5 CSCC(C)C(C)=O Amb25268934 [0,1,0,0,0,0|1,0,2]=4 1237 B7R0.5 CSCC(C)C(N)=O Amb24475326 [0,1,0,0,0,0|1,0,2]=4 1238 B7R0.5 CSCC(C)C(O)=O Amb18967825 [0,1,0,0,0,0|0,0,2]=3 1239 B7R0.5 CSCC(O)C(O)=O Amb25131873 [0,1,0,0,0,0|1,0,2]=4 1240 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [0,1,0,0,0,0|1,0,2]=4 1241 B7R0.5 CSSC(C)C(O)=O Amb25701741 [0,1,0,0,0,0|1,0,1]=3 1242 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [0,1,0,0,0,0|0,0,3]=4 1243 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [0,1,0,0,0,0|0,0,2]=3 1244 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [0,1,0,0,0,0|0,0,2]=3 1245 B7R0.5 C[C@@H](CC=C)C(N)=O Amb25232867 [0,1,0,0,0,0|1,0,2]=4 1246 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [0,1,0,0,0,0|0,0,2]=3 1247 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [0,1,0,0,0,0|1,0,1]=3 1248 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [0,1,0,0,0,0|2,0,1]=4 1249 B7R0.5 C[C@@H](O)C(C)=CC#N Amb24475497 [0,1,0,0,0,0|1,0,2]=4 1250 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [0,1,0,0,0,0|0,0,3]=4 1251 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [0,1,0,0,0,0|0,0,2]=3 1252 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [0,1,0,0,0,0|0,0,2]=3 1253 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [0,1,0,0,0,0|0,0,2]=3 1254 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [0,1,0,0,0,0|0,0,2]=3 1255 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [0,1,0,0,0,0|0,0,3]=4 1256 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [0,1,0,0,0,0|0,0,2]=3 1257 B7R0.5 C[C@H](N=[N+]=[N-])C(O)=O Amb25274282 [0,1,0,0,0,0|2,0,1]=4 1258 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [0,1,0,0,0,0|1,0,1]=3 1259 B7R0.5 C[C@H](O)C(C)=CC#N Amb25204757 [0,1,0,0,0,0|1,0,2]=4 1260 B7R0.5 C[C@H](SC#N)C(O)=O Amb24333429 [0,1,0,0,0,0|1,0,2]=4 1261 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [0,1,0,0,0,0|1,0,1]=3 1262 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [0,1,0,0,0,0|1,0,2]=4 1263 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [0,1,0,0,0,0|1,0,2]=4 1264 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [0,1,0,0,0,0|1,0,2]=4 1265 B7R0.5 C\C(=C/C#C)\C(O)=O Amb24472639 [0,1,0,0,0,0|0,0,1]=2 1266 B7R0.5 C\C(=C/C#N)\C(C)=O Amb18123827 [0,1,0,0,0,0|1,0,1]=3 1267 B7R0.5 C\C(=C/C=C)\C(O)=O Amb25258956 [0,1,0,0,0,0|0,0,1]=2 1268 B7R0.5 C\C(=C/CBr)\C(O)=O Amb24433947 [0,1,0,0,0,0|0,0,0]=1 1269 B7R0.5 C\C(=C/CC)\C(C)=O Amb25067970 [0,1,0,0,0,0|1,0,0]=2 1270 B7R0.5 C\C(=C/CC)\C(N)=N Amb24549842 [0,1,0,0,0,0|2,0,0]=3 1271 B7R0.5 C\C(=C/CCl)\C(O)=O Amb25844891 [0,1,0,0,0,0|0,0,0]=1 1272 B7R0.5 C\C(=C/CO)\C(C)=O Amb25188393 [0,1,0,0,0,0|1,0,0]=2 1273 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [0,1,0,0,0,0|0,0,0]=1 1274 B7R0.5 C\C(=C/NC)\C(C)=O Amb24689530 [0,1,0,0,0,0|1,0,0]=2 1275 B7R0.5 C\C(=C/OC)\C(C)=O Amb24691706 [0,1,0,0,0,0|1,0,0]=2 1276 B7R0.5 C\C(=C/OC)\C(O)=O Amb18641867 [0,1,0,0,0,0|0,0,0]=1 1277 B7R0.5 C\C(=C/SC)\C(C)=O Amb24481401 [0,1,0,0,0,0|1,0,0]=2 1278 B7R0.5 C\C(=C\CBr)\C(F)F Amb25361128 [0,1,0,0,0,0|2,0,1]=4 1279 B7R0.5 C\C(=C\CC)\C(C)=O Amb24575271 [0,1,0,0,0,0|1,0,0]=2 1280 B7R0.5 C\C(=C\CC)\C(N)=N Amb24549902 [0,1,0,0,0,0|2,0,0]=3 1281 B7R0.5 C\C(=C\CC)\C(N)=O Amb24706168 [0,1,0,0,0,0|1,0,0]=2 1282 B7R0.5 C\C(=C\NC)\C(C)=O Amb24640763 [0,1,0,0,0,0|1,0,0]=2 1283 B7R0.5 C\C(=C\OC)\C(N)=O Amb25323795 [0,1,0,0,0,0|1,0,0]=2 1284 B7R0.5 C\C(=C\SC)\C(C)=O Amb25278649 [0,1,0,0,0,0|1,0,0]=2 1285 B7R0.5 C\C(=N/NC)\C(C)=O Amb25202569 [0,1,0,0,0,0|2,0,0]=3 1286 B7R0.5 C\C(=N/OC)\C(C)=O Amb25262268 [0,1,0,0,0,0|2,0,0]=3 1287 B7R0.5 C\C(\Cl)=C(\C)/CCCl Amb24481471 [0,1,0,0,0,0|2,0,1]=4 1288 B7R0.5 C\C=C/C(=O)C(C)O Amb24481478 [0,1,0,0,0,0|2,0,1]=4 1289 B7R0.5 C\C=C/C(N)C(N)=O Amb24679364 [0,1,0,0,0,0|2,0,1]=4 1290 B7R0.5 C\C=C/C(O)C(=C)O Amb24437447 [0,1,0,0,0,0|2,0,1]=4 1291 B7R0.5 C\C=C/C(O)C(C)=O Amb24526785 [0,1,0,0,0,0|2,0,1]=4 1292 B7R0.5 C\C=C\C(=O)C(C)O Amb24644349 [0,1,0,0,0,0|2,0,1]=4 1293 B7R0.5 C\C=C\C(=O)C(O)=O Amb24568283 [0,1,0,0,0,0|1,0,0]=2 1294 B7R0.5 C\C=C\C(=O)N(C)O Amb24611948 [0,1,0,0,0,0|3,0,0]=4 1295 B7R0.5 C\C=C\C(=O)[C@H](C)O Amb25241352 [0,1,0,0,0,0|2,0,1]=4 1296 B7R0.5 C\C=C\C(C)C(N)=O Amb25299936 [0,1,0,0,0,0|1,0,1]=3 1297 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [0,1,0,0,0,0|0,0,1]=2 1298 B7R0.5 C\C=C\C(N)C(N)=O Amb24515058 [0,1,0,0,0,0|2,0,1]=4 1299 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [0,1,0,0,0,0|1,0,1]=3 1300 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [0,1,0,0,0,0|1,0,1]=3 1301 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [0,1,0,0,0,0|0,0,1]=2 1302 B7R0.5 C\C=C\[C@@H](C)[C@H](C)O Amb25056250 [0,1,0,0,0,0|1,0,2]=4 1303 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [0,1,0,0,0,0|0,0,1]=2 1304 B7R0.5 C\C=C\[C@H](O)C(C)=O Amb25287343 [0,1,0,0,0,0|2,0,1]=4 1305 B7R0.5 N=C(NC=O)S(O)=O Amb25167503 [0,1,0,0,0,0|3,0,0]=4 1306 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [0,1,0,0,0,0|1,0,2]=4 1307 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [0,1,0,0,0,0|1,0,2]=4 1308 B7R0.5 NC(CCI)C(O)=O Amb25339674 [0,1,0,0,0,0|1,0,2]=4 1309 B7R0.5 NC(CCS)C(O)=O Amb19267093 [0,1,0,0,0,0|1,0,2]=4 1310 B7R0.5 NC(\C=C\Cl)C(O)=O Amb24483058 [0,1,0,0,0,0|1,0,2]=4 1311 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [0,1,0,0,0,0|1,0,1]=3 1312 B7R0.5 NCCC(C(=O)O)F Amb10838221 [0,1,0,0,0,0|1,0,2]=4 1313 B7R0.5 NCCC(C(=O)O)O Amb16232090 [0,1,0,0,0,0|1,0,2]=4 1314 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [0,1,0,0,0,0|1,0,2]=4 1315 B7R0.5 NCCC(F)C(O)=O Amb22229524 [0,1,0,0,0,0|1,0,2]=4 1316 B7R0.5 NCCC(N)C(O)=O Amb17678762 [0,1,0,0,0,0|1,0,2]=4 1317 B7R0.5 NCCC(N)C(O)=O Amb22348212 [0,1,0,0,0,0|1,0,2]=4 1318 B7R0.5 NCCC(S)C(O)=O Amb25083375 [0,1,0,0,0,0|1,0,2]=4 1319 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [0,1,0,0,0,0|1,0,2]=4 1320 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [0,1,0,0,0,0|1,0,2]=4 1321 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [0,1,0,0,0,0|1,0,2]=4 1322 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [0,1,0,0,0,0|1,0,2]=4 1323 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [0,1,0,0,0,0|1,0,2]=4 1324 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [0,1,0,0,0,0|1,0,2]=4 1325 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [0,1,0,0,0,0|1,0,2]=4 1326 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [0,1,0,0,0,0|1,0,2]=4 1327 B7R0.5 NC\C=C(/Br)\C(O)=O Amb24483175 [0,1,0,0,0,0|1,0,0]=2 1328 B7R0.5 NC\C=C(\Br)/C(O)=O Amb24627030 [0,1,0,0,0,0|1,0,0]=2 1329 B7R0.5 NC\C=C(\Cl)/C(O)=O Amb25231611 [0,1,0,0,0,0|1,0,0]=2 1330 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [0,1,0,0,0,0|1,0,2]=4 1331 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [0,1,0,0,0,0|2,0,1]=4 1332 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [0,1,0,0,0,0|2,0,1]=4 1333 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [0,1,0,0,0,0|1,0,2]=4 1334 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [0,1,0,0,0,0|1,0,2]=4 1335 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [0,1,0,0,0,0|1,0,2]=4 1336 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [0,1,0,0,0,0|1,0,2]=4 1337 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [0,1,0,0,0,0|1,0,2]=4 1338 B7R0.5 N[C@H](\C=C\Cl)C(O)=O Amb25230190 [0,1,0,0,0,0|1,0,2]=4 1339 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [0,1,0,0,0,0|2,0,1]=4 1340 B7R0.5 O=CCN(C(=O)C)C Amb17080668 [0,1,0,0,0,0|3,0,0]=4 1341 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [0,1,0,0,0,0|1,0,1]=3 1342 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [0,1,0,0,0,0|1,0,1]=3 1343 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 1344 B7R0.5 OC(=O)C(=O)\C=C\O Amb24699120 [0,1,0,0,0,0|1,0,1]=3 1345 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|1,0,2]=4 1346 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [0,1,0,0,0,0|1,0,2]=4 1347 B7R0.5 OC(=O)C(Cl)=CCBr Amb24621021 [0,1,0,0,0,0|1,0,0]=2 1348 B7R0.5 OC(=O)C(Cl)=CCCl Amb25836746 [0,1,0,0,0,0|1,0,0]=2 1349 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|1,0,2]=4 1350 B7R0.5 OC(=O)C(O)=CC=O Amb25339531 [0,1,0,0,0,0|1,0,1]=3 1351 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [0,1,0,0,0,0|1,0,2]=4 1352 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [0,1,0,0,0,0|1,0,0]=2 1353 B7R0.5 OC(=O)\C(\Br)=C\C=O Amb25242509 [0,1,0,0,0,0|1,0,1]=3 1354 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [0,1,0,0,0,0|1,0,0]=2 1355 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [0,1,0,0,0,0|1,0,0]=2 1356 B7R0.5 OC(=O)\C(\O)=C\C=O Amb25082413 [0,1,0,0,0,0|1,0,1]=3 1357 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [0,1,0,0,0,0|2,0,1]=4 1358 B7R0.5 OC(CCS)C(O)=O Amb24586206 [0,1,0,0,0,0|1,0,2]=4 1359 B7R0.5 OCC/C(Br)=C(/O)Br Amb17942926 [0,1,0,0,0,0|2,0,1]=4 1360 B7R0.5 OCCC(O)C(O)=O Amb24689942 [0,1,0,0,0,0|1,0,2]=4 1361 B7R0.5 OCNC(=N)S(O)=O Amb17674108 [0,1,0,0,0,0|3,0,0]=4 1362 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [0,1,0,0,0,0|1,0,2]=4 1363 B7R0.5 [13CH3][13CH2]OC(=O)C(=O)Cl Amb22353953 [0,1,0,0,0,0|2,0,1]=4 1364 B7R0.5 [2H][13CH2]CC(=O)C([O-])=O Amb22337314 [0,1,0,0,0,0|1,0,2]=4 1365 B7R0.5 [N-]=[N+]=CC(=O)C(O)=O Amb25760149 [0,1,0,0,0,0|2,0,0]=3 1366 B7R0.5 [O-]C(=O)C(=O)OCC Amb16192061 [0,1,0,0,0,0|1,0,2]=4 1367 B7R0.10 BrCC(=O)C(=O)OC Amb2455971 [0,1,0,0,0,0|2,0,1]=4 1368 B7R0.10 CC(=C=C)C(=O)CBr Amb24691328 [0,1,0,0,0,0|1,0,2]=4 1369 B7R0.10 CC(=C=C)C(=O)CC Amb25190020 [0,1,0,0,0,0|1,0,2]=4 1370 B7R0.10 CC(=C=C)C(=O)CCl Amb24761291 [0,1,0,0,0,0|1,0,2]=4 1371 B7R0.10 CC(=C=O)C(=O)CC Amb25054488 [0,1,0,0,0,0|2,0,1]=4 1372 B7R0.10 CC(=CBr)C(=O)CC Amb25358728 [0,1,0,0,0,0|2,0,0]=3 1373 B7R0.10 CC(=CC)C(=O)CC Amb25233725 [0,1,0,0,0,0|1,0,0]=2 1374 B7R0.10 CC(=CC)C(=O)NC Amb24476602 [0,1,0,0,0,0|1,0,0]=2 1375 B7R0.10 CC(=CCl)C(C)=CCl Amb24740780 [0,1,0,0,0,0|3,0,0]=4 1376 B7R0.10 CC(=CN)C(=O)OC Amb24568871 [0,1,0,0,0,0|1,0,0]=2 1377 B7R0.10 CC(=NN)C(=O)CC Amb25263116 [0,1,0,0,0,0|3,0,0]=4 1378 B7R0.10 CC(=NN)C(C)=NO Amb24504503 [0,1,0,0,0,0|3,0,0]=4 1379 B7R0.10 CC(=NO)C(=O)CBr Amb24601510 [0,1,0,0,0,0|3,0,0]=4 1380 B7R0.10 CC(C#N)C(=O)NO Amb25106145 [0,1,0,0,0,0|1,0,2]=4 1381 B7R0.10 CC(C(=O)NN)CC Amb1124144 [0,1,0,0,0,0|1,0,2]=4 1382 B7R0.10 CC(C(=O)NN)OC Amb2081552 [0,1,0,0,0,0|2,0,1]=4 1383 B7R0.10 CC(C(=O)OC)C#N Amb17210509 [0,1,0,0,0,0|1,0,2]=4 1384 B7R0.10 CC(C(=O)OC)CN Amb13952562 [0,1,0,0,0,0|1,0,2]=4 1385 B7R0.10 CC(C=C)C(=O)C=C Amb24619641 [0,1,0,0,0,0|1,0,2]=4 1386 B7R0.10 CC(C=O)C(C)=CCl Amb24474448 [0,1,0,0,0,0|2,0,1]=4 1387 B7R0.10 CC(CC)=C(F)C=O Amb24621033 [0,1,0,0,0,0|1,0,1]=3 1388 B7R0.10 CC(CC)C(=O)CC Amb22229845 [0,1,0,0,0,0|1,0,2]=4 1389 B7R0.10 CC(CCl)C(=O)NO Amb24659587 [0,1,0,0,0,0|1,0,2]=4 1390 B7R0.10 CC(CO)=C(C)CCl Amb24398643 [0,1,0,0,0,0|2,0,1]=4 1391 B7R0.10 CC(OC)C(=N)OC Amb24483161 [0,1,0,0,0,0|2,0,1]=4 1392 B7R0.10 CC=C(Br)C(=O)OC Amb24618775 [0,1,0,0,0,0|1,0,0]=2 1393 B7R0.10 CC=C(C)\C(\C)=C\Cl Amb25200716 [0,1,0,0,0,0|2,0,0]=3 1394 B7R0.10 CC=C(Cl)C(Cl)OC Amb25701390 [0,1,0,0,0,0|2,0,1]=4 1395 B7R0.10 CCC(=C)C(=N)NO Amb24482604 [0,1,0,0,0,0|1,0,2]=4 1396 B7R0.10 CCC(=C)C(=O)OC Amb24469857 [0,1,0,0,0,0|0,0,2]=3 1397 B7R0.10 CCC(=O)C(/C)=C\N Amb17778143 [0,1,0,0,0,0|2,0,0]=3 1398 B7R0.10 CCC(=O)C(=C)CC Amb17593165 [0,1,0,0,0,0|1,0,2]=4 1399 B7R0.10 CCC(=O)C(=C)CO Amb24364209 [0,1,0,0,0,0|2,0,1]=4 1400 B7R0.10 CCC(=O)C(=N)NO Amb24744342 [0,1,0,0,0,0|2,0,1]=4 1401 B7R0.10 CCC(=O)C(=O)C=O Amb25758777 [0,1,0,0,0,0|1,0,2]=4 1402 B7R0.10 CCC(=O)C(=O)CBr Amb24730429 [0,1,0,0,0,0|2,0,1]=4 1403 B7R0.10 CCC(=O)C(=O)NN Amb24706937 [0,1,0,0,0,0|2,0,1]=4 1404 B7R0.10 CCC(=O)C(=O)NO Amb25304726 [0,1,0,0,0,0|1,0,1]=3 1405 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,0,0,0,0|1,0,1]=3 1406 B7R0.10 CCC(=O)C(Br)=CC Amb24600977 [0,1,0,0,0,0|2,0,0]=3 1407 B7R0.10 CCC(=O)C(C)C=O Amb18641776 [0,1,0,0,0,0|2,0,1]=4 1408 B7R0.10 CCC(=O)C(C)NC Amb25738187 [0,1,0,0,0,0|2,0,1]=4 1409 B7R0.10 CCC(=O)C(C)OC Amb24718758 [0,1,0,0,0,0|2,0,1]=4 1410 B7R0.10 CCC(=O)C(Cl)=CC Amb24512746 [0,1,0,0,0,0|2,0,0]=3 1411 B7R0.10 CCC(=O)C(F)=CC Amb24617907 [0,1,0,0,0,0|2,0,0]=3 1412 B7R0.10 CCC(=O)[C@@H](C)SC Amb24737470 [0,1,0,0,0,0|2,0,1]=4 1413 B7R0.10 CCC(=O)\C(=N/O)\C Amb10552519 [0,1,0,0,0,0|2,0,1]=4 1414 B7R0.10 CCC(=O)\C(=N\O)\C Amb17615135 [0,1,0,0,0,0|2,0,1]=4 1415 B7R0.10 CCC(=O)\C(\Cl)=C\Cl Amb24689534 [0,1,0,0,0,0|3,0,0]=4 1416 B7R0.10 CCC(=O)\C(\Cl)=N\O Amb25031538 [0,1,0,0,0,0|2,0,1]=4 1417 B7R0.10 CCC(C(=O)OC)Br Amb1157544 [0,1,0,0,0,0|1,0,2]=4 1418 B7R0.10 CCC(C(=O)OC)N Amb17601372 [0,1,0,0,0,0|1,0,2]=4 1419 B7R0.10 CCC(C)=C(C)CN Amb25675055 [0,1,0,0,0,0|2,0,1]=4 1420 B7R0.10 CCC(C)=C(C)CO Amb25052170 [0,1,0,0,0,0|1,0,1]=3 1421 B7R0.10 CCC(C)C(=C)C=O Amb18641701 [0,1,0,0,0,0|1,0,2]=4 1422 B7R0.10 CCC(C)C(=N)OC Amb20623203 [0,1,0,0,0,0|1,0,2]=4 1423 B7R0.10 CCC(C)C(=O)C#C Amb25745951 [0,1,0,0,0,0|1,0,2]=4 1424 B7R0.10 CCC(C)C(=O)C=O Amb24481549 [0,1,0,0,0,0|0,0,3]=4 1425 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [0,1,0,0,0,0|1,0,2]=4 1426 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [0,1,0,0,0,0|1,0,2]=4 1427 B7R0.10 CCC(C)C(=O)CF Amb25736326 [0,1,0,0,0,0|1,0,2]=4 1428 B7R0.10 CCC(C)C(=O)CO Amb24680373 [0,1,0,0,0,0|0,0,2]=3 1429 B7R0.10 CCC(C)C(=O)SC Amb22168284 [0,1,0,0,0,0|0,1,2]=4 1430 B7R0.10 CCC(C)C(C)=CC Amb22229004 [0,1,0,0,0,0|2,0,1]=4 1431 B7R0.10 CCC(C)\C(\N)=N\O Amb19516921 [0,1,0,0,0,0|1,0,2]=4 1432 B7R0.10 CCC(C)\C(\N)=N\O Amb22586630 [0,1,0,0,0,0|1,0,2]=4 1433 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [0,1,0,0,0,0|1,0,2]=4 1434 B7R0.10 CCC(Cl)C(=O)OF Amb24483107 [0,1,0,0,0,0|1,0,2]=4 1435 B7R0.10 CCC(N)C(=O)NO Amb21922881 [0,1,0,0,0,0|1,0,2]=4 1436 B7R0.10 CCC(N)C(=O)OC Amb22349873 [0,1,0,0,0,0|1,0,2]=4 1437 B7R0.10 CCC(O)C(Br)=CC Amb24706256 [0,1,0,0,0,0|2,0,1]=4 1438 B7R0.10 CCC(O)C(C)=CC Amb24464702 [0,1,0,0,0,0|1,0,1]=3 1439 B7R0.10 CCC(O)C(Cl)=CC Amb25221001 [0,1,0,0,0,0|2,0,1]=4 1440 B7R0.10 CCN(C)C(=O)C#C Amb25106168 [0,1,0,0,0,0|2,0,1]=4 1441 B7R0.10 CCN(C)C(=O)CBr Amb22886703 [0,1,0,0,0,0|2,0,1]=4 1442 B7R0.10 CCN(C)C(=O)CS Amb25132563 [0,1,0,0,0,0|1,1,1]=4 1443 B7R0.10 CCN(C)C(=O)NC Amb25084516 [0,1,0,0,0,0|2,0,1]=4 1444 B7R0.10 CCN(C)C(N)=NO Amb25112225 [0,1,0,0,0,0|2,0,1]=4 1445 B7R0.10 CC[C@@H](C)C(=O)OC Amb24549105 [0,1,0,0,0,0|0,0,2]=3 1446 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [0,1,0,0,0,0|1,0,2]=4 1447 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [0,1,0,0,0,0|1,0,2]=4 1448 B7R0.10 CC[C@@H](O)C(=O)OC Amb22746930 [0,1,0,0,0,0|1,0,2]=4 1449 B7R0.10 CC[C@H](C)C(=C)CO Amb25270604 [0,1,0,0,0,0|1,0,2]=4 1450 B7R0.10 CC[C@H](C)C(=O)C#C Amb25830032 [0,1,0,0,0,0|1,0,2]=4 1451 B7R0.10 CC[C@H](C)C(=O)C=C Amb25052297 [0,1,0,0,0,0|1,0,2]=4 1452 B7R0.10 CC[C@H](C)C(=O)CCl Amb24578496 [0,1,0,0,0,0|1,0,2]=4 1453 B7R0.10 CC[C@H](C)C(=O)NN Amb24423489 [0,1,0,0,0,0|1,0,2]=4 1454 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [0,1,0,0,0,0|1,0,2]=4 1455 B7R0.10 CC[C@H](O)C(C)=CC Amb25032079 [0,1,0,0,0,0|1,0,1]=3 1456 B7R0.10 CC\C(\C)=C(\C)/C=O Amb24602986 [0,1,0,0,0,0|1,0,1]=3 1457 B7R0.10 CN(CC)C(=O)CC Amb24663431 [0,1,0,0,0,0|2,0,1]=4 1458 B7R0.10 CNC(=O)C(=C)CO Amb25145253 [0,1,0,0,0,0|3,0,0]=4 1459 B7R0.10 CNC(=O)C(=O)NN Amb2167381 [0,1,0,0,0,0|3,0,0]=4 1460 B7R0.10 CNC(=O)C(=O)NO Amb25377834 [0,1,0,0,0,0|2,0,0]=3 1461 B7R0.10 CNC(=O)C(=S)NC Amb25368320 [0,1,0,0,0,0|3,0,0]=4 1462 B7R0.10 CNC(=O)C(C)SC Amb25742663 [0,1,0,0,0,0|2,0,1]=4 1463 B7R0.10 CNC(=O)\C(=N/O)\C Amb1933236 [0,1,0,0,0,0|3,0,0]=4 1464 B7R0.10 CNC(=O)\C(\N)=N/O Amb19517087 [0,1,0,0,0,0|3,0,0]=4 1465 B7R0.10 CNC(=O)\C(\N)=N\O Amb19651443 [0,1,0,0,0,0|3,0,0]=4 1466 B7R0.10 CNC(=S)C(=O)NN Amb25844400 [0,1,0,0,0,0|3,0,0]=4 1467 B7R0.10 CNC(C)C(=O)NN Amb25803779 [0,1,0,0,0,0|2,0,1]=4 1468 B7R0.10 CNC(C)C(=O)OC Amb18299580 [0,1,0,0,0,0|1,0,1]=3 1469 B7R0.10 CNC(C)C(=O)OC Amb21961535 [0,1,0,0,0,0|1,0,1]=3 1470 B7R0.10 CNC(C)\C(\C)=N\O Amb24401479 [0,1,0,0,0,0|2,0,1]=4 1471 B7R0.10 CN[C@@H](C)C(=O)NN Amb25702337 [0,1,0,0,0,0|2,0,1]=4 1472 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [0,1,0,0,0,0|1,0,1]=3 1473 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [0,1,0,0,0,0|1,0,1]=3 1474 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [0,1,0,0,0,0|1,0,1]=3 1475 B7R0.10 COC(=C)C(=C)OC Amb22338211 [0,1,0,0,0,0|2,0,1]=4 1476 B7R0.10 COC(=N)C(=N)OC Amb25205930 [0,1,0,0,0,0|3,0,0]=4 1477 B7R0.10 COC(=O)C(/C)=C\O Amb17778951 [0,1,0,0,0,0|1,0,0]=2 1478 B7R0.10 COC(=O)C(=C)C#N Amb18641186 [0,1,0,0,0,0|1,0,2]=4 1479 B7R0.10 COC(=O)C(=C)C=C Amb25130487 [0,1,0,0,0,0|0,0,2]=3 1480 B7R0.10 COC(=O)C(=C)CCl Amb19958340 [0,1,0,0,0,0|1,0,2]=4 1481 B7R0.10 COC(=O)C(=C)CO Amb17933844 [0,1,0,0,0,0|1,0,2]=4 1482 B7R0.10 COC(=O)C(=O)C=O Amb24415603 [0,1,0,0,0,0|2,0,0]=3 1483 B7R0.10 COC(=O)C(=O)O[K] Amb22167023 [0,1,0,0,0,0|2,0,0]=3 1484 B7R0.10 COC(=O)C(=S)SC Amb25202170 [0,1,0,0,0,0|2,0,0]=3 1485 B7R0.10 COC(=O)C(Br)C=C Amb24483227 [0,1,0,0,0,0|1,0,2]=4 1486 B7R0.10 COC(=O)C(Br)OC Amb21964964 [0,1,0,0,0,0|2,0,1]=4 1487 B7R0.10 COC(=O)C(C)C#C Amb20171370 [0,1,0,0,0,0|0,0,3]=4 1488 B7R0.10 COC(=O)C(C)C=O Amb18641861 [0,1,0,0,0,0|1,0,1]=3 1489 B7R0.10 COC(=O)C(C)CBr Amb23440928 [0,1,0,0,0,0|1,0,2]=4 1490 B7R0.10 COC(=O)C(C)CI Amb25114121 [0,1,0,0,0,0|1,0,2]=4 1491 B7R0.10 COC(=O)C(C)CS Amb17673607 [0,1,0,0,0,0|1,0,2]=4 1492 B7R0.10 COC(=O)C(C)NN Amb24367186 [0,1,0,0,0,0|2,0,1]=4 1493 B7R0.10 COC(=O)C(C)SC Amb22043309 [0,1,0,0,0,0|1,0,1]=3 1494 B7R0.10 COC(=O)C(C=O)Cl Amb17621536 [0,1,0,0,0,0|2,0,1]=4 1495 B7R0.10 COC(=O)C(Cl)=CBr Amb24511898 [0,1,0,0,0,0|2,0,0]=3 1496 B7R0.10 COC(=O)C(Cl)=CO Amb25847918 [0,1,0,0,0,0|2,0,0]=3 1497 B7R0.10 COC(=O)C(Cl)=NO Amb25082179 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [0,1,0,0,0,0|2,0,1]=4 1499 B7R0.10 COC(=O)C(N)=NN Amb25244637 [0,1,0,0,0,0|3,0,0]=4 1500 B7R0.10 COC(=O)C(N)C=C Amb24427259 [0,1,0,0,0,0|1,0,2]=4 1501 B7R0.10 COC(=O)C(N)OC Amb24401525 [0,1,0,0,0,0|2,0,1]=4 1502 B7R0.10 COC(=O)C(O)C=C Amb22734006 [0,1,0,0,0,0|1,0,2]=4 1503 B7R0.10 COC(=O)C(O)SC Amb24362213 [0,1,0,0,0,0|2,0,1]=4 1504 B7R0.10 COC(=O)C(OC)O Amb17593224 [0,1,0,0,0,0|2,0,1]=4 1505 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [0,1,0,0,0,0|1,0,1]=3 1506 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [0,1,0,0,0,0|1,0,2]=4 1507 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [0,1,0,0,0,0|1,0,2]=4 1508 B7R0.10 COC(=O)[C@@H](C)NN Amb24117928 [0,1,0,0,0,0|2,0,1]=4 1509 B7R0.10 COC(=O)[C@@H](C)NN Amb24377162 [0,1,0,0,0,0|2,0,1]=4 1510 B7R0.10 COC(=O)[C@@H](N)C=C Amb25127988 [0,1,0,0,0,0|1,0,2]=4 1511 B7R0.10 COC(=O)[C@H](C)CN Amb25317379 [0,1,0,0,0,0|1,0,2]=4 1512 B7R0.10 COC(=O)[C@H](C)NN Amb25115282 [0,1,0,0,0,0|2,0,1]=4 1513 B7R0.10 COC(=O)[C@H](C)ON Amb24439736 [0,1,0,0,0,0|2,0,1]=4 1514 B7R0.10 COC(=O)[C@H](N)C=C Amb24376395 [0,1,0,0,0,0|1,0,2]=4 1515 B7R0.10 COC(=O)\C(=C\Br)\Br Amb16234173 [0,1,0,0,0,0|2,0,0]=3 1516 B7R0.10 COC(=O)\C(\Cl)=N/O Amb24665681 [0,1,0,0,0,0|3,0,0]=4 1517 B7R0.10 COC(=O)\C(\Cl)=N\O Amb22741121 [0,1,0,0,0,0|3,0,0]=4 1518 B7R0.10 COC(=O)\C(\F)=C\Cl Amb25858156 [0,1,0,0,0,0|2,0,0]=3 1519 B7R0.10 COC(=O)\C(\N)=N\O Amb22741276 [0,1,0,0,0,0|3,0,0]=4 1520 B7R0.10 COC(C)C(=C)CO Amb24332119 [0,1,0,0,0,0|2,0,1]=4 1521 B7R0.10 COC(C)C(=O)C=C Amb24483162 [0,1,0,0,0,0|2,0,1]=4 1522 B7R0.10 COC(C)C(=O)CN Amb25678030 [0,1,0,0,0,0|2,0,1]=4 1523 B7R0.10 COC(C)\C(\N)=N\O Amb19650787 [0,1,0,0,0,0|2,0,1]=4 1524 B7R0.10 COC(Cl)C(C)=CCl Amb25779181 [0,1,0,0,0,0|2,0,1]=4 1525 B7R0.10 CON(C)C(=O)CBr Amb20673706 [0,1,0,0,0,0|3,0,0]=4 1526 B7R0.10 CON(C)C(=O)CN Amb18282074 [0,1,0,0,0,0|3,0,0]=4 1527 B7R0.10 CON(C)C(=O)CO Amb24482084 [0,1,0,0,0,0|2,0,0]=3 1528 B7R0.10 CO[C@@H](C)C(N)=NO Amb24681093 [0,1,0,0,0,0|2,0,1]=4 1529 B7R0.10 CSC(C)C(C)=NO Amb24078632 [0,1,0,0,0,0|2,0,1]=4 1530 B7R0.10 CSC(C)C(N)=NO Amb25310726 [0,1,0,0,0,0|2,0,1]=4 1531 B7R0.10 C[C@@H](C(=O)OC)CBr Amb10844721 [0,1,0,0,0,0|1,0,2]=4 1532 B7R0.10 C[C@@H](C(=O)OC)CO Amb17615446 [0,1,0,0,0,0|1,0,2]=4 1533 B7R0.10 C[C@@H](CC)C(=O)CC Amb25735825 [0,1,0,0,0,0|1,0,2]=4 1534 B7R0.10 C[C@@H](NC)C(=O)NC Amb22587544 [0,1,0,0,0,0|2,0,1]=4 1535 B7R0.10 C[C@@H](NC)C(=O)NC Amb23385262 [0,1,0,0,0,0|2,0,1]=4 1536 B7R0.10 C[C@H](C(=O)OC)CO Amb17615445 [0,1,0,0,0,0|1,0,2]=4 1537 B7R0.10 C[C@H](C=O)[C@@H](O)C=O Amb24502787 [0,1,0,0,0,0|1,0,2]=4 1538 B7R0.10 C[C@H](NC)C(=O)NC Amb22587529 [0,1,0,0,0,0|2,0,1]=4 1539 B7R0.10 C[C@H](NC)C(=O)NC Amb23385248 [0,1,0,0,0,0|2,0,1]=4 1540 B7R0.10 C\C(=C/C)\C(=O)NN Amb24351069 [0,1,0,0,0,0|1,0,0]=2 1541 B7R0.10 C\C(=C/Cl)\C(=O)CC Amb25053936 [0,1,0,0,0,0|2,0,0]=3 1542 B7R0.10 C\C(=C/Cl)\C(=O)OC Amb24482370 [0,1,0,0,0,0|1,0,0]=2 1543 B7R0.10 C\C(=C/N)\C(=O)OC Amb25757852 [0,1,0,0,0,0|1,0,0]=2 1544 B7R0.10 C\C(=C/O)\C(=O)CC Amb25371844 [0,1,0,0,0,0|2,0,0]=3 1545 B7R0.10 C\C(=C\C)\C(=O)C#C Amb25318785 [0,1,0,0,0,0|1,0,0]=2 1546 B7R0.10 C\C(=C\C)\C(=O)NN Amb24351818 [0,1,0,0,0,0|1,0,0]=2 1547 B7R0.10 C\C(=C\C)\C(=O)OC Amb19930194 [0,1,0,0,0,0|0,0,0]=1 1548 B7R0.10 C\C(=N/N)\C(=O)NN Amb25276807 [0,1,0,0,0,0|3,0,0]=4 1549 B7R0.10 C\C(=N/N)\C(C)=NO Amb24121510 [0,1,0,0,0,0|3,0,0]=4 1550 B7R0.10 C\C(=N/N)\C(\C)=N\O Amb23453378 [0,1,0,0,0,0|3,0,0]=4 1551 B7R0.10 C\C(=N/O)\C(=O)CCl Amb25112015 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.10 C\C(=N/O)\C(=O)CO Amb24676551 [0,1,0,0,0,0|2,0,0]=3 1553 B7R0.10 C\C(=N/O)\C(\C)=N\[O-] Amb22045510 [0,1,0,0,0,0|3,0,0]=4 1554 B7R0.10 C\C(=N/[O-])\C(\C)=N\O Amb24123061 [0,1,0,0,0,0|3,0,0]=4 1555 B7R0.10 C\C(=N\N)\C(=O)NN Amb24501348 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.10 C\C(=N\O)\C(=O)NN Amb23512421 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.10 C\C(\C#C)=C(/C)\C=O Amb24483033 [0,1,0,0,0,0|1,0,2]=4 1558 B7R0.10 C\C(\C=C)=C(/F)\CCl Amb24481327 [0,1,0,0,0,0|2,0,1]=4 1559 B7R0.10 C\C(\C=C)=C(\C)/CO Amb24474539 [0,1,0,0,0,0|1,0,1]=3 1560 B7R0.10 C\C(\C=O)=C(/Cl)\CC Amb18124369 [0,1,0,0,0,0|2,0,1]=4 1561 B7R0.10 C\C(\C=O)=C(\C)/C=O Amb25758523 [0,1,0,0,0,0|2,0,0]=3 1562 B7R0.10 C\C(\C=O)=C(\Cl)/CC Amb24483064 [0,1,0,0,0,0|2,0,1]=4 1563 B7R0.10 C\C(\CC)=C(/C)\CC Amb24099381 [0,1,0,0,0,0|2,0,1]=4 1564 B7R0.10 C\C(\CC)=C(\C)/CC Amb24561037 [0,1,0,0,0,0|2,0,1]=4 1565 B7R0.10 C\C(\OC)=C(/N)\C#N Amb25824588 [0,1,0,0,0,0|3,0,0]=4 1566 B7R0.10 C\C(\SC)=C(\N)/C#N Amb25131734 [0,1,0,0,0,0|3,0,0]=4 1567 B7R0.10 C\C=C(/Br)\C(=O)C#N Amb25371873 [0,1,0,0,0,0|2,0,0]=3 1568 B7R0.10 C\C=C(/Br)\C(=O)OC Amb22360679 [0,1,0,0,0,0|1,0,0]=2 1569 B7R0.10 C\C=C(/C)\C(O)CN Amb25857910 [0,1,0,0,0,0|1,0,1]=3 1570 B7R0.10 C\C=C(/N)\C(=O)OC Amb25684543 [0,1,0,0,0,0|1,0,0]=2 1571 B7R0.10 C\C=C(\Br)/C(=O)OC Amb24538840 [0,1,0,0,0,0|1,0,0]=2 1572 B7R0.10 C\C=C(\C)/C(Cl)CCl Amb24417161 [0,1,0,0,0,0|2,0,1]=4 1573 B7R0.10 C\C=C(\C)/C(F)CO Amb24748492 [0,1,0,0,0,0|1,0,1]=3 1574 B7R0.10 C\C=C(\C)/C(O)C#C Amb25204306 [0,1,0,0,0,0|1,0,1]=3 1575 B7R0.10 C\C=C(\C)/C(O)C#N Amb25821855 [0,1,0,0,0,0|1,0,1]=3 1576 B7R0.10 C\C=C(\C)/C(O)C=C Amb25847665 [0,1,0,0,0,0|1,0,1]=3 1577 B7R0.10 C\C=C(\C)/C(O)CBr Amb25074031 [0,1,0,0,0,0|1,0,1]=3 1578 B7R0.10 C\C=C(\C)/C(O)CO Amb25284457 [0,1,0,0,0,0|0,0,2]=3 1579 B7R0.10 C\C=C(\C)/[C@@H](O)CO Amb25769225 [0,1,0,0,0,0|0,0,2]=3 1580 B7R0.10 C\C=C(\C)/[C@H](O)C=C Amb25762908 [0,1,0,0,0,0|1,0,1]=3 1581 B7R0.10 C\C=C(\C)/[C@H](O)CO Amb24472342 [0,1,0,0,0,0|0,0,2]=3 1582 B7R0.10 O=C(C=O)\C(\Cl)=C\Cl Amb18124724 [0,1,0,0,0,0|2,0,1]=4 1583 B7R0.10 O=C(CCl)C(Cl)=CCl Amb25258014 [0,1,0,0,0,0|3,0,0]=4 1584 B7R0.10 OC(C=O)=C(Br)C=O Amb24611575 [0,1,0,0,0,0|2,0,0]=3 1585 B7R0.10 O\N=C(\C(=N\O)\C)/N Amb16229981 [0,1,0,0,0,0|3,0,0]=4 1586 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC Amb25175826 [0,1,0,0,0,0|1,0,2]=4 1587 B7R0.13 C=CC(C(=O)C)(C)C Amb17593169 [0,1,0,0,0,0|1,0,2]=4 1588 B7R0.13 CC(=O)C(C)(C)C=O Amb18641788 [0,1,0,0,0,0|2,0,1]=4 1589 B7R0.13 CC(=O)C(C)(O)C=C Amb25798379 [0,1,0,0,0,0|1,0,2]=4 1590 B7R0.13 CC(=O)[C@](C)(O)C=O Amb24481483 [0,1,0,0,0,0|2,0,1]=4 1591 B7R0.13 CC(C(=O)N)(CC)N Amb13952193 [0,1,0,0,0,0|1,0,2]=4 1592 B7R0.13 CC(C(=O)O)(CC)N Amb2235200 [0,1,0,0,0,0|0,0,2]=3 1593 B7R0.13 CC(C)(C=C)C(=O)Cl Amb25300712 [0,1,0,0,0,0|1,0,2]=4 1594 B7R0.13 CC(C)(C=C)P(O)=O Amb24746734 [0,1,0,0,0,0|1,0,2]=4 1595 B7R0.13 CC(C)(C=O)C(O)=O Amb25260968 [0,1,0,0,0,0|1,0,1]=3 1596 B7R0.13 CC(C)(CF)C(O)=O Amb22000679 [0,1,0,0,0,0|1,0,2]=4 1597 B7R0.13 CC(C)(CN)C(O)=O Amb22371031 [0,1,0,0,0,0|1,0,2]=4 1598 B7R0.13 CC(C)(NCl)C(O)=O Amb25698269 [0,1,0,0,0,0|2,0,1]=4 1599 B7R0.13 CC(C)(NO)C(O)=O Amb24407386 [0,1,0,0,0,0|2,0,1]=4 1600 B7R0.13 CC(C)(ON)C(O)=O Amb18641969 [0,1,0,0,0,0|2,0,1]=4 1601 B7R0.13 CC(C)(O[NH3+])C(O)=O Amb22167603 [0,1,0,0,0,0|2,0,1]=4 1602 B7R0.13 CC(Cl)(C#C)C(O)=O Amb25771733 [0,1,0,0,0,0|0,0,3]=4 1603 B7R0.13 CC(F)(CF)C(O)=O Amb24545976 [0,1,0,0,0,0|1,0,2]=4 1604 B7R0.13 CC(N)(C#C)C(O)=O Amb23504061 [0,1,0,0,0,0|0,0,3]=4 1605 B7R0.13 CC(N)(C=C)C(O)=O Amb18641826 [0,1,0,0,0,0|0,0,2]=3 1606 B7R0.13 CC(N)(CN)C(O)=O Amb25310586 [0,1,0,0,0,0|1,0,2]=4 1607 B7R0.13 CC(N)(CS)C(O)=O Amb18124446 [0,1,0,0,0,0|1,0,2]=4 1608 B7R0.13 CC(N)(CS)C(O)=O Amb24480151 [0,1,0,0,0,0|1,0,2]=4 1609 B7R0.13 CC(O)(C#C)C(O)=O Amb25071834 [0,1,0,0,0,0|0,0,3]=4 1610 B7R0.13 CC(O)(CBr)C(O)=O Amb18522184 [0,1,0,0,0,0|1,0,2]=4 1611 B7R0.13 CC(O)(CN)C(O)=O Amb25378699 [0,1,0,0,0,0|1,0,2]=4 1612 B7R0.13 CC(O)(CO)C(O)=O Amb22270195 [0,1,0,0,0,0|1,0,2]=4 1613 B7R0.13 CC(O)(NO)C(O)=O Amb24482657 [0,1,0,0,0,0|2,0,1]=4 1614 B7R0.13 CC(S)(C#N)C(O)=O Amb25134394 [0,1,0,0,0,0|1,0,2]=4 1615 B7R0.13 CCC(C(=O)C)(O)C Amb17593200 [0,1,0,0,0,0|1,0,2]=4 1616 B7R0.13 CCC(C(=O)O)(F)F Amb10982488 [0,1,0,0,0,0|1,0,2]=4 1617 B7R0.13 CCC(C)(Br)C(=O)Br Amb24061144 [0,1,0,0,0,0|1,0,2]=4 1618 B7R0.13 CCC(C)(Br)C(=O)Cl Amb25127778 [0,1,0,0,0,0|1,0,2]=4 1619 B7R0.13 CCC(C)(Br)C(C)=O Amb24570848 [0,1,0,0,0,0|1,0,2]=4 1620 B7R0.13 CCC(C)(Br)C(N)=O Amb25111192 [0,1,0,0,0,0|1,0,2]=4 1621 B7R0.13 CCC(C)(Br)C(O)=O Amb22228657 [0,1,0,0,0,0|0,0,2]=3 1622 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [0,1,0,0,0,0|0,1,2]=4 1623 B7R0.13 CCC(C)(Cl)C(C)=O Amb24434571 [0,1,0,0,0,0|1,0,2]=4 1624 B7R0.13 CCC(C)(Cl)C(O)=O Amb25730682 [0,1,0,0,0,0|0,0,2]=3 1625 B7R0.13 CCC(C)(F)C(O)=O Amb24481385 [0,1,0,0,0,0|0,0,2]=3 1626 B7R0.13 CCC(C)(N)C(C)=O Amb25857157 [0,1,0,0,0,0|1,0,2]=4 1627 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,0,0,0,0|1,0,2]=4 1628 B7R0.13 CCC(C)(N)P(O)=O Amb24505272 [0,1,0,0,0,0|1,0,2]=4 1629 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,0,0,0,0|1,0,2]=4 1630 B7R0.13 CCC(Cl)(Cl)C(O)=O Amb25274946 [0,1,0,0,0,0|1,0,2]=4 1631 B7R0.13 CC[C@@](C)(N)C(O)=O Amb19929605 [0,1,0,0,0,0|0,0,2]=3 1632 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [0,1,0,0,0,0|1,0,2]=4 1633 B7R0.13 CC[C@@](C)(O)C(N)=O Amb24668764 [0,1,0,0,0,0|1,0,2]=4 1634 B7R0.13 CC[C@@](C)(O)C([O-])=O Amb17772231 [0,1,0,0,0,0|0,0,3]=4 1635 B7R0.13 CC[C@](C)(Cl)C(O)=O Amb24402244 [0,1,0,0,0,0|0,0,2]=3 1636 B7R0.13 CNC(C)(C)C(C)=O Amb18641844 [0,1,0,0,0,0|2,0,1]=4 1637 B7R0.13 CNC(C)(C)C(N)=O Amb18950551 [0,1,0,0,0,0|2,0,1]=4 1638 B7R0.13 CNC(C)(F)C(O)=O Amb25225635 [0,1,0,0,0,0|1,0,1]=3 1639 B7R0.13 CN[C@@](C)(F)C(O)=O Amb25697457 [0,1,0,0,0,0|1,0,1]=3 1640 B7R0.13 CN[C@](C)(F)C(O)=O Amb25085415 [0,1,0,0,0,0|1,0,1]=3 1641 B7R0.13 COC(C)(C)C(C)=O Amb22169707 [0,1,0,0,0,0|2,0,1]=4 1642 B7R0.13 COC(C)(N)C(C)=O Amb24608852 [0,1,0,0,0,0|2,0,1]=4 1643 B7R0.13 COC(C)(O)C(C)=O Amb25853230 [0,1,0,0,0,0|2,0,1]=4 1644 B7R0.13 COC(C)(S)C(O)=O Amb25201636 [0,1,0,0,0,0|1,0,1]=3 1645 B7R0.13 CSC(C(=O)O)(C)C Amb17501488 [0,1,0,0,0,0|1,0,1]=3 1646 B7R0.13 CSC(C)(C)C(N)=O Amb25293100 [0,1,0,0,0,0|2,0,1]=4 1647 B7R0.13 CSC(C)(Cl)C(C)=O Amb24481499 [0,1,0,0,0,0|2,0,1]=4 1648 B7R0.13 CSC(F)(F)C(O)=O Amb23586472 [0,1,0,0,0,0|2,0,1]=4 1649 B7R0.13 C[C@@](C(=O)O)(CC)N Amb16183896 [0,1,0,0,0,0|0,0,2]=3 1650 B7R0.13 C[C@@](C(=O)O)(CC)O Amb10067076 [0,1,0,0,0,0|0,0,2]=3 1651 B7R0.13 C[C@@](N)(CF)C(O)=O Amb25169596 [0,1,0,0,0,0|1,0,2]=4 1652 B7R0.13 C[C@@](N)(CS)C(O)=O Amb22757501 [0,1,0,0,0,0|1,0,2]=4 1653 B7R0.13 C[C@@](O)(CN)C(O)=O Amb24698181 [0,1,0,0,0,0|1,0,2]=4 1654 B7R0.13 C[C@](C(=O)O)(CBr)O Amb17610012 [0,1,0,0,0,0|1,0,2]=4 1655 B7R0.13 C[C@](C(=O)O)(CC)O Amb10067075 [0,1,0,0,0,0|0,0,2]=3 1656 B7R0.13 C[C@](C(=O)O)(CS)N Amb16183893 [0,1,0,0,0,0|1,0,2]=4 1657 B7R0.13 C[C@](F)(CN)C(O)=O Amb25110675 [0,1,0,0,0,0|1,0,2]=4 1658 B7R0.13 C[C@](N)(C#C)C(O)=O Amb24406693 [0,1,0,0,0,0|0,0,3]=4 1659 B7R0.13 C[C@](N)(C=C)C(O)=O Amb24481465 [0,1,0,0,0,0|0,0,2]=3 1660 B7R0.13 C[C@](N)(CF)C(O)=O Amb25775618 [0,1,0,0,0,0|1,0,2]=4 1661 B7R0.13 C[C@](N)(CN)C(O)=O Amb25690446 [0,1,0,0,0,0|1,0,2]=4 1662 B7R0.13 C[C@](N)(CS)C(O)=O Amb22388665 [0,1,0,0,0,0|1,0,2]=4 1663 B7R0.13 C[C@](N)(CS)C(O)=O Amb24053489 [0,1,0,0,0,0|1,0,2]=4 1664 B7R0.13 C[C@](O)(C=C)C(O)=O Amb24556886 [0,1,0,0,0,0|0,0,2]=3 1665 B7R0.13 C[C@](O)(CBr)C(O)=O Amb22224875 [0,1,0,0,0,0|1,0,2]=4 1666 B7R0.13 C[C@](O)(CO)C(O)=O Amb25173833 [0,1,0,0,0,0|1,0,2]=4 1667 B7R0.13 C[C@](O)(NO)C(O)=O Amb24412529 [0,1,0,0,0,0|2,0,1]=4 1668 B7R0.13 [C-]#[N+]C(C)(C)C(O)=O Amb24481414 [0,1,0,0,0,0|1,0,2]=4 1669 B7R0.14 CC(=CCl)S(C)(=O)=O Amb24511788 [0,1,0,0,0,0|2,0,1]=4 1670 B7R0.14 CC(C=O)P(O)(O)=O Amb24481584 [0,1,0,0,0,0|2,0,1]=4 1671 B7R0.14 CC=C(C)[B-](F)(F)F Amb22735434 [0,1,0,0,0,0|3,0,0]=4 1672 B7R0.14 CCC(=C)P(O)(O)=O Amb22831916 [0,1,0,0,0,0|1,0,2]=4 1673 B7R0.14 CCC(C)S(O)(=O)=O Amb22372234 [0,1,0,0,0,0|1,0,2]=4 1674 B7R0.14 CCC(P(=O)(O)O)C Amb10560197 [0,1,0,0,0,0|1,0,2]=4 1675 B7R0.14 CNC(=N)S(O)(=O)=O Amb25173828 [0,1,0,0,0,0|3,0,0]=4 1676 B7R0.14 CNC(=O)P(O)(O)=O Amb24715894 [0,1,0,0,0,0|3,0,0]=4 1677 B7R0.14 CNC(=S)S(O)(=O)=O Amb24711518 [0,1,0,0,0,0|3,0,0]=4 1678 B7R0.14 CNC(C)P(O)(O)=O Amb25223984 [0,1,0,0,0,0|2,0,1]=4 1679 B7R0.14 COC(=O)P(O)(O)=O Amb22388745 [0,1,0,0,0,0|3,0,0]=4 1680 B7R0.14 C\C=C(\C)/C(C)(C)C Amb22734766 [0,1,0,0,0,0|2,0,1]=4 1681 B7R0.14 C\C=C(\C)/S(=O)(=O)Cl Amb25337988 [0,1,0,0,0,0|1,0,1]=3 1682 B7R0.14 C\C=C(\C)/S(O)(=O)=O Amb25302225 [0,1,0,0,0,0|1,0,0]=2 1683 B7R0.15 C=CC(C#C)C(O)=O Amb24562856 [0,1,0,0,0,0|0,0,3]=4 1684 B7R0.15 C=CC(C=O)C(O)=O Amb25042871 [0,1,0,0,0,0|0,0,3]=4 1685 B7R0.15 C=N\C(=C\N)\C(N)=O Amb24534094 [0,1,0,0,0,0|2,0,1]=4 1686 B7R0.15 CC(=C)\C(\CC)=C\C Amb25228270 [0,1,0,0,0,0|2,0,0]=3 1687 B7R0.15 CC(=O)C(=CN)C#N Amb25757496 [0,1,0,0,0,0|2,0,1]=4 1688 B7R0.15 CC(=O)C(=CO)OC Amb24631186 [0,1,0,0,0,0|2,0,0]=3 1689 B7R0.15 CC(=O)C(=CO)SC Amb24518437 [0,1,0,0,0,0|2,0,0]=3 1690 B7R0.15 CC(=O)C(CBr)C=O Amb24483303 [0,1,0,0,0,0|2,0,1]=4 1691 B7R0.15 CC(=O)C(CC)=NC Amb24518359 [0,1,0,0,0,0|1,0,1]=3 1692 B7R0.15 CC(=O)C(CC)=NN Amb25373336 [0,1,0,0,0,0|2,0,1]=4 1693 B7R0.15 CC(=O)\C(=C/C)\OC Amb25086645 [0,1,0,0,0,0|1,0,0]=2 1694 B7R0.15 CC(=O)\C(=C/O)\C#N Amb24068325 [0,1,0,0,0,0|2,0,1]=4 1695 B7R0.15 CC(=O)\C(=C/O)\OC Amb25065808 [0,1,0,0,0,0|2,0,0]=3 1696 B7R0.15 CC(=O)\C(=C\N)\C#N Amb25094377 [0,1,0,0,0,0|2,0,1]=4 1697 B7R0.15 CC(=O)\C(=N/O)\SC Amb24434618 [0,1,0,0,0,0|3,0,0]=4 1698 B7R0.15 CC(=O)\C(\CC)=C/C Amb24481481 [0,1,0,0,0,0|1,0,0]=2 1699 B7R0.15 CC(=O)\C(\CC)=N\C Amb24524263 [0,1,0,0,0,0|1,0,1]=3 1700 B7R0.15 CC(C)=C(CBr)C=C Amb25360950 [0,1,0,0,0,0|2,0,1]=4 1701 B7R0.15 CC(C)=C(CO)CC Amb25781813 [0,1,0,0,0,0|2,0,1]=4 1702 B7R0.15 CC(O)=C(CO)NC Amb25210013 [0,1,0,0,0,0|2,0,0]=3 1703 B7R0.15 CC(O)=C(NC)NC Amb25348418 [0,1,0,0,0,0|2,0,0]=3 1704 B7R0.15 CC=C(OC)C(N)=O Amb24612424 [0,1,0,0,0,0|1,0,0]=2 1705 B7R0.15 CC=C(OC)C(O)=O Amb25793698 [0,1,0,0,0,0|0,0,0]=1 1706 B7R0.15 CC=C(SC)N(C)C Amb24564706 [0,1,0,0,0,0|3,0,0]=4 1707 B7R0.15 CCC(=C=C)C(O)=O Amb25246162 [0,1,0,0,0,0|0,0,2]=3 1708 B7R0.15 CCC(=CC)C(C)C Amb25349447 [0,1,0,0,0,0|2,0,1]=4 1709 B7R0.15 CCC(=CC)C(C)Cl Amb24652557 [0,1,0,0,0,0|2,0,1]=4 1710 B7R0.15 CCC(=CC)C(N)=O Amb25367251 [0,1,0,0,0,0|1,0,0]=2 1711 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [0,1,0,0,0,0|0,0,0]=1 1712 B7R0.15 CCC(=CC)[N+]([O-])=O Amb25338404 [0,1,0,0,0,0|1,0,1]=3 1713 B7R0.15 CCC(=NO)C(N)=O Amb25174963 [0,1,0,0,0,0|2,0,1]=4 1714 B7R0.15 CCC(=S=S)C(N)=O Amb25731576 [0,1,0,0,0,0|2,0,1]=4 1715 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [0,1,0,0,0,0|0,0,3]=4 1716 B7R0.15 CCC(C(=O)N)NC Amb15701261 [0,1,0,0,0,0|1,0,2]=4 1717 B7R0.15 CCC(C(=O)N)OC Amb2027289 [0,1,0,0,0,0|1,0,2]=4 1718 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [0,1,0,0,0,0|0,0,3]=4 1719 B7R0.15 CCC(C(=O)O)NC Amb10610245 [0,1,0,0,0,0|0,0,2]=3 1720 B7R0.15 CCC(C(=O)O)SC Amb17501348 [0,1,0,0,0,0|0,0,2]=3 1721 B7R0.15 CCC(C(=O)[O-])CCl Amb10604125 [0,1,0,0,0,0|0,0,3]=4 1722 B7R0.15 CCC(C=O)=C(Cl)Cl Amb25770066 [0,1,0,0,0,0|3,0,0]=4 1723 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [0,1,0,0,0,0|0,0,2]=3 1724 B7R0.15 CCC(CC)C(=O)Br Amb25280424 [0,1,0,0,0,0|1,0,2]=4 1725 B7R0.15 CCC(CC)C([O-])=O Amb22585838 [0,1,0,0,0,0|0,0,3]=4 1726 B7R0.15 CCC(CCl)=C(Cl)Cl Amb25701732 [0,1,0,0,0,0|2,0,1]=4 1727 B7R0.15 CCC(CN)C(C)=O Amb24548156 [0,1,0,0,0,0|1,0,2]=4 1728 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,0,0,0,0|1,0,2]=4 1729 B7R0.15 CCC(CN)C(O)=O Amb18987934 [0,1,0,0,0,0|0,0,2]=3 1730 B7R0.15 CCC(CN)C(O)=O Amb19514932 [0,1,0,0,0,0|0,0,2]=3 1731 B7R0.15 CCC(CO)C(C)=O Amb24709237 [0,1,0,0,0,0|1,0,2]=4 1732 B7R0.15 CCC(CO)C(O)=O Amb18641947 [0,1,0,0,0,0|0,0,2]=3 1733 B7R0.15 CCC(CS)C(O)=O Amb24435402 [0,1,0,0,0,0|0,0,2]=3 1734 B7R0.15 CCC(NN)C(O)=O Amb18641955 [0,1,0,0,0,0|1,0,2]=4 1735 B7R0.15 CCC(ON)C(O)=O Amb25697895 [0,1,0,0,0,0|1,0,2]=4 1736 B7R0.15 CCN(C(=O)N)CC Amb1128168 [0,1,0,0,0,0|2,0,1]=4 1737 B7R0.15 CCN(C=C)C(C)=O Amb25145259 [0,1,0,0,0,0|2,0,1]=4 1738 B7R0.15 CCN(CC)C(O)=S Amb24698748 [0,1,0,0,0,0|1,1,1]=4 1739 B7R0.15 CCN(CC)P(O)=O Amb24550706 [0,1,0,0,0,0|2,0,1]=4 1740 B7R0.15 CCN(CCl)C(=O)Cl Amb24680857 [0,1,0,0,0,0|2,0,1]=4 1741 B7R0.15 CCN(OC)C(N)=O Amb24417375 [0,1,0,0,0,0|2,0,1]=4 1742 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [0,1,0,0,0,0|0,0,2]=3 1743 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [0,1,0,0,0,0|0,0,2]=3 1744 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [0,1,0,0,0,0|0,0,2]=3 1745 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [0,1,0,0,0,0|1,0,2]=4 1746 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [0,1,0,0,0,0|0,0,2]=3 1747 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [0,1,0,0,0,0|0,0,2]=3 1748 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [0,1,0,0,0,0|0,0,2]=3 1749 B7R0.15 CC[C@H](NC)C(N)=O Amb25745002 [0,1,0,0,0,0|1,0,2]=4 1750 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [0,1,0,0,0,0|0,0,2]=3 1751 B7R0.15 CC\C(=C/C)\C(C)C Amb24581918 [0,1,0,0,0,0|2,0,1]=4 1752 B7R0.15 CC\C(=C/C)\C(C)Cl Amb24740385 [0,1,0,0,0,0|2,0,1]=4 1753 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [0,1,0,0,0,0|0,0,0]=1 1754 B7R0.15 CC\C(=C/C)\[N+]([O-])=O Amb24761528 [0,1,0,0,0,0|1,0,1]=3 1755 B7R0.15 CC\C(=N/O)\C(O)=O Amb25378085 [0,1,0,0,0,0|1,0,1]=3 1756 B7R0.15 CNC(=NC)S(=O)=O Amb25842815 [0,1,0,0,0,0|2,0,1]=4 1757 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [0,1,0,0,0,0|0,0,2]=3 1758 B7R0.15 CNC(CF)C(O)=O Amb25695388 [0,1,0,0,0,0|1,0,1]=3 1759 B7R0.15 CNC(CN)C(O)=O Amb23515020 [0,1,0,0,0,0|1,0,1]=3 1760 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,0,0,0,0|2,0,1]=4 1761 B7R0.15 CNC(NC)=S(=O)=O Amb25338130 [0,1,0,0,0,0|2,0,1]=4 1762 B7R0.15 CNC(SC)C(O)=O Amb25745282 [0,1,0,0,0,0|1,0,1]=3 1763 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [0,1,0,0,0,0|1,0,1]=3 1764 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [0,1,0,0,0,0|1,0,1]=3 1765 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [0,1,0,0,0,0|2,0,1]=4 1766 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [0,1,0,0,0,0|1,0,1]=3 1767 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [0,1,0,0,0,0|1,0,1]=3 1768 B7R0.15 COC(=CO)C(O)=O Amb25730461 [0,1,0,0,0,0|1,0,0]=2 1769 B7R0.15 COC(C=C)C(O)=O Amb18641874 [0,1,0,0,0,0|0,0,2]=3 1770 B7R0.15 COC(CBr)C(C)=O Amb24737219 [0,1,0,0,0,0|2,0,1]=4 1771 B7R0.15 COC(CBr)C(N)=O Amb24563790 [0,1,0,0,0,0|2,0,1]=4 1772 B7R0.15 COC(CCl)C(O)=O Amb18643355 [0,1,0,0,0,0|1,0,1]=3 1773 B7R0.15 COC(CN)C(N)=O Amb24719552 [0,1,0,0,0,0|2,0,1]=4 1774 B7R0.15 COC(CN)C(O)=O Amb22059584 [0,1,0,0,0,0|1,0,1]=3 1775 B7R0.15 COC(CN)C(O)=O Amb24271092 [0,1,0,0,0,0|1,0,1]=3 1776 B7R0.15 COC(CO)C(O)=O Amb24482992 [0,1,0,0,0,0|1,0,1]=3 1777 B7R0.15 COC(CS)C(O)=O Amb25305649 [0,1,0,0,0,0|1,0,1]=3 1778 B7R0.15 CON(SC)C(N)=O Amb25662973 [0,1,0,0,0,0|3,0,0]=4 1779 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [0,1,0,0,0,0|2,0,1]=4 1780 B7R0.15 CO\C(=C/Br)\C(O)=O Amb25189037 [0,1,0,0,0,0|1,0,0]=2 1781 B7R0.15 CSC(=NO)C(N)=O Amb24671298 [0,1,0,0,0,0|3,0,0]=4 1782 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [0,1,0,0,0,0|1,0,1]=3 1783 B7R0.15 CSC(CO)C(C)=O Amb25746293 [0,1,0,0,0,0|2,0,1]=4 1784 B7R0.15 CSC(CO)C(N)=O Amb25849170 [0,1,0,0,0,0|2,0,1]=4 1785 B7R0.15 CSC(SC)C(N)=O Amb25233004 [0,1,0,0,0,0|2,0,1]=4 1786 B7R0.15 C\C(\Cl)=C(/CC)\C=O Amb24481513 [0,1,0,0,0,0|3,0,0]=4 1787 B7R0.15 C\C(\Cl)=C(\CC)/C=O Amb24679611 [0,1,0,0,0,0|3,0,0]=4 1788 B7R0.15 C\C(\O)=C(\CO)/NC Amb25759923 [0,1,0,0,0,0|2,0,0]=3 1789 B7R0.15 C\C=C(/CBr)\C(=O)Cl Amb24433436 [0,1,0,0,0,0|1,0,0]=2 1790 B7R0.15 C\C=C(/CBr)\C(O)=O Amb18128301 [0,1,0,0,0,0|0,0,0]=1 1791 B7R0.15 C\C=C(/OC)\C(N)=O Amb24681019 [0,1,0,0,0,0|1,0,0]=2 1792 B7R0.15 C\C=C(/OC)\C(O)=O Amb18124260 [0,1,0,0,0,0|0,0,0]=1 1793 B7R0.15 C\C=C(\C#N)/C(C)O Amb24747211 [0,1,0,0,0,0|1,0,2]=4 1794 B7R0.15 C\C=C(\C#N)/C(O)=O Amb25703574 [0,1,0,0,0,0|0,0,1]=2 1795 B7R0.15 C\C=C(\C=C)/C(N)=O Amb25276462 [0,1,0,0,0,0|1,0,1]=3 1796 B7R0.15 C\C=C(\CBr)/C(O)=O Amb24606924 [0,1,0,0,0,0|0,0,0]=1 1797 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [0,1,0,0,0,0|0,0,0]=1 1798 B7R0.15 C\C=C(\CO)/[C@H](C)O Amb25220995 [0,1,0,0,0,0|1,0,1]=3 1799 B7R0.15 C\C=C(\OC)/N(C)C Amb25132691 [0,1,0,0,0,0|3,0,0]=4 1800 B7R0.15 NCC(C(=O)O)C#N Amb10842157 [0,1,0,0,0,0|1,0,2]=4 1801 B7R0.15 NCC(CN)C(O)=O Amb25335570 [0,1,0,0,0,0|1,0,2]=4 1802 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [0,1,0,0,0,0|1,0,2]=4 1803 B7R0.15 NNC(CS)C(O)=O Amb24117863 [0,1,0,0,0,0|2,0,1]=4 1804 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [0,1,0,0,0,0|2,0,1]=4 1805 B7R0.15 NN\C(=N/N)\C(O)=O Amb24377685 [0,1,0,0,0,0|3,0,0]=4 1806 B7R0.15 N\C=C(\C(=O)N)/C#N Amb17593144 [0,1,0,0,0,0|2,0,1]=4 1807 B7R0.15 OC(=O)C(CBr)=NO Amb24621133 [0,1,0,0,0,0|2,0,0]=3 1808 B7R0.15 OC(=O)C(CI)CI Amb17779784 [0,1,0,0,0,0|1,0,2]=4 1809 B7R0.15 OC(=O)C(CO)CO Amb18124271 [0,1,0,0,0,0|1,0,2]=4 1810 B7R0.15 OC(=O)C(CS)=NO Amb24685236 [0,1,0,0,0,0|2,0,0]=3 1811 B7R0.15 OC(=O)C(CS)NS Amb25286626 [0,1,0,0,0,0|2,0,1]=4 1812 B7R0.15 OC(=O)\C(\CS)=N\O Amb24551064 [0,1,0,0,0,0|2,0,0]=3 1813 B7R0.15 OCC(NO)C(O)=O Amb24719766 [0,1,0,0,0,0|2,0,1]=4 1814 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [0,1,0,0,0,0|0,0,3]=4 1815 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,1,0,0,0,0|2,0,1]=4 1816 B7R0.16 C(=C(C(=O)N)[2H])([2H])[2H] Amb17607704 [0,1,0,0,0,0|3,0,0]=4 1817 B7R0.16 C(=C(C(=O)[2H])[2H])([2H])[2H] Amb17607703 [0,1,0,0,0,0|3,0,0]=4 1818 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,1,0,0,0,0|1,0,2]=4 1819 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,1,0,0,0,0|1,0,2]=4 1820 B7R0.16 C=C(C(F)F)C(O)=O Amb24117234 [0,1,0,0,0,0|1,0,2]=4 1821 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,1,0,0,0,0|1,0,1]=3 1822 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,1,0,0,0,0|1,0,2]=4 1823 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,1,0,0,0,0|1,0,2]=4 1824 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,1,0,0,0,0|1,0,0]=2 1825 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,1,0,0,0,0|0,0,0]=1 1826 B7R0.16 CC(=C(C)C)C(=O)C Amb17593162 [0,1,0,0,0,0|1,0,0]=2 1827 B7R0.16 CC(=C(C)N)C(C)=O Amb25232464 [0,1,0,0,0,0|1,0,0]=2 1828 B7R0.16 CC(=C(N)N)C(C)=O Amb25168636 [0,1,0,0,0,0|2,0,0]=3 1829 B7R0.16 CC(=C(N)O)C(C)=O Amb24741192 [0,1,0,0,0,0|1,0,0]=2 1830 B7R0.16 CC(=C)C(=C)C(C)=O Amb24481403 [0,1,0,0,0,0|1,0,1]=3 1831 B7R0.16 CC(=C)C(=C)C(N)=O Amb25857156 [0,1,0,0,0,0|1,0,1]=3 1832 B7R0.16 CC(=C)C(=O)C(C)=C Amb24645453 [0,1,0,0,0,0|3,0,0]=4 1833 B7R0.16 CC(=C)C(=O)C(C)O Amb25245802 [0,1,0,0,0,0|2,0,1]=4 1834 B7R0.16 CC(=C)C(=O)[C@@H](C)O Amb24434621 [0,1,0,0,0,0|2,0,1]=4 1835 B7R0.16 CC(=C)C(=O)[C@H](C)O Amb25064672 [0,1,0,0,0,0|2,0,1]=4 1836 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,1,0,0,0,0|0,0,1]=2 1837 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,1,0,0,0,0|1,0,1]=3 1838 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,1,0,0,0,0|0,0,1]=2 1839 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,1,0,0,0,0|2,0,1]=4 1840 B7R0.16 CC(=N)C(=N)C(N)=O Amb24357519 [0,1,0,0,0,0|2,0,0]=3 1841 B7R0.16 CC(=N)C(C)C(N)=S Amb25326603 [0,1,0,0,0,0|1,1,1]=4 1842 B7R0.16 CC(=O)C(=C)C(C)C Amb25713676 [0,1,0,0,0,0|1,0,2]=4 1843 B7R0.16 CC(=O)C(=C)N(C)C Amb24363792 [0,1,0,0,0,0|2,0,1]=4 1844 B7R0.16 CC(=O)C(=C)S(C)=O Amb25853035 [0,1,0,0,0,0|2,0,1]=4 1845 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,1,0,0,0,0|2,0,1]=4 1846 B7R0.16 CC(=O)C(=O)C(C)Cl Amb24483301 [0,1,0,0,0,0|2,0,1]=4 1847 B7R0.16 CC(=O)C(=O)C(C)O Amb25173440 [0,1,0,0,0,0|2,0,1]=4 1848 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,1,0,0,0,0|1,0,0]=2 1849 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,1,0,0,0,0|2,0,0]=3 1850 B7R0.16 CC(=O)C(Br)C(C)=C Amb24533829 [0,1,0,0,0,0|2,0,1]=4 1851 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,0,0|2,0,1]=4 1852 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,1,0,0,0,0|2,0,1]=4 1853 B7R0.16 CC(=O)C(C)C(=O)S Amb25094430 [0,1,0,0,0,0|0,1,1]=3 1854 B7R0.16 CC(=O)C(C)C(=S)Cl Amb24432212 [0,1,0,0,0,0|1,1,1]=4 1855 B7R0.16 CC(=O)C(C)C(N)=N Amb24629832 [0,1,0,0,0,0|2,0,1]=4 1856 B7R0.16 CC(=O)C(Cl)=C(C)N Amb24564321 [0,1,0,0,0,0|2,0,0]=3 1857 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,1,0,0,0,0|2,0,1]=4 1858 B7R0.16 CC(=O)C(F)=C(F)F Amb25116561 [0,1,0,0,0,0|3,0,0]=4 1859 B7R0.16 CC(=O)C(F)C(C)=O Amb19889779 [0,1,0,0,0,0|2,0,1]=4 1860 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,1,0,0,0,0|1,0,1]=3 1861 B7R0.16 CC(=O)C(O)C(C)=C Amb24614054 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.16 CC(=O)C(S)=C(C)O Amb25327947 [0,1,0,0,0,0|2,0,0]=3 1863 B7R0.16 CC(=O)N(C)C(N)=O Amb24621834 [0,1,0,0,0,0|2,0,0]=3 1864 B7R0.16 CC(=O)N(C)C(N)=S Amb25337074 [0,1,0,0,0,0|2,1,0]=4 1865 B7R0.16 CC(=O)N(Cl)C(N)=O Amb24481411 [0,1,0,0,0,0|3,0,0]=4 1866 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,1,0,0,0,0|3,0,0]=4 1867 B7R0.16 CC(=O)\C(\Br)=C(\C)/N Amb25310939 [0,1,0,0,0,0|2,0,0]=3 1868 B7R0.16 CC(=O)\C(\Cl)=C(\C)/N Amb24581140 [0,1,0,0,0,0|2,0,0]=3 1869 B7R0.16 CC(=O)\C(\F)=C(\C)/O Amb24571214 [0,1,0,0,0,0|2,0,0]=3 1870 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,1,0,0,0,0|1,0,1]=3 1871 B7R0.16 CC(Br)C(=O)C([O-])=O Amb19516024 [0,1,0,0,0,0|1,0,2]=4 1872 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,1,0,0,0,0|1,0,2]=4 1873 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,1,0,0,0,0|0,0,2]=3 1874 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,1,0,0,0,0|0,0,2]=3 1875 B7R0.16 CC(C(=O)C)C(=O)C Amb1152249 [0,1,0,0,0,0|1,0,1]=3 1876 B7R0.16 CC(C(=O)Cl)C(=O)Cl Amb22232260 [0,1,0,0,0,0|2,0,1]=4 1877 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,1,0,0,0,0|1,0,1]=3 1878 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,1,0,0,0,0|0,0,1]=2 1879 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,1,0,0,0,0|0,0,2]=3 1880 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,1,0,0,0,0|1,0,2]=4 1881 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,1,0,0,0,0|1,0,2]=4 1882 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,1,0,0,0,0|0,0,2]=3 1883 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,1,0,0,0,0|1,0,2]=4 1884 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,1,0,0,0,0|1,0,2]=4 1885 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,1,0,0,0,0|1,0,2]=4 1886 B7R0.16 CC(C(C)=O)=C(C)Cl Amb25326830 [0,1,0,0,0,0|1,0,0]=2 1887 B7R0.16 CC(C(C)=O)=C(C)F Amb25233562 [0,1,0,0,0,0|1,0,0]=2 1888 B7R0.16 CC(C(C)=O)=S(C)C Amb25833593 [0,1,0,0,0,0|2,0,0]=3 1889 B7R0.16 CC(C(C)=O)S(C)=O Amb24481498 [0,1,0,0,0,0|2,0,1]=4 1890 B7R0.16 CC(C(C)=O)[N+]([O-])=O Amb24559893 [0,1,0,0,0,0|1,0,2]=4 1891 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,1,0,0,0,0|0,0,2]=3 1892 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,1,0,0,0,0|1,0,2]=4 1893 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,1,0,0,0,0|1,0,2]=4 1894 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,1,0,0,0,0|0,0,2]=3 1895 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,1,0,0,0,0|1,0,2]=4 1896 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,1,0,0,0,0|0,0,2]=3 1897 B7R0.16 CC(C(N)=O)=C(C)Cl Amb24517373 [0,1,0,0,0,0|1,0,0]=2 1898 B7R0.16 CC(C(N)=O)C(N)=S Amb22229181 [0,1,0,0,0,0|2,0,1]=4 1899 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,1,0,0,0,0|2,0,1]=4 1900 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,1,0,0,0,0|1,0,1]=3 1901 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,1,0,0,0,0|0,0,0]=1 1902 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,1,0,0,0,0|0,0,0]=1 1903 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,1,0,0,0,0|0,0,0]=1 1904 B7R0.16 CC(C(O)=O)=C(Cl)Cl Amb24373832 [0,1,0,0,0,0|1,0,0]=2 1905 B7R0.16 CC(C(O)=O)=C(F)F Amb24702881 [0,1,0,0,0,0|1,0,0]=2 1906 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,1,0,0,0,0|1,0,1]=3 1907 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,1,0,0,0,0|1,0,1]=3 1908 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,1,0,0,0,0|1,0,1]=3 1909 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,1,0,0,0,0|1,0,1]=3 1910 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,1,0,0,0,0|1,0,1]=3 1911 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,1,0,0,0,0|2,0,1]=4 1912 B7R0.16 CC(C)=C(Br)C(C)=O Amb25792957 [0,1,0,0,0,0|2,0,0]=3 1913 B7R0.16 CC(C)=C(C)B(O)O Amb21963206 [0,1,0,0,0,0|1,0,1]=3 1914 B7R0.16 CC(C)=C(C)C(C)C Amb22347879 [0,1,0,0,0,0|2,0,1]=4 1915 B7R0.16 CC(C)=C(C)C(C)Cl Amb24536548 [0,1,0,0,0,0|2,0,1]=4 1916 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,1,0,0,0,0|1,0,0]=2 1917 B7R0.16 CC(C)=C(F)C(C)O Amb25220424 [0,1,0,0,0,0|2,0,1]=4 1918 B7R0.16 CC(C)=C(F)C(N)=O Amb25075288 [0,1,0,0,0,0|2,0,0]=3 1919 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,1,0,0,0,0|1,0,0]=2 1920 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,1,0,0,0,0|1,0,0]=2 1921 B7R0.16 CC(C)C(=C)C(N)=O Amb24709685 [0,1,0,0,0,0|1,0,2]=4 1922 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,1,0,0,0,0|1,0,1]=3 1923 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,1,0,0,0,0|1,0,2]=4 1924 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,1,0,0,0,0|1,0,2]=4 1925 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,1,0,0,0,0|1,0,2]=4 1926 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,1,0,0,0,0|1,0,2]=4 1927 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,1,0,0,0,0|1,0,2]=4 1928 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,1,0,0,0,0|1,0,2]=4 1929 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,0,0|2,0,1]=4 1930 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,1,0,0,0,0|1,0,2]=4 1931 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,1,0,0,0,0|1,0,2]=4 1932 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,1,0,0,0,0|1,0,2]=4 1933 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,1,0,0,0,0|1,0,2]=4 1934 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,1,0,0,0,0|1,0,2]=4 1935 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,1,0,0,0,0|1,0,2]=4 1936 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,1,0,0,0,0|1,0,2]=4 1937 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,1,0,0,0,0|1,0,2]=4 1938 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,1,0,0,0,0|1,0,2]=4 1939 B7R0.16 CC(Cl)=C(C)C(Cl)Cl Amb24421094 [0,1,0,0,0,0|2,0,1]=4 1940 B7R0.16 CC(Cl)=C(Cl)C(O)=O Amb25272743 [0,1,0,0,0,0|1,0,0]=2 1941 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,1,0,0,0,0|0,0,2]=3 1942 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,1,0,0,0,0|1,0,2]=4 1943 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,1,0,0,0,0|1,0,2]=4 1944 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,1,0,0,0,0|1,0,2]=4 1945 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,1,0,0,0,0|1,0,2]=4 1946 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,1,0,0,0,0|1,0,2]=4 1947 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,1,0,0,0,0|1,0,2]=4 1948 B7R0.16 CC(N(C(=O)N)C)C Amb1132046 [0,1,0,0,0,0|2,0,1]=4 1949 B7R0.16 CC(N)=C(C)C(N)=O Amb24568296 [0,1,0,0,0,0|1,0,0]=2 1950 B7R0.16 CC(N)=C(Cl)C(N)=O Amb24760958 [0,1,0,0,0,0|2,0,0]=3 1951 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,1,0,0,0,0|1,0,2]=4 1952 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,1,0,0,0,0|1,0,2]=4 1953 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,1,0,0,0,0|1,0,2]=4 1954 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,1,0,0,0,0|1,0,2]=4 1955 B7R0.16 CC(O)=C(O)C(C)O Amb25227909 [0,1,0,0,0,0|2,0,1]=4 1956 B7R0.16 CC(O)C(=C)C(N)=O Amb24694487 [0,1,0,0,0,0|1,0,2]=4 1957 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,1,0,0,0,0|1,0,1]=3 1958 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,1,0,0,0,0|1,0,2]=4 1959 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,1,0,0,0,0|1,0,1]=3 1960 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,1,0,0,0,0|0,0,2]=3 1961 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,1,0,0,0,0|1,0,2]=4 1962 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,1,0,0,0,0|1,0,2]=4 1963 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,1,0,0,0,0|0,0,2]=3 1964 B7R0.16 CN(C(=O)C(=O)C)C Amb17399799 [0,1,0,0,0,0|3,0,0]=4 1965 B7R0.16 CN(C(N)=N)C(N)=O Amb25836892 [0,1,0,0,0,0|3,0,0]=4 1966 B7R0.16 CN(C(N)=O)C(N)=S Amb24383546 [0,1,0,0,0,0|3,0,0]=4 1967 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [0,1,0,0,0,0|2,0,0]=3 1968 B7R0.16 CN(C)C(=O)C(N)=O Amb24652690 [0,1,0,0,0,0|3,0,0]=4 1969 B7R0.16 CN(C)C(=S)C(N)=O Amb24101259 [0,1,0,0,0,0|3,0,0]=4 1970 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [0,1,0,0,0,0|2,0,0]=3 1971 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,1,0,0,0,0|2,0,1]=4 1972 B7R0.16 CN(C)N(C)C(N)=O Amb25061983 [0,1,0,0,0,0|3,0,0]=4 1973 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,1,0,0,0,0|0,0,2]=3 1974 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,1,0,0,0,0|2,0,1]=4 1975 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,1,0,0,0,0|1,0,1]=3 1976 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,1,0,0,0,0|1,0,1]=3 1977 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,1,0,0,0,0|1,0,2]=4 1978 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,1,0,0,0,0|1,0,2]=4 1979 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,1,0,0,0,0|1,0,2]=4 1980 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,1,0,0,0,0|1,0,2]=4 1981 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,1,0,0,0,0|1,0,2]=4 1982 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,1,0,0,0,0|1,0,2]=4 1983 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,1,0,0,0,0|0,0,2]=3 1984 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,1,0,0,0,0|1,0,2]=4 1985 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,1,0,0,0,0|0,0,2]=3 1986 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,1,0,0,0,0|1,0,2]=4 1987 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,1,0,0,0,0|1,0,2]=4 1988 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,1,0,0,0,0|1,0,2]=4 1989 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,1,0,0,0,0|1,0,2]=4 1990 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,1,0,0,0,0|1,0,2]=4 1991 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,1,0,0,0,0|1,0,2]=4 1992 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,1,0,0,0,0|0,0,2]=3 1993 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,1,0,0,0,0|0,0,2]=3 1994 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,1,0,0,0,0|1,0,2]=4 1995 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,1,0,0,0,0|1,0,2]=4 1996 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,1,0,0,0,0|0,0,2]=3 1997 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,1,0,0,0,0|2,0,1]=4 1998 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,1,0,0,0,0|1,0,1]=3 1999 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,1,0,0,0,0|1,0,2]=4 2000 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,1,0,0,0,0|0,0,2]=3 2001 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,1,0,0,0,0|1,0,2]=4 2002 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,1,0,0,0,0|1,0,2]=4 2003 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,1,0,0,0,0|1,0,2]=4 2004 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,1,0,0,0,0|1,0,2]=4 2005 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,1,0,0,0,0|1,0,2]=4 2006 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,1,0,0,0,0|1,0,2]=4 2007 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,1,0,0,0,0|1,0,2]=4 2008 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,1,0,0,0,0|1,0,2]=4 2009 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,1,0,0,0,0|1,0,2]=4 2010 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,1,0,0,0,0|0,0,2]=3 2011 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,1,0,0,0,0|1,0,2]=4 2012 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,1,0,0,0,0|0,0,2]=3 2013 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,1,0,0,0,0|1,0,2]=4 2014 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,1,0,0,0,0|1,0,2]=4 2015 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,1,0,0,0,0|0,0,2]=3 2016 B7R0.16 C\C(=C(\C)/N)\C(C)=O Amb24332752 [0,1,0,0,0,0|1,0,0]=2 2017 B7R0.16 C\C(\C(C)=O)=C(/C)\Cl Amb24722797 [0,1,0,0,0,0|1,0,0]=2 2018 B7R0.16 C\C(\C(C)=O)=C(\C)/Cl Amb25801180 [0,1,0,0,0,0|1,0,0]=2 2019 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,1,0,0,0,0|0,0,0]=1 2020 B7R0.16 C\C(\F)=C(/F)\C(C)=O Amb24645401 [0,1,0,0,0,0|2,0,0]=3 2021 B7R0.16 C\C(\N)=C(\C)/C(N)=O Amb25293132 [0,1,0,0,0,0|1,0,0]=2 2022 B7R0.16 C\C(\O)=C(/O)\C(C)O Amb24364699 [0,1,0,0,0,0|2,0,1]=4 2023 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,1,0,0,0,0|1,0,0]=2 2024 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,1,0,0,0,0|1,0,2]=4 2025 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,1,0,0,0,0|2,0,0]=3 2026 B7R0.16 NC(=O)C(=O)C(O)=O Amb25344375 [0,1,0,0,0,0|2,0,0]=3 2027 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,1,0,0,0,0|2,0,1]=4 2028 B7R0.16 NC(=O)C(F)=C(F)F Amb25060487 [0,1,0,0,0,0|3,0,0]=4 2029 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,1,0,0,0,0|2,0,1]=4 2030 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,1,0,0,0,0|2,0,1]=4 2031 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,1,0,0,0,0|2,0,1]=4 2032 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|2,0,1]=4 2033 B7R0.16 NC(N)=C(N)C(N)=O Amb24426784 [0,1,0,0,0,0|3,0,0]=4 2034 B7R0.16 O=C(C(=O)C)C(=O)C Amb17593178 [0,1,0,0,0,0|2,0,0]=3 2035 B7R0.16 O=C(Cl)C(Cl)=C(Cl)Cl Amb22366596 [0,1,0,0,0,0|3,0,0]=4 2036 B7R0.16 OC(=O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,0,0|2,0,1]=4 2037 B7R0.16 OC(=O)C(=O)C(Cl)Cl Amb24652562 [0,1,0,0,0,0|2,0,1]=4 2038 B7R0.16 OC(=O)C(=O)C(F)Br Amb25111221 [0,1,0,0,0,0|2,0,1]=4 2039 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,1,0,0,0,0|2,0,0]=3 2040 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,1,0,0,0,0|2,0,0]=3 2041 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,1,0,0,0,0|2,0,0]=3 2042 B7R0.16 OC(=O)C(=S)C(S)=S Amb24635391 [0,1,0,0,0,0|2,0,0]=3 2043 B7R0.16 OC(=O)C(Cl)=C(Cl)Br Amb25365980 [0,1,0,0,0,0|2,0,0]=3 2044 B7R0.16 OC(=O)C(Cl)=C(F)F Amb24758750 [0,1,0,0,0,0|2,0,0]=3 2045 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,1,0,0,0,0|2,0,1]=4 2046 B7R0.16 OC(=O)C(F)=C(Cl)Cl Amb25732891 [0,1,0,0,0,0|2,0,0]=3 2047 B7R0.16 OC(=O)C(F)=C(F)Cl Amb24628494 [0,1,0,0,0,0|2,0,0]=3 2048 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,1,0,0,0,0|2,0,1]=4 2049 B7R0.16 OC(=O)\C(\F)=C(/F)\Cl Amb25265638 [0,1,0,0,0,0|2,0,0]=3 2050 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,1,0,0,0,0|2,0,1]=4 2051 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,1,0,0,0,0|1,0,2]=4 2052 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,1,0,0,0,0|1,0,2]=4 2053 B7R0.16 [13CH3]C([13CH3])C(=O)C([O-])=O Amb22353581 [0,1,0,0,0,0|1,0,2]=4 2054 B7R0.16 [13CH3]C([13CH3])[13C](=O)[13C]([O-])=O Amb22338387 [0,1,0,0,0,0|1,0,2]=4 2055 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,1,0,0,0,0|1,0,2]=4 2056 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,1,0,0,0,0|1,0,2]=4 2057 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,1,0,0,0,0|1,0,2]=4 2058 B7R0.16 [O-]C(=O)C(=O)C([O-])=O Amb22234835 [0,1,0,0,0,0|2,0,1]=4 2059 B7R1.4 Brc1cscc1C Amb2447459 [0,0,0,1,0,0|3,0,0]=4 2060 B7R1.4 CC1=CC=CC1=O Amb24408382 [0,0,0,1,0,0|1,0,1]=3 2061 B7R1.4 CC1=CCCC1Br Amb25279491 [0,0,0,1,0,0|2,0,1]=4 2062 B7R1.4 CC1=CCCC1Cl Amb25139325 [0,0,0,1,0,0|2,0,1]=4 2063 B7R1.4 CC1=CCCC1O Amb25220686 [0,0,0,1,0,0|1,0,1]=3 2064 B7R1.4 CC1=CCC[C@@H]1O Amb24506387 [0,0,0,1,0,0|1,0,1]=3 2065 B7R1.4 CC1=CNOC1=O Amb25843682 [0,0,0,1,0,0|1,0,0]=2 2066 B7R1.4 CC1=CNSC1=N Amb25800616 [0,0,0,1,0,0|2,1,0]=4 2067 B7R1.4 CC1=CSNC1=O Amb24480941 [0,0,0,1,0,0|2,0,0]=3 2068 B7R1.4 CC1=NNCC1=O Amb25086598 [0,0,0,1,0,0|3,0,0]=4 2069 B7R1.4 CC1=NSNC1=O Amb24352647 [0,0,0,1,0,0|3,0,0]=4 2070 B7R1.4 CC1C=CCC1=O Amb25233761 [0,0,0,1,0,0|1,0,2]=4 2071 B7R1.4 CC1C=NNC1=O Amb22232312 [0,0,0,1,0,0|2,0,1]=4 2072 B7R1.4 CC1CCC=C1C Amb24479857 [0,0,0,1,0,0|2,0,1]=4 2073 B7R1.4 CC1CCSC1=O Amb25271791 [0,0,0,1,0,0|0,1,2]=4 2074 B7R1.4 CC1N=COC1=O Amb24518855 [0,0,0,1,0,0|1,0,2]=4 2075 B7R1.4 CC1NCOC1=O Amb24409631 [0,0,0,1,0,0|1,0,1]=3 2076 B7R1.4 CC1O[Ag]OC1=O Amb22352183 [0,0,0,1,0,0|2,0,1]=4 2077 B7R1.4 CC1SCOC1=O Amb25347819 [0,0,0,1,0,0|1,0,1]=3 2078 B7R1.4 CC=1CCCC1Br Amb24479762 [0,0,0,1,0,0|2,0,1]=4 2079 B7R1.4 CC=1CCCC1C Amb22227705 [0,0,0,1,0,0|2,0,1]=4 2080 B7R1.4 CC=1SCCC1S Amb25846018 [0,0,0,1,0,0|2,1,0]=4 2081 B7R1.4 CN1C=CCC1=O Amb25806222 [0,0,0,1,0,0|2,0,1]=4 2082 B7R1.4 CN1C=CNC1=O Amb20622459 [0,0,0,1,0,0|2,0,1]=4 2083 B7R1.4 CN1CCC=C1C Amb17938859 [0,0,0,1,0,0|3,0,0]=4 2084 B7R1.4 CN1CCCC1=O Amb22493780 [0,0,0,1,0,0|2,0,1]=4 2085 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,1,0,0|1,0,1]=3 2086 B7R1.4 CN1NCCC1=O Amb18559311 [0,0,0,1,0,0|3,0,0]=4 2087 B7R1.4 CN1OCCC1=O Amb25229271 [0,0,0,1,0,0|3,0,0]=4 2088 B7R1.4 CN1SCCC1=O Amb25746503 [0,0,0,1,0,0|3,0,0]=4 2089 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,1,0,0|1,0,2]=4 2090 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,0,0,1,0,0|2,0,1]=4 2091 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [0,0,0,1,0,0|1,0,1]=3 2092 B7R1.4 C[C@@H]1OCCC1=O Amb24728733 [0,0,0,1,0,0|2,0,1]=4 2093 B7R1.4 C[C@@H]1OCNC1=O Amb25115508 [0,0,0,1,0,0|2,0,1]=4 2094 B7R1.4 C[C@H]1OCCC1=O Amb25811510 [0,0,0,1,0,0|2,0,1]=4 2095 B7R1.4 C[n]1c[n][n]c1O Amb22157280 [0,0,0,1,0,0|3,0,0]=4 2096 B7R1.4 Cc1[nH][n]cc1O Amb25810995 [0,0,0,1,0,0|3,0,0]=4 2097 B7R1.4 Cc1[nH]ccc1O Amb25214639 [0,0,0,1,0,0|2,0,1]=4 2098 B7R1.4 Cc1[n][nH]cc1C Amb22002061 [0,0,0,1,0,0|3,0,0]=4 2099 B7R1.4 Cc1[n]c[s]c1O Amb25268351 [0,0,0,1,0,0|1,1,1]=4 2100 B7R1.4 Cc1[n]coc1N Amb22234804 [0,0,0,1,0,0|2,0,1]=4 2101 B7R1.4 Cc1[n]coc1O Amb24536045 [0,0,0,1,0,0|1,0,2]=4 2102 B7R1.4 Cc1[s]c[n]c1O Amb24099829 [0,0,0,1,0,0|2,0,1]=4 2103 B7R1.4 Cc1c[nH][n]c1Br Amb22235611 [0,0,0,1,0,0|3,0,0]=4 2104 B7R1.4 Cc1c[nH][n]c1Cl Amb25268019 [0,0,0,1,0,0|3,0,0]=4 2105 B7R1.4 Cc1c[nH][n]c1N Amb24053207 [0,0,0,1,0,0|3,0,0]=4 2106 B7R1.4 Cc1c[nH]cc1Br Amb24419899 [0,0,0,1,0,0|3,0,0]=4 2107 B7R1.4 Cc1c[nH]cc1C Amb17938703 [0,0,0,1,0,0|3,0,0]=4 2108 B7R1.4 Cc1c[nH]cc1N Amb25682874 [0,0,0,1,0,0|3,0,0]=4 2109 B7R1.4 Cc1c[nH]nc1N Amb10248860 [0,0,0,1,0,0|3,0,0]=4 2110 B7R1.4 Cc1c[nH]nc1O Amb17622020 [0,0,0,1,0,0|2,0,0]=3 2111 B7R1.4 Cc1c[n][nH]c1I Amb22755203 [0,0,0,1,0,0|3,0,0]=4 2112 B7R1.4 Cc1c[n][s]c1I Amb25210334 [0,0,0,1,0,0|2,1,0]=4 2113 B7R1.4 Cc1c[n]oc1N Amb18943767 [0,0,0,1,0,0|2,0,0]=3 2114 B7R1.4 Cc1c[n]oc1O Amb25064746 [0,0,0,1,0,0|1,0,1]=3 2115 B7R1.4 Cc1c[s][n]c1Br Amb22490966 [0,0,0,1,0,0|3,0,0]=4 2116 B7R1.4 Cc1c[s][n]c1N Amb24540475 [0,0,0,1,0,0|3,0,0]=4 2117 B7R1.4 Cc1c[s]cc1Cl Amb24751006 [0,0,0,1,0,0|3,0,0]=4 2118 B7R1.4 Cc1c[s]cc1F Amb24620444 [0,0,0,1,0,0|3,0,0]=4 2119 B7R1.4 Cc1c[s]cc1N Amb18833058 [0,0,0,1,0,0|3,0,0]=4 2120 B7R1.4 Cc1c[s]cc1N Amb20667756 [0,0,0,1,0,0|3,0,0]=4 2121 B7R1.4 Cc1c[s]cc1N Amb22234035 [0,0,0,1,0,0|3,0,0]=4 2122 B7R1.4 Cc1cc[nH]c1C Amb17938702 [0,0,0,1,0,0|2,0,1]=4 2123 B7R1.4 Cc1cc[s]c1I Amb22898804 [0,0,0,1,0,0|1,1,1]=4 2124 B7R1.4 Cc1cc[s]c1N Amb18679496 [0,0,0,1,0,0|1,1,1]=4 2125 B7R1.4 Cc1cc[s]c1N Amb22496058 [0,0,0,1,0,0|1,1,1]=4 2126 B7R1.4 Cc1cc[s]c1N Amb22498571 [0,0,0,1,0,0|1,1,1]=4 2127 B7R1.4 Cc1cc[s]c1O Amb24639732 [0,0,0,1,0,0|0,1,1]=3 2128 B7R1.4 Cc1cc[s]c1S Amb25747282 [0,0,0,1,0,0|0,2,1]=4 2129 B7R1.4 Cc1ccoc1Br Amb22276939 [0,0,0,1,0,0|1,0,1]=3 2130 B7R1.4 Cc1ccsc1Br Amb2236394 [0,0,0,1,0,0|1,1,1]=4 2131 B7R1.4 Cc1co[n]c1N Amb18278180 [0,0,0,1,0,0|3,0,0]=4 2132 B7R1.4 Cc1cocc1Br Amb24056370 [0,0,0,1,0,0|3,0,0]=4 2133 B7R1.4 Cc1cocc1C Amb17613311 [0,0,0,1,0,0|3,0,0]=4 2134 B7R1.4 Cc1cocc1I Amb24630674 [0,0,0,1,0,0|3,0,0]=4 2135 B7R1.4 Cc1cocc1O Amb24411637 [0,0,0,1,0,0|2,0,0]=3 2136 B7R1.4 Cc1n[nH]cc1C Amb17613373 [0,0,0,1,0,0|3,0,0]=4 2137 B7R1.4 Cc1o[n]cc1Br Amb18199818 [0,0,0,1,0,0|3,0,0]=4 2138 B7R1.4 Cc1o[n]cc1N Amb18119789 [0,0,0,1,0,0|3,0,0]=4 2139 B7R1.4 Cc1o[n]cc1N Amb20668399 [0,0,0,1,0,0|3,0,0]=4 2140 B7R1.4 Cc1oc[n]c1C Amb22396059 [0,0,0,1,0,0|2,0,1]=4 2141 B7R1.4 Cc1occc1N Amb18203072 [0,0,0,1,0,0|2,0,1]=4 2142 B7R1.4 Cc1occc1O Amb25178728 [0,0,0,1,0,0|2,0,1]=4 2143 B7R1.4 Cc1sccc1C Amb2447413 [0,0,0,1,0,0|1,1,1]=4 2144 B7R1.4 Clc1ccoc1Cl Amb25208816 [0,0,0,1,0,0|2,0,1]=4 2145 B7R1.4 Clc1occc1Br Amb24443259 [0,0,0,1,0,0|2,0,1]=4 2146 B7R1.4 Fc1ccoc1Br Amb18199675 [0,0,0,1,0,0|2,0,1]=4 2147 B7R1.4 Fc1occc1Br Amb24638170 [0,0,0,1,0,0|2,0,1]=4 2148 B7R1.4 NC1=CCOC1=O Amb22234102 [0,0,0,1,0,0|1,0,0]=2 2149 B7R1.4 NC1=CNNC1=O Amb24120355 [0,0,0,1,0,0|3,0,0]=4 2150 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,1,0,0|3,0,0]=4 2151 B7R1.4 NC1=CSSC1=O Amb25303597 [0,0,0,1,0,0|2,1,0]=4 2152 B7R1.4 NC1CCOC1=O Amb22233082 [0,0,0,1,0,0|1,0,2]=4 2153 B7R1.4 NN1C=COC1=O Amb24626105 [0,0,0,1,0,0|2,0,1]=4 2154 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,0,0,1,0,0|1,0,2]=4 2155 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [0,0,0,1,0,0|1,0,2]=4 2156 B7R1.4 Nc1c[n]oc1Cl Amb25025558 [0,0,0,1,0,0|3,0,0]=4 2157 B7R1.4 Nc1ccoc1Br Amb13884558 [0,0,0,1,0,0|2,0,1]=4 2158 B7R1.4 Nc1ccoc1N Amb18832360 [0,0,0,1,0,0|2,0,1]=4 2159 B7R1.4 Nc1cocc1O Amb24078810 [0,0,0,1,0,0|3,0,0]=4 2160 B7R1.4 Nc1o[n]cc1Cl Amb24385964 [0,0,0,1,0,0|3,0,0]=4 2161 B7R1.4 Nc1occc1O Amb25327034 [0,0,0,1,0,0|2,0,1]=4 2162 B7R1.4 O=C1C=COC1=O Amb24706925 [0,0,0,1,0,0|1,0,1]=3 2163 B7R1.4 O=C1CCBC1=O Amb25186988 [0,0,0,1,0,0|2,0,1]=4 2164 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,0,0,1,0,0|2,0,0]=3 2165 B7R1.4 O=C1CCC=C1Cl Amb24749092 [0,0,0,1,0,0|2,0,0]=3 2166 B7R1.4 O=C1CCC=C1O Amb17593067 [0,0,0,1,0,0|2,0,0]=3 2167 B7R1.4 O=C1CCCC1=C Amb17593061 [0,0,0,1,0,0|1,0,2]=4 2168 B7R1.4 O=C1CCCC1=O Amb24053064 [0,0,0,1,0,0|2,0,1]=4 2169 B7R1.4 O=C1CCNC1=O Amb21858086 [0,0,0,1,0,0|2,0,1]=4 2170 B7R1.4 O=C1N=NC=C1Cl Amb25836875 [0,0,0,1,0,0|3,0,0]=4 2171 B7R1.4 O=C1NCCC1C Amb10603701 [0,0,0,1,0,0|1,0,2]=4 2172 B7R1.4 O=C1NOC=C1Br Amb24641631 [0,0,0,1,0,0|3,0,0]=4 2173 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,1,0,0|1,0,2]=4 2174 B7R1.4 O=C1OC=CC1I Amb24679050 [0,0,0,1,0,0|1,0,2]=4 2175 B7R1.4 O=C1OCC=C1Br Amb10067498 [0,0,0,1,0,0|1,0,0]=2 2176 B7R1.4 O=C1OCC=C1C Amb16231256 [0,0,0,1,0,0|0,0,0]=1 2177 B7R1.4 O=C1OCC=C1Cl Amb23571857 [0,0,0,1,0,0|1,0,0]=2 2178 B7R1.4 O=C1OCC=C1I Amb24679080 [0,0,0,1,0,0|1,0,0]=2 2179 B7R1.4 O=C1OCCC1C Amb16185414 [0,0,0,1,0,0|0,0,2]=3 2180 B7R1.4 O=C1OCCC1Cl Amb25065373 [0,0,0,1,0,0|1,0,2]=4 2181 B7R1.4 O=C1OCCC1I Amb24418518 [0,0,0,1,0,0|1,0,2]=4 2182 B7R1.4 O=C1OCCC1N Amb1151850 [0,0,0,1,0,0|1,0,2]=4 2183 B7R1.4 O=C1OCCC1N Amb17614991 [0,0,0,1,0,0|1,0,2]=4 2184 B7R1.4 O=C1OCCC1S Amb25146639 [0,0,0,1,0,0|1,0,2]=4 2185 B7R1.4 O=C1OCCN1N Amb10068971 [0,0,0,1,0,0|2,0,1]=4 2186 B7R1.4 O=C1OCC[C@@H]1N Amb10982617 [0,0,0,1,0,0|1,0,2]=4 2187 B7R1.4 O=C1OCC[C@H]1N Amb10601656 [0,0,0,1,0,0|1,0,2]=4 2188 B7R1.4 O=C1OCNC1Br Amb25299209 [0,0,0,1,0,0|2,0,1]=4 2189 B7R1.4 O=C1OCOC1Br Amb25237748 [0,0,0,1,0,0|2,0,1]=4 2190 B7R1.4 O=C1ON=CC1=O Amb25319011 [0,0,0,1,0,0|2,0,0]=3 2191 B7R1.4 O=C1O[Ca]OC1=O Amb20671286 [0,0,0,1,0,0|3,0,0]=4 2192 B7R1.4 O=C1O[Fe]OC1=O Amb22167955 [0,0,0,1,0,0|3,0,0]=4 2193 B7R1.4 O=C1O[Sn]OC1=O Amb19894343 [0,0,0,1,0,0|3,0,0]=4 2194 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [0,0,0,1,0,0|3,0,0]=4 2195 B7R1.4 OC1=CCOC1=O Amb25147525 [0,0,0,1,0,0|1,0,0]=2 2196 B7R1.4 OC1C=COC1=O Amb25296159 [0,0,0,1,0,0|1,0,2]=4 2197 B7R1.4 OC1CCC=C1Br Amb24429462 [0,0,0,1,0,0|2,0,1]=4 2198 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,0,0,1,0,0|2,0,1]=4 2199 B7R1.4 O[C@@H]1CCC=C1Br Amb24631856 [0,0,0,1,0,0|2,0,1]=4 2200 B7R1.4 O[C@H]1CCC=C1Br Amb25186071 [0,0,0,1,0,0|2,0,1]=4 2201 B7R1.4 Oc1[nH]ccc1Br Amb18819118 [0,0,0,1,0,0|2,0,1]=4 2202 B7R1.4 Oc1[n][s]cc1Cl Amb25292896 [0,0,0,1,0,0|3,0,0]=4 2203 B7R1.4 Oc1[s]ccc1Br Amb22492529 [0,0,0,1,0,0|1,1,1]=4 2204 B7R1.4 Oc1[s]ccc1Cl Amb25296805 [0,0,0,1,0,0|1,1,1]=4 2205 B7R1.4 Oc1[s]ccc1F Amb25177194 [0,0,0,1,0,0|1,1,1]=4 2206 B7R1.4 Oc1c[s]cc1O Amb21964108 [0,0,0,1,0,0|3,0,0]=4 2207 B7R1.4 Oc1ccoc1Br Amb24078809 [0,0,0,1,0,0|2,0,1]=4 2208 B7R1.4 Oc1ccoc1O Amb24060949 [0,0,0,1,0,0|1,0,2]=4 2209 B7R1.4 Oc1cocc1Cl Amb25375956 [0,0,0,1,0,0|3,0,0]=4 2210 B7R1.4 Oc1cocc1F Amb24638363 [0,0,0,1,0,0|3,0,0]=4 2211 B7R1.4 Oc1nonc1C Amb1102107 [0,0,0,1,0,0|3,0,0]=4 2212 B7R1.4 Oc1occc1Br Amb18199810 [0,0,0,1,0,0|1,0,2]=4 2213 B7R1.4 SC1=C(C)OCC1 Amb16232456 [0,0,0,1,0,0|2,0,1]=4 2214 B7R1.4 Sc1ccoc1C Amb16232454 [0,0,0,1,0,0|2,0,1]=4 2215 B7R1.4 [13CH3]N1[13CH2]CC[13C]1=O Amb22055816 [0,0,0,1,0,0|2,0,1]=4 2216 B7R1.8 COC1CCC1=O Amb22896543 [0,0,0,1,0,0|2,0,1]=4 2217 B7R1.8 C\C=C/1\CCC1=O Amb24512730 [0,0,0,1,0,0|1,0,0]=2 2218 B7R1.8 C\C=C/1\CNC1=O Amb24578767 [0,0,0,1,0,0|1,0,0]=2 2219 B7R1.8 C\C=C\1/CCC1=O Amb24576011 [0,0,0,1,0,0|1,0,0]=2 2220 B7R1.8 O=C/1CC\C1=C\Cl Amb24706832 [0,0,0,1,0,0|2,0,0]=3 2221 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,1,0,0|0,0,2]=3 2222 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,1,0,0|0,0,2]=3 2223 B7R1.12 CC1=CC1C(C)=O Amb24736062 [0,0,0,1,0,0|1,0,2]=4 2224 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,1,0,0|1,0,2]=4 2225 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|1,0,2]=4 2226 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,1,0,0|1,0,2]=4 2227 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,1,0,0|1,0,2]=4 2228 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,1,0,0|0,0,2]=3 2229 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|1,0,2]=4 2230 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,1,0,0|0,0,2]=3 2231 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,1,0,0|1,0,2]=4 2232 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,1,0,0|1,0,2]=4 2233 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,1,0,0|0,0,2]=3 2234 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|0,0,2]=3 2235 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,1,0,0|1,0,2]=4 2236 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,1,0,0|1,0,2]=4 2237 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,1,0,0|1,0,2]=4 2238 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,1,0,0|1,0,2]=4 2239 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,2]=4 2240 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,2]=4 2241 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,1,0,0|1,0,2]=4 2242 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,2]=4 2243 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,2]=4 2244 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,2]=4 2245 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,2]=4 2246 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,2]=4 2247 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,2]=4 2248 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,2]=4 2249 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,1,0,0|1,0,2]=4 2250 B7R1.15 CC1=CC(=C)C1=O Amb24456573 [0,0,0,1,0,0|3,0,0]=4 2251 B7R1.15 CC1=CC(=O)C1=O Amb25092478 [0,0,0,1,0,0|2,0,0]=3 2252 B7R1.15 CC1=CC(=O)C1C Amb24690597 [0,0,0,1,0,0|1,0,1]=3 2253 B7R1.15 CC1C(=O)CC1=O Amb24364046 [0,0,0,1,0,0|2,0,1]=4 2254 B7R1.15 CC1C(C)CC1=O Amb24605096 [0,0,0,1,0,0|1,0,2]=4 2255 B7R1.15 CC1C(C)NC1=O Amb22364651 [0,0,0,1,0,0|1,0,2]=4 2256 B7R1.15 CC1OC(=O)C1N Amb25169554 [0,0,0,1,0,0|1,0,2]=4 2257 B7R1.15 CC=1C(Br)CC1C Amb24504655 [0,0,0,1,0,0|2,0,1]=4 2258 B7R1.15 CC=1C(Cl)CC1C Amb25286188 [0,0,0,1,0,0|2,0,1]=4 2259 B7R1.15 C[C@@H]1[C@H](C)CC1=O Amb25745705 [0,0,0,1,0,0|1,0,2]=4 2260 B7R1.15 Nc1cc(=O)c1=O Amb17835337 [0,0,0,1,0,0|3,0,0]=4 2261 B7R1.15 O=C1C(Cl)=CC1=O Amb22171299 [0,0,0,1,0,0|3,0,0]=4 2262 B7R1.15 OC1=CC(=O)C1=O Amb20246501 [0,0,0,1,0,0|3,0,0]=4 2263 B7R1.15 OC1=CC(=O)C1=O Amb22171298 [0,0,0,1,0,0|3,0,0]=4 2264 B7R1.15 [O-]C1=CC(=O)C1=O Amb22410185 [0,0,0,1,0,0|3,0,0]=4 2265 B7R1.15 [O-]c1cc(=O)c1=O Amb17770074 [0,0,0,1,0,0|3,0,0]=4 2266 B7R1.17 CC1=CCS1(=O)=O Amb22364834 [0,0,0,1,0,0|1,0,1]=3 2267 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [0,0,0,1,0,0|1,0,2]=4 2268 B7R1.18 CC(=O)C1CCO1 Amb25745997 [0,0,0,1,0,0|2,0,1]=4 2269 B7R1.18 CC(=O)C1CCS1 Amb24105980 [0,0,0,1,0,0|2,0,1]=4 2270 B7R1.18 CC(=O)C=1CCC1 Amb23453500 [0,0,0,1,0,0|1,0,0]=2 2271 B7R1.18 CC(=O)N1CC=C1 Amb22001815 [0,0,0,1,0,0|2,0,1]=4 2272 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,0,1,0,0|2,0,1]=4 2273 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,1]=4 2274 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,1]=4 2275 B7R1.18 NC(=O)C1CCO1 Amb24478900 [0,0,0,1,0,0|2,0,1]=4 2276 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,0,0,1,0,0|2,0,1]=4 2277 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|0,0,0]=1 2278 B7R1.18 OC(=O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,1]=3 2279 B7R1.18 OC(=O)C1CCO1 Amb2383526 [0,0,0,1,0,0|1,0,1]=3 2280 B7R1.18 OC(=O)C1CNC1 Amb2444164 [0,0,0,1,0,0|1,0,2]=4 2281 B7R1.18 OC(=O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,0,2]=4 2282 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [0,0,0,1,0,0|1,0,2]=4 2283 B7R1.19 CC1(C=C1)C(O)=O Amb25042785 [0,0,0,1,0,0|0,0,2]=3 2284 B7R1.19 CC1(CC1)C(N)=O Amb19958822 [0,0,0,1,0,0|1,0,2]=4 2285 B7R1.19 CC1(CC1)C(N)=O Amb22752771 [0,0,0,1,0,0|1,0,2]=4 2286 B7R1.19 CC1(CO1)C(=O)O Amb17593087 [0,0,0,1,0,0|1,0,1]=3 2287 B7R1.19 CC1(CO1)C(N)=O Amb25261467 [0,0,0,1,0,0|2,0,1]=4 2288 B7R1.19 CC1(CS1)C(O)=O Amb24760846 [0,0,0,1,0,0|1,0,1]=3 2289 B7R1.19 C[C@@]1(CO1)C(O)=O Amb25785347 [0,0,0,1,0,0|1,0,1]=3 2290 B7R1.19 C[C@]1(CO1)C(O)=O Amb25063884 [0,0,0,1,0,0|1,0,1]=3 2291 B7R1.19 ClC(=O)C1(C)CC1 Amb16230812 [0,0,0,1,0,0|1,0,2]=4 2292 B7R1.19 OC(=O)C1(Br)CC1 Amb19888922 [0,0,0,1,0,0|1,0,2]=4 2293 B7R1.19 OC(=O)C1(Cl)CC1 Amb25841916 [0,0,0,1,0,0|1,0,2]=4 2294 B7R1.19 OC(=O)C1(F)CC1 Amb22001836 [0,0,0,1,0,0|1,0,2]=4 2295 B7R1.22 C\C=C(/C)\C1CO1 Amb25101149 [0,0,0,1,0,0|1,0,1]=3 2296 B7R1.22 C\C=C(\C)/C1CO1 Amb24575410 [0,0,0,1,0,0|1,0,1]=3 2297 B7R1.27 CC1(CC1=O)C=C Amb25116558 [0,0,0,1,0,0|1,0,2]=4 2298 B7R1.30 CC1(C)C(C)=C1C Amb22730990 [0,0,0,1,0,0|2,0,1]=4 2299 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [0,0,0,0,0,1|0,0,3]=4 2300 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [0,0,0,0,0,1|0,0,2]=3 2301 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,0,0,0,0,1|1,0,2]=4 2302 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,0,0,0,0,1|1,0,2]=4 2303 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,0,0,0,0,1|1,0,2]=4 2304 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,0,0,0,0,1|1,0,2]=4 2305 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,0,0,0,0,1|1,0,2]=4 2306 B7R0.2 C=CN(Br)CC(O)=O Amb24629979 [0,0,0,0,0,1|2,0,1]=4 2307 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,0,0,0,0,1|1,0,2]=4 2308 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,0,0,0,0,1|1,0,2]=4 2309 B7R0.2 CC(=CC(C)=O)NC Amb25850096 [0,0,0,0,0,1|2,0,0]=3 2310 B7R0.2 CC(=CC(C)=O)OC Amb24583696 [0,0,0,0,0,1|2,0,0]=3 2311 B7R0.2 CC(=CC(N)=O)C#N Amb25174853 [0,0,0,0,0,1|2,0,1]=4 2312 B7R0.2 CC(=CC(N)=O)OC Amb25128053 [0,0,0,0,0,1|2,0,0]=3 2313 B7R0.2 CC(=CC(O)=O)C#C Amb25687994 [0,0,0,0,0,1|0,0,2]=3 2314 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [0,0,0,0,0,1|1,0,0]=2 2315 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,0,0,0,0,1|1,0,0]=2 2316 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [0,0,0,0,0,1|2,0,1]=4 2317 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [0,0,0,0,0,1|2,0,1]=4 2318 B7R0.2 CC(=O)C=C(N)OC Amb25174865 [0,0,0,0,0,1|3,0,0]=4 2319 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [0,0,0,0,0,1|3,0,0]=4 2320 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,0,0,0,0,1|3,0,0]=4 2321 B7R0.2 CC(=O)CC(=S)C=O Amb25142738 [0,0,0,0,0,1|3,0,0]=4 2322 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [0,0,0,0,0,1|2,0,1]=4 2323 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [0,0,0,0,0,1|3,0,0]=4 2324 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,0,0,0,0,1|3,0,0]=4 2325 B7R0.2 CC(=O)CN(C)C=O Amb25134136 [0,0,0,0,0,1|3,0,0]=4 2326 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [0,0,0,0,0,1|2,0,0]=3 2327 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [0,0,0,0,0,1|2,0,0]=3 2328 B7R0.2 CC(=O)C\C(\Cl)=C\Cl Amb24736103 [0,0,0,0,0,1|3,0,0]=4 2329 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [0,0,0,0,0,1|1,0,2]=4 2330 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [0,0,0,0,0,1|3,0,0]=4 2331 B7R0.2 CC(=O)NC(=O)SC Amb24481559 [0,0,0,0,0,1|3,0,0]=4 2332 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [0,0,0,0,0,1|2,0,1]=4 2333 B7R0.2 CC(=O)NC(=S)NC Amb24746594 [0,0,0,0,0,1|3,0,0]=4 2334 B7R0.2 CC(=O)OC(=C)C=C Amb25694419 [0,0,0,0,0,1|1,0,2]=4 2335 B7R0.2 CC(=O)OC(=C)C=O Amb25695435 [0,0,0,0,0,1|2,0,1]=4 2336 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [0,0,0,0,0,1|1,0,2]=4 2337 B7R0.2 CC(=O)OC(=O)C=C Amb25770477 [0,0,0,0,0,1|2,0,1]=4 2338 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [0,0,0,0,0,1|2,0,1]=4 2339 B7R0.2 CC(=O)SC(=N)NC Amb24694348 [0,0,0,0,0,1|3,0,0]=4 2340 B7R0.2 CC(=O)SC(Cl)=CCl Amb25725021 [0,0,0,0,0,1|3,0,0]=4 2341 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [0,0,0,0,0,1|2,0,1]=4 2342 B7R0.2 CC(=O)\C=C(/Cl)\C=C Amb25236926 [0,0,0,0,0,1|2,0,1]=4 2343 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [0,0,0,0,0,1|2,0,1]=4 2344 B7R0.2 CC(=O)\C=C(/O)\C=C Amb24339287 [0,0,0,0,0,1|2,0,1]=4 2345 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [0,0,0,0,0,1|2,0,1]=4 2346 B7R0.2 CC(=O)\C=C(\Br)/C=C Amb24505183 [0,0,0,0,0,1|2,0,1]=4 2347 B7R0.2 CC(=O)\C=C(\C)/C=O Amb18641689 [0,0,0,0,0,1|2,0,0]=3 2348 B7R0.2 CC(=O)\C=C(\O)/C=C Amb24553056 [0,0,0,0,0,1|2,0,1]=4 2349 B7R0.2 CC(=O)\N=C(/N)\NC Amb24120628 [0,0,0,0,0,1|3,0,0]=4 2350 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,0,0,0,0,1|1,0,2]=4 2351 B7R0.2 CC(C=C)OC(=O)Cl Amb24550333 [0,0,0,0,0,1|1,0,2]=4 2352 B7R0.2 CC(C=O)NC(C)=O Amb18641830 [0,0,0,0,0,1|2,0,1]=4 2353 B7R0.2 CC(C=O)OC(C)=O Amb18641863 [0,0,0,0,0,1|2,0,1]=4 2354 B7R0.2 CC(CBr)=CC(=O)Cl Amb24519437 [0,0,0,0,0,1|2,0,1]=4 2355 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [0,0,0,0,0,1|1,0,2]=4 2356 B7R0.2 CC(CC(C)=O)=CCl Amb25685302 [0,0,0,0,0,1|2,0,0]=3 2357 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [0,0,0,0,0,1|2,0,0]=3 2358 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [0,0,0,0,0,1|2,0,1]=4 2359 B7R0.2 CC(CC(N)=O)=CCl Amb25663357 [0,0,0,0,0,1|2,0,0]=3 2360 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [0,0,0,0,0,1|0,0,2]=3 2361 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [0,0,0,0,0,1|1,0,0]=2 2362 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,0,0,0,0,1|0,0,2]=3 2363 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,0,0,0,0,1|1,0,1]=3 2364 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,0,0,0,0,1|1,0,2]=4 2365 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,0,0,0,0,1|2,0,1]=4 2366 B7R0.2 CC(CC)=CC(N)=O Amb24640827 [0,0,0,0,0,1|1,0,1]=3 2367 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,0,0,0,0,1|1,0,2]=4 2368 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,0,0,0,0,1|1,0,2]=4 2369 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,0,0,0,0,1|1,0,2]=4 2370 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,0,0,0,0,1|1,0,1]=3 2371 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,0,0,0,0,1|1,0,1]=3 2372 B7R0.2 CC(NC(=O)N)CC Amb1105272 [0,0,0,0,0,1|1,0,2]=4 2373 B7R0.2 CC(NC)CC(=O)N Amb17231826 [0,0,0,0,0,1|2,0,1]=4 2374 B7R0.2 CC(O)C\C(\C)=C\Br Amb24415427 [0,0,0,0,0,1|2,0,1]=4 2375 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,0,0,0,0,1|0,0,2]=3 2376 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,0,0,0,0,1|1,0,1]=3 2377 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,0,0,0,0,1|1,0,2]=4 2378 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,0,0,0,0,1|1,0,2]=4 2379 B7R0.2 CCC(C)NC(O)=S Amb25368326 [0,0,0,0,0,1|0,1,2]=4 2380 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,0,0,0,0,1|1,0,2]=4 2381 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,0,0,0,0,1|1,0,2]=4 2382 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,0,0,0,0,1|1,0,2]=4 2383 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,0,0,0,0,1|1,0,2]=4 2384 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,0,0,0,0,1|1,0,2]=4 2385 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,0,0,0,0,1|1,0,1]=3 2386 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,0,0,0,0,1|1,0,2]=4 2387 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,0,0,0,0,1|1,0,2]=4 2388 B7R0.2 CCN(C)NC(C)=O Amb24675229 [0,0,0,0,0,1|2,0,1]=4 2389 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,0,0,0,0,1|2,0,1]=4 2390 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,0,1|2,0,1]=4 2391 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,0,0,0,0,1|1,0,2]=4 2392 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,0,0,0,0,1|1,0,2]=4 2393 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,0,0,0,0,1|1,0,2]=4 2394 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [0,0,0,0,0,1|1,0,2]=4 2395 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,0,0,0,0,1|1,0,2]=4 2396 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,0,0,0,0,1|1,0,2]=4 2397 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,0,0,0,0,1|1,0,2]=4 2398 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [0,0,0,0,0,1|1,0,2]=4 2399 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,0,0,0,0,1|1,0,2]=4 2400 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,0,0,0,0,1|1,0,1]=3 2401 B7R0.2 CC\C(\N)=C/C(N)=O Amb24624408 [0,0,0,0,0,1|2,0,1]=4 2402 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [0,0,0,0,0,1|2,0,1]=4 2403 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [0,0,0,0,0,1|2,0,0]=3 2404 B7R0.2 CNC(=N)NC(N)=O Amb25374784 [0,0,0,0,0,1|3,0,0]=4 2405 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,0,0,0,0,1|3,0,0]=4 2406 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,0,0,0,0,1|2,0,1]=4 2407 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,0,0,0,0,1|1,0,1]=3 2408 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,0,0,0,0,1|1,0,1]=3 2409 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,0,0,0,0,1|1,0,1]=3 2410 B7R0.2 CN\C(=C/C(=O)C)\C Amb15691784 [0,0,0,0,0,1|2,0,0]=3 2411 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,0,0,0,0,1|2,0,0]=3 2412 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,0,0,0,0,1|3,0,0]=4 2413 B7R0.2 COC(=O)NC(=O)Cl Amb24483069 [0,0,0,0,0,1|3,0,0]=4 2414 B7R0.2 COC(C)=CC(C)O Amb25769416 [0,0,0,0,0,1|2,0,1]=4 2415 B7R0.2 CON(C)CC(N)=O Amb24447118 [0,0,0,0,0,1|3,0,0]=4 2416 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,0,0,0,0,1|1,0,1]=3 2417 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,0,0,0,0,1|2,0,1]=4 2418 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,0,0,0,0,1|1,0,1]=3 2419 B7R0.2 CSC(N)=NC(N)=O Amb25757974 [0,0,0,0,0,1|3,0,0]=4 2420 B7R0.2 CS\C(=N\C(=O)C)\N Amb1091801 [0,0,0,0,0,1|3,0,0]=4 2421 B7R0.2 C[C@@H](C=C)NC(C)=O Amb25084335 [0,0,0,0,0,1|1,0,2]=4 2422 B7R0.2 C[C@@H](C=O)OC(C)=O Amb24724866 [0,0,0,0,0,1|2,0,1]=4 2423 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [0,0,0,0,0,1|2,0,1]=4 2424 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,0,0,0,0,1|2,0,1]=4 2425 B7R0.2 C[C@@H](O)\C=C(/C)\C=O Amb25827172 [0,0,0,0,0,1|2,0,1]=4 2426 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,0,0,0,0,1|0,0,2]=3 2427 B7R0.2 C\C(=C/C(C)=O)\NN Amb25718654 [0,0,0,0,0,1|3,0,0]=4 2428 B7R0.2 C\C(=C/C(C)=O)\OC Amb24332557 [0,0,0,0,0,1|2,0,0]=3 2429 B7R0.2 C\C(=C/C(N)=O)\C#N Amb24507835 [0,0,0,0,0,1|2,0,1]=4 2430 B7R0.2 C\C(=C/C(N)=O)\C=C Amb24523763 [0,0,0,0,0,1|1,0,1]=3 2431 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [0,0,0,0,0,1|1,0,0]=2 2432 B7R0.2 C\C(=C\C(=C)O)\OC Amb24481460 [0,0,0,0,0,1|2,0,0]=3 2433 B7R0.2 C\C(=C\C(C)=O)\C#C Amb24760457 [0,0,0,0,0,1|1,0,2]=4 2434 B7R0.2 C\C(=C\C(C)=O)\O[K] Amb22353109 [0,0,0,0,0,1|3,0,0]=4 2435 B7R0.2 C\C(=C\C(C)=O)\O[Rb] Amb22337868 [0,0,0,0,0,1|3,0,0]=4 2436 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22167430 [0,0,0,0,0,1|3,0,0]=4 2437 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22167433 [0,0,0,0,0,1|3,0,0]=4 2438 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22350497 [0,0,0,0,0,1|3,0,0]=4 2439 B7R0.2 C\C(=C\C(C)=O)\O[Tl] Amb22351612 [0,0,0,0,0,1|3,0,0]=4 2440 B7R0.2 C\C(=C\C(O)=O)\C=C Amb18641686 [0,0,0,0,0,1|0,0,1]=2 2441 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [0,0,0,0,0,1|1,0,0]=2 2442 B7R0.2 C\C(=C\C)\NC(C)=O Amb24468210 [0,0,0,0,0,1|1,0,0]=2 2443 B7R0.2 C\C(=C\C)\NC([S-])=S Amb24337419 [0,0,0,0,0,1|0,2,0]=3 2444 B7R0.2 C\C(\C=C)=C/C(C)=O Amb25234874 [0,0,0,0,0,1|1,0,1]=3 2445 B7R0.2 C\C(\C=O)=C\C(C)=C Amb18641616 [0,0,0,0,0,1|3,0,0]=4 2446 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,0,0,0,0,1|1,0,1]=3 2447 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [0,0,0,0,0,1|2,0,0]=3 2448 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [0,0,0,0,0,1|2,0,0]=3 2449 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [0,0,0,0,0,1|3,0,0]=4 2450 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [0,0,0,0,0,1|1,0,0]=2 2451 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,0,0,0,0,1|0,0,0]=1 2452 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,0,0,0,0,1|2,0,0]=3 2453 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,0,0,0,0,1|0,0,1]=2 2454 B7R0.2 C\C(\CCl)=C\C(C)=O Amb25340485 [0,0,0,0,0,1|2,0,1]=4 2455 B7R0.2 C\C(\CN)=C\C(C)=O Amb20621518 [0,0,0,0,0,1|2,0,1]=4 2456 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,0,0,0,0,1|2,0,1]=4 2457 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,0,0,0,0,1|1,0,1]=3 2458 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,0,0,0,0,1|2,0,1]=4 2459 B7R0.2 C\C(\O)=C\C(=S)NC Amb24470603 [0,0,0,0,0,1|3,0,0]=4 2460 B7R0.2 C\C=C(/C)\CC(C)N Amb25076680 [0,0,0,0,0,1|2,0,1]=4 2461 B7R0.2 C\C=C(\C)/CC(C)Br Amb25194408 [0,0,0,0,0,1|2,0,1]=4 2462 B7R0.2 C\C=C(\C)/CC(C)C Amb24566930 [0,0,0,0,0,1|2,0,1]=4 2463 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,0,0,0,0,1|1,0,0]=2 2464 B7R0.2 NC(=O)NC(=O)C=C Amb13951205 [0,0,0,0,0,1|2,0,1]=4 2465 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,0,0,0,0,1|2,0,1]=4 2466 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,0,0,0,0,1|2,0,1]=4 2467 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,0,0,0,0,1|2,0,1]=4 2468 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,0,0,0,0,1|2,0,1]=4 2469 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,0,0,0,0,1|3,0,0]=4 2470 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,0,0,0,0,1|2,0,1]=4 2471 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,0,0,0,0,1|3,0,0]=4 2472 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [0,0,0,0,0,1|3,0,0]=4 2473 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,0,0,0,0,1|2,0,1]=4 2474 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,0,0,0,0,1|3,0,0]=4 2475 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,0,0,0,0,1|2,0,1]=4 2476 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [0,0,0,0,0,1|3,0,0]=4 2477 B7R0.2 OC(=O)\C=C(/Cl)\C=O Amb24452824 [0,0,0,0,0,1|2,0,0]=3 2478 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,0,0,0,0,1|2,0,1]=4 2479 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,0,0,0,0,1|2,0,1]=4 2480 B7R0.2 [Li]O\C(\C)=C/C(C)=O Amb22366981 [0,0,0,0,0,1|3,0,0]=4 2481 B4R0.1 BC(=O)OC Amb22337865 [2,0,0,0,0,0|2,0,0]=4 2482 B4R0.1 BC(=O)OC Amb25199772 [2,0,0,0,0,0|2,0,0]=4 2483 B4R0.1 BCC(C)=O Amb25024392 [2,0,0,0,0,0|1,0,1]=4 2484 B4R0.1 BrC=C(C)C Amb10067297 [2,0,0,0,0,0|1,0,0]=3 2485 B4R0.1 C=C(Br)CO Amb20620404 [2,0,0,0,0,0|1,0,1]=4 2486 B4R0.1 C=C(F)CO Amb22008254 [2,0,0,0,0,0|1,0,1]=4 2487 B4R0.1 C=C(I)C=O Amb25747223 [2,0,0,0,0,0|1,0,0]=3 2488 B4R0.1 C=CB(O)O Amb20248084 [2,0,0,0,0,0|1,0,1]=4 2489 B4R0.1 C=CC(=C)Br Amb24552661 [2,0,0,0,0,0|1,0,1]=4 2490 B4R0.1 C=CC(=C)Cl Amb22351555 [2,0,0,0,0,0|1,0,1]=4 2491 B4R0.1 C=CC(=C)I Amb25745723 [2,0,0,0,0,0|1,0,1]=4 2492 B4R0.1 C=CC(N)=N Amb22489590 [2,0,0,0,0,0|2,0,0]=4 2493 B4R0.1 C=CC(N)=O Amb22167336 [2,0,0,0,0,0|1,0,0]=3 2494 B4R0.1 C=CC(N)=O Amb22351294 [2,0,0,0,0,0|1,0,0]=3 2495 B4R0.1 C=CC(N)=S Amb24532927 [2,0,0,0,0,0|1,1,0]=4 2496 B4R0.1 C=CC(O)=O Amb22227738 [2,0,0,0,0,0|0,0,0]=2 2497 B4R0.1 C=CC(O)=O Amb22336305 [2,0,0,0,0,0|0,0,0]=2 2498 B4R0.1 C=CC(O)=O Amb22338581 [2,0,0,0,0,0|0,0,0]=2 2499 B4R0.1 C=CC(O)=O Amb22351186 [2,0,0,0,0,0|0,0,0]=2 2500 B4R0.1 C=CC(O)=O Amb22351399 [2,0,0,0,0,0|0,0,0]=2 2501 B4R0.1 C=CC(O)=O Amb22363130 [2,0,0,0,0,0|0,0,0]=2 2502 B4R0.1 C=CC([O-])=O Amb22045810 [2,0,0,0,0,0|0,0,1]=3 2503 B4R0.1 C=CC([O-])=O Amb22045811 [2,0,0,0,0,0|0,0,1]=3 2504 B4R0.1 C=CC([O-])=O Amb22045848 [2,0,0,0,0,0|0,0,1]=3 2505 B4R0.1 C=CC([O-])=O Amb22045849 [2,0,0,0,0,0|0,0,1]=3 2506 B4R0.1 C=CC([O-])=O Amb22045850 [2,0,0,0,0,0|0,0,1]=3 2507 B4R0.1 C=CC([O-])=O Amb22054122 [2,0,0,0,0,0|0,0,1]=3 2508 B4R0.1 C=CC([O-])=O Amb22167662 [2,0,0,0,0,0|0,0,1]=3 2509 B4R0.1 C=CC([O-])=O Amb22229631 [2,0,0,0,0,0|0,0,1]=3 2510 B4R0.1 C=CC([O-])=O Amb22336408 [2,0,0,0,0,0|0,0,1]=3 2511 B4R0.1 C=CC([O-])=O Amb22366873 [2,0,0,0,0,0|0,0,1]=3 2512 B4R0.1 C=CC([O-])=O Amb22731093 [2,0,0,0,0,0|0,0,1]=3 2513 B4R0.1 C=CC([O-])=O Amb22732585 [2,0,0,0,0,0|0,0,1]=3 2514 B4R0.1 C=CC([O-])=O Amb22733713 [2,0,0,0,0,0|0,0,1]=3 2515 B4R0.1 C=C[13C](N)=O Amb22350706 [2,0,0,0,0,0|1,0,0]=3 2516 B4R0.1 C=C[13C](O)=O Amb22351199 [2,0,0,0,0,0|0,0,0]=2 2517 B4R0.1 C=NC(N)=O Amb25267386 [2,0,0,0,0,0|2,0,0]=4 2518 B4R0.1 CB(C)CO Amb24477462 [2,0,0,0,0,0|1,0,1]=4 2519 B4R0.1 CC(=C)C#C Amb1101959 [2,0,0,0,0,0|0,0,2]=4 2520 B4R0.1 CC(=C)C#[15N] Amb22055668 [2,0,0,0,0,0|1,0,1]=4 2521 B4R0.1 CC(=C)C=C Amb22337780 [2,0,0,0,0,0|0,0,1]=3 2522 B4R0.1 CC(=C)CN Amb10071222 [2,0,0,0,0,0|1,0,1]=4 2523 B4R0.1 CC(=C)CN Amb17749039 [2,0,0,0,0,0|1,0,1]=4 2524 B4R0.1 CC(=C)CS Amb19888160 [2,0,0,0,0,0|0,1,1]=4 2525 B4R0.1 CC(=C)C[Pd+] Amb22729504 [2,0,0,0,0,0|1,0,1]=4 2526 B4R0.1 CC(=C)[13CH]=O Amb22055667 [2,0,0,0,0,0|0,0,0]=2 2527 B4R0.1 CC(=C)[Mg]Br Amb22338432 [2,0,0,0,0,0|2,0,0]=4 2528 B4R0.1 CC(=N)CO Amb24478077 [2,0,0,0,0,0|1,0,1]=4 2529 B4R0.1 CC(=N)NO Amb22232230 [2,0,0,0,0,0|2,0,0]=4 2530 B4R0.1 CC(=O)C#N Amb17231798 [2,0,0,0,0,0|1,0,1]=4 2531 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|1,0,1]=4 2532 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,1]=4 2533 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,1]=4 2534 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|1,0,1]=4 2535 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|1,0,1]=4 2536 B4R0.1 CC(=O)N=O Amb25745528 [2,0,0,0,0,0|2,0,0]=4 2537 B4R0.1 CC(=O)NBr Amb17672559 [2,0,0,0,0,0|2,0,0]=4 2538 B4R0.1 CC(=O)NCl Amb17939326 [2,0,0,0,0,0|2,0,0]=4 2539 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 2540 B4R0.1 CC(=O)N[SiH3] Amb25746995 [2,0,0,0,0,0|1,1,0]=4 2541 B4R0.1 CC(=O)OS Amb22168358 [2,0,0,0,0,0|2,0,0]=4 2542 B4R0.1 CC(=O)O[Hg] Amb22732602 [2,0,0,0,0,0|2,0,0]=4 2543 B4R0.1 CC(=S)C=O Amb24477343 [2,0,0,0,0,0|1,0,0]=3 2544 B4R0.1 CC(C)=C=C Amb19930195 [2,0,0,0,0,0|1,0,1]=4 2545 B4R0.1 CC(C)=C=O Amb17672588 [2,0,0,0,0,0|0,0,1]=3 2546 B4R0.1 CC(C)=CCl Amb22338168 [2,0,0,0,0,0|1,0,0]=3 2547 B4R0.1 CC(C)=NN Amb24334355 [2,0,0,0,0,0|2,0,0]=4 2548 B4R0.1 CC(C)=[N+]=[N-] Amb22228798 [2,0,0,0,0,0|2,0,0]=4 2549 B4R0.1 CC(C)C=C Amb17666952 [2,0,0,0,0,0|1,0,1]=4 2550 B4R0.1 CC(C)NO Amb22058701 [2,0,0,0,0,0|1,0,1]=4 2551 B4R0.1 CC(C=O)Cl Amb10603585 [2,0,0,0,0,0|1,0,1]=4 2552 B4R0.1 CC(F)=CCl Amb25663106 [2,0,0,0,0,0|2,0,0]=4 2553 B4R0.1 CC(I)C=O Amb24477178 [2,0,0,0,0,0|1,0,1]=4 2554 B4R0.1 CC(N)=CO Amb24478074 [2,0,0,0,0,0|1,0,0]=3 2555 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|1,0,1]=4 2556 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|1,0,1]=4 2557 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|1,0,1]=4 2558 B4R0.1 CC=C(Br)Br Amb22733606 [2,0,0,0,0,0|2,0,0]=4 2559 B4R0.1 CC=C(F)F Amb10840482 [2,0,0,0,0,0|2,0,0]=4 2560 B4R0.1 CCC(=C)Br Amb22052658 [2,0,0,0,0,0|1,0,1]=4 2561 B4R0.1 CCC(=C)C Amb10069004 [2,0,0,0,0,0|0,0,1]=3 2562 B4R0.1 CCC(=C)Cl Amb22228725 [2,0,0,0,0,0|1,0,1]=4 2563 B4R0.1 CCC(=C)O Amb22338693 [2,0,0,0,0,0|0,0,2]=4 2564 B4R0.1 CCC(=O)Cl Amb22338551 [2,0,0,0,0,0|1,0,1]=4 2565 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,1]=4 2566 B4R0.1 CCC(O)=O Amb22363268 [2,0,0,0,0,0|0,0,1]=3 2567 B4R0.1 CCC([O-])=O Amb17942918 [2,0,0,0,0,0|0,0,2]=4 2568 B4R0.1 CCC([O-])=O Amb22043363 [2,0,0,0,0,0|0,0,2]=4 2569 B4R0.1 CCC([O-])=O Amb22053980 [2,0,0,0,0,0|0,0,2]=4 2570 B4R0.1 CCC([O-])=O Amb22353324 [2,0,0,0,0,0|0,0,2]=4 2571 B4R0.1 CCC([O-])=O Amb22730265 [2,0,0,0,0,0|0,0,2]=4 2572 B4R0.1 CCC([O-])=O Amb22731204 [2,0,0,0,0,0|0,0,2]=4 2573 B4R0.1 CCC([O-])=O Amb22732964 [2,0,0,0,0,0|0,0,2]=4 2574 B4R0.1 CCC([O-])=O Amb22733966 [2,0,0,0,0,0|0,0,2]=4 2575 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|1,0,1]=4 2576 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|1,0,1]=4 2577 B4R0.1 CCS(O)=O Amb24332177 [2,0,0,0,0,0|1,0,1]=4 2578 B4R0.1 CC[13C](O)=O Amb22336570 [2,0,0,0,0,0|0,0,1]=3 2579 B4R0.1 CC[13C](O)=O Amb22732548 [2,0,0,0,0,0|0,0,1]=3 2580 B4R0.1 CC[13C]([O-])=O Amb22363364 [2,0,0,0,0,0|0,0,2]=4 2581 B4R0.1 CN(C)=CBr Amb22336345 [2,0,0,0,0,0|2,0,0]=4 2582 B4R0.1 CN(C)C=C Amb25244447 [2,0,0,0,0,0|2,0,0]=4 2583 B4R0.1 CN(C)C=O Amb22168323 [2,0,0,0,0,0|1,0,0]=3 2584 B4R0.1 CN(C)CO Amb17673884 [2,0,0,0,0,0|1,0,1]=4 2585 B4R0.1 CN(C)N=O Amb17938637 [2,0,0,0,0,0|2,0,0]=4 2586 B4R0.1 CN(C)[13CH]=O Amb22363163 [2,0,0,0,0,0|1,0,0]=3 2587 B4R0.1 CN(C=O)N Amb10843911 [2,0,0,0,0,0|2,0,0]=4 2588 B4R0.1 CN=C(C)C Amb24449148 [2,0,0,0,0,0|1,0,1]=4 2589 B4R0.1 CNC(=O)Br Amb25764660 [2,0,0,0,0,0|2,0,0]=4 2590 B4R0.1 CNC(=O)N Amb1152075 [2,0,0,0,0,0|2,0,0]=4 2591 B4R0.1 CNC(C)=S Amb23590663 [2,0,0,0,0,0|1,1,0]=4 2592 B4R0.1 CNC(C)O Amb24726970 [2,0,0,0,0,0|1,0,1]=4 2593 B4R0.1 CNC(Cl)=O Amb17942998 [2,0,0,0,0,0|2,0,0]=4 2594 B4R0.1 CNC(N)=O Amb22899158 [2,0,0,0,0,0|2,0,0]=4 2595 B4R0.1 CNC(O)=S Amb25747283 [2,0,0,0,0,0|1,1,0]=4 2596 B4R0.1 CNS(C)=O Amb24626150 [2,0,0,0,0,0|2,0,0]=4 2597 B4R0.1 COC(=N)C Amb10844798 [2,0,0,0,0,0|2,0,0]=4 2598 B4R0.1 COC(C)=S Amb23554940 [2,0,0,0,0,0|1,1,0]=4 2599 B4R0.1 COC(C)O Amb24376229 [2,0,0,0,0,0|1,0,1]=4 2600 B4R0.1 COC([O-])=O Amb22731820 [2,0,0,0,0,0|1,0,1]=4 2601 B4R0.1 COC([O-])=O Amb25688001 [2,0,0,0,0,0|1,0,1]=4 2602 B4R0.1 COP(C)=O Amb25278680 [2,0,0,0,0,0|2,0,0]=4 2603 B4R0.1 COP(C)O Amb24410264 [2,0,0,0,0,0|2,0,0]=4 2604 B4R0.1 CP(C)CO Amb24430966 [2,0,0,0,0,0|1,0,1]=4 2605 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 2606 B4R0.1 CSC(C)=O Amb22043188 [2,0,0,0,0,0|1,0,0]=3 2607 B4R0.1 CSC(C)O Amb25266788 [2,0,0,0,0,0|1,0,1]=4 2608 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 2609 B4R0.1 CSS(C)=O Amb25786159 [2,0,0,0,0,0|2,0,0]=4 2610 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [2,0,0,0,0,0|0,0,2]=4 2611 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [2,0,0,0,0,0|0,0,2]=4 2612 B4R0.1 C[14C](=O)O[Na] Amb22350228 [2,0,0,0,0,0|2,0,0]=4 2613 B4R0.1 C[15N](C)C=O Amb22338371 [2,0,0,0,0,0|1,0,0]=3 2614 B4R0.1 C[C@@H](N)C=O Amb25090862 [2,0,0,0,0,0|1,0,1]=4 2615 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|1,0,1]=4 2616 B4R0.1 C[C@H](O)C=O Amb24452140 [2,0,0,0,0,0|1,0,1]=4 2617 B4R0.1 C[N+](C)=CBr Amb22730803 [2,0,0,0,0,0|2,0,0]=4 2618 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|1,0,0]=3 2619 B4R0.1 C[SiH](C)C=C Amb25226815 [2,0,0,0,0,0|1,1,0]=4 2620 B4R0.1 C[SiH](C)CO Amb25058422 [2,0,0,0,0,0|0,1,1]=4 2621 B4R0.1 C\C(=C\Cl)\F Amb10838560 [2,0,0,0,0,0|2,0,0]=4 2622 B4R0.1 C\C(=N\O)\N Amb10610482 [2,0,0,0,0,0|2,0,0]=4 2623 B4R0.1 C\C(\Br)=C/Br Amb22730991 [2,0,0,0,0,0|2,0,0]=4 2624 B4R0.1 C\C(\Br)=C/F Amb24088815 [2,0,0,0,0,0|2,0,0]=4 2625 B4R0.1 C\C(\Cl)=C/Cl Amb24077348 [2,0,0,0,0,0|2,0,0]=4 2626 B4R0.1 C\C(\O)=N\O Amb22492489 [2,0,0,0,0,0|2,0,0]=4 2627 B4R0.1 C\C=C(/C)\Br Amb21953703 [2,0,0,0,0,0|1,0,0]=3 2628 B4R0.1 C\C=C(/C)\Cl Amb25025045 [2,0,0,0,0,0|1,0,0]=3 2629 B4R0.1 C\C=C(\C)/Br Amb20001493 [2,0,0,0,0,0|1,0,0]=3 2630 B4R0.1 C\C=C(\C)/Cl Amb22731715 [2,0,0,0,0,0|1,0,0]=3 2631 B4R0.1 C\C=C(\Cl)/Br Amb24640149 [2,0,0,0,0,0|2,0,0]=4 2632 B4R0.1 ClC(=O)C=C Amb17942845 [2,0,0,0,0,0|1,0,0]=3 2633 B4R0.1 NC(=O)C=N Amb24460788 [2,0,0,0,0,0|2,0,0]=4 2634 B4R0.1 NC(S)=CO Amb25173804 [2,0,0,0,0,0|2,0,0]=4 2635 B4R0.1 NCC(O)=O Amb22274145 [2,0,0,0,0,0|1,0,1]=4 2636 B4R0.1 NCC(O)=O Amb22731925 [2,0,0,0,0,0|1,0,1]=4 2637 B4R0.1 NC[13C](O)=O Amb22354047 [2,0,0,0,0,0|1,0,1]=4 2638 B4R0.1 N[13CH2]C(O)=O Amb22363299 [2,0,0,0,0,0|1,0,1]=4 2639 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [2,0,0,0,0,0|1,0,1]=4 2640 B4R0.1 O=CC(=O)S Amb24505852 [2,0,0,0,0,0|1,1,0]=4 2641 B4R0.1 OC(=O)CI Amb1916034 [2,0,0,0,0,0|1,0,1]=4 2642 B4R0.1 OC(=O)CI Amb22274295 [2,0,0,0,0,0|1,0,1]=4 2643 B4R0.1 OC(=O)CI Amb22353096 [2,0,0,0,0,0|1,0,1]=4 2644 B4R0.1 OC(=O)CO Amb22338156 [2,0,0,0,0,0|1,0,1]=4 2645 B4R0.1 OC(=O)CP Amb24476887 [2,0,0,0,0,0|1,0,1]=4 2646 B4R0.1 OC(=O)CS Amb22360787 [2,0,0,0,0,0|1,0,1]=4 2647 B4R0.1 OC(=O)CS Amb24323537 [2,0,0,0,0,0|1,0,1]=4 2648 B4R0.1 OC(=O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 2649 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [2,0,0,0,0,0|1,0,1]=4 2650 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [2,0,0,0,0,0|1,0,1]=4 2651 B4R0.1 OC(=O)[13CH2]I Amb22367368 [2,0,0,0,0,0|1,0,1]=4 2652 B4R0.1 OC(=[18O])CBr Amb22367291 [2,0,0,0,0,0|1,0,1]=4 2653 B4R0.1 OC=C(Br)Br Amb25747016 [2,0,0,0,0,0|2,0,0]=4 2654 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [2,0,0,0,0,0|1,0,1]=4 2655 B4R0.1 O[13C](=O)CBr Amb22351346 [2,0,0,0,0,0|1,0,1]=4 2656 B4R0.1 O[13C](=O)CCl Amb22351545 [2,0,0,0,0,0|1,0,1]=4 2657 B4R0.1 O[13C](=O)CI Amb22367367 [2,0,0,0,0,0|1,0,1]=4 2658 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [2,0,0,0,0,0|1,0,1]=4 2659 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [2,0,0,0,0,0|1,0,1]=4 2660 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [2,0,0,0,0,0|1,0,1]=4 2661 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [2,0,0,0,0,0|1,0,0]=3 2662 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [2,0,0,0,0,0|0,0,0]=2 2663 B4R0.1 O[13C](=[18O])CBr Amb22337237 [2,0,0,0,0,0|1,0,1]=4 2664 B4R0.1 O[14C](=O)CBr Amb22731740 [2,0,0,0,0,0|1,0,1]=4 2665 B4R0.1 O[14C](=O)O[Na] Amb22350243 [2,0,0,0,0,0|2,0,0]=4 2666 B4R0.1 [13CH2]=[13CH][13C](N)=O Amb22367442 [2,0,0,0,0,0|1,0,0]=3 2667 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [2,0,0,0,0,0|0,0,2]=4 2668 B4R0.1 [13CH3]N([13CH3])C=O Amb22353459 [2,0,0,0,0,0|1,0,0]=3 2669 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [2,0,0,0,0,0|0,0,1]=3 2670 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [2,0,0,0,0,0|0,0,1]=3 2671 B4R0.1 [13CH3][13CH]([13CH3])[13CH2]O Amb22338875 [2,0,0,0,0,0|0,0,2]=4 2672 B4R0.1 [14CH3]C(=O)O[Na] Amb22349811 [2,0,0,0,0,0|2,0,0]=4 2673 B4R0.1 [15NH2]CC(O)=O Amb22337980 [2,0,0,0,0,0|1,0,1]=4 2674 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [2,0,0,0,0,0|1,0,1]=4 2675 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [2,0,0,0,0,0|1,0,1]=4 2676 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [2,0,0,0,0,0|1,0,1]=4 2677 B4R0.1 [BH3-]OC(C)=O Amb24625387 [2,0,0,0,0,0|2,0,0]=4 2678 B4R0.1 [Na]OC(=O)C Amb10552368 [2,0,0,0,0,0|2,0,0]=4 2679 B4R0.1 [O-]C(=O)C=C Amb17942810 [2,0,0,0,0,0|0,0,1]=3 2680 B4R0.1 [O-]C(=O)C=O Amb22349677 [2,0,0,0,0,0|1,0,1]=4 2681 B4R0.1 [O-]C(=O)C=O Amb22359884 [2,0,0,0,0,0|1,0,1]=4 2682 B4R0.1 [O-]C(=O)CC Amb10844614 [2,0,0,0,0,0|0,0,2]=4 2683 B4R0.1 [O-][N+](=O)C=C Amb13883663 [2,0,0,0,0,0|1,0,1]=4 2684 B4R0.2 C/C=C/C=C Amb17772326 [2,0,0,0,0,0|1,0,0]=3 2685 B4R0.2 C=C=CC=O Amb25662437 [2,0,0,0,0,0|0,0,2]=4 2686 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 2687 B4R0.2 C=CNC=O Amb10844823 [2,0,0,0,0,0|1,0,1]=4 2688 B4R0.2 C=COC=O Amb22734253 [2,0,0,0,0,0|1,0,1]=4 2689 B4R0.2 C=C\C=C\I Amb25025292 [2,0,0,0,0,0|1,0,1]=4 2690 B4R0.2 C=C\C=C\[PH3+] Amb24623691 [2,0,0,0,0,0|1,0,1]=4 2691 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 2692 B4R0.2 CC=C=CBr Amb17670638 [2,0,0,0,0,0|1,0,1]=4 2693 B4R0.2 CC=C=CC Amb17670597 [2,0,0,0,0,0|1,0,1]=4 2694 B4R0.2 CC=C=CCl Amb17670634 [2,0,0,0,0,0|1,0,1]=4 2695 B4R0.2 CC=C=CI Amb17673291 [2,0,0,0,0,0|1,0,1]=4 2696 B4R0.2 CC=CC#C Amb22056026 [2,0,0,0,0,0|1,0,1]=4 2697 B4R0.2 CC=COC Amb22552518 [2,0,0,0,0,0|2,0,0]=4 2698 B4R0.2 CC=C[Mg]Br Amb22353444 [2,0,0,0,0,0|2,0,0]=4 2699 B4R0.2 CCC=CCl Amb22227554 [2,0,0,0,0,0|1,0,1]=4 2700 B4R0.2 CCC=NO Amb24369620 [2,0,0,0,0,0|1,0,1]=4 2701 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,1]=4 2702 B4R0.2 CCO[13CH]=O Amb22351501 [2,0,0,0,0,0|1,0,1]=4 2703 B4R0.2 CC\C=C\Br Amb22002685 [2,0,0,0,0,0|1,0,1]=4 2704 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 2705 B4R0.2 CC\C=C\N Amb25188893 [2,0,0,0,0,0|1,0,1]=4 2706 B4R0.2 CC\C=N\O Amb24333315 [2,0,0,0,0,0|1,0,1]=4 2707 B4R0.2 CN\C=N/O Amb24333049 [2,0,0,0,0,0|2,0,0]=4 2708 B4R0.2 CO\C=C\Cl Amb24696330 [2,0,0,0,0,0|2,0,0]=4 2709 B4R0.2 C\C=C/C=C Amb22731863 [2,0,0,0,0,0|1,0,0]=3 2710 B4R0.2 C\C=C/C=C Amb24477227 [2,0,0,0,0,0|1,0,0]=3 2711 B4R0.2 C\C=C/CO Amb24089436 [2,0,0,0,0,0|0,0,1]=3 2712 B4R0.2 C\C=C\C#C Amb24763508 [2,0,0,0,0,0|1,0,1]=4 2713 B4R0.2 C\C=C\CC Amb22730891 [2,0,0,0,0,0|1,0,1]=4 2714 B4R0.2 C\C=C\CN Amb22490422 [2,0,0,0,0,0|1,0,1]=4 2715 B4R0.2 C\C=C\CS Amb24476237 [2,0,0,0,0,0|0,1,1]=4 2716 B4R0.2 C\C=C\OC Amb25747348 [2,0,0,0,0,0|2,0,0]=4 2717 B4R0.2 C\C=C\[Mg]Br Amb22729922 [2,0,0,0,0,0|2,0,0]=4 2718 B4R0.2 Cl\C=C\C=O Amb17593041 [2,0,0,0,0,0|1,0,0]=3 2719 B4R0.2 N\C=C/C=O Amb25246630 [2,0,0,0,0,0|1,0,0]=3 2720 B4R0.2 N\C=C\C=N Amb25784879 [2,0,0,0,0,0|2,0,0]=4 2721 B4R0.2 N\C=C\C=O Amb24596377 [2,0,0,0,0,0|1,0,0]=3 2722 B4R0.2 O=CC=C=S Amb25112137 [2,0,0,0,0,0|1,0,1]=4 2723 B4R0.2 O=CNC=O Amb25721263 [2,0,0,0,0,0|2,0,0]=4 2724 B4R0.2 O=C\C=C/Cl Amb25222856 [2,0,0,0,0,0|1,0,0]=3 2725 B4R0.2 O=C\C=C/S Amb24477332 [2,0,0,0,0,0|1,0,0]=3 2726 B4R0.2 O=C\C=C\Br Amb24477124 [2,0,0,0,0,0|1,0,0]=3 2727 B4R0.2 O=C\C=C\I Amb24477297 [2,0,0,0,0,0|1,0,0]=3 2728 B4R0.2 O=C\C=C\P Amb24670391 [2,0,0,0,0,0|1,0,0]=3 2729 B4R0.2 O=C\C=C\S Amb24756696 [2,0,0,0,0,0|1,0,0]=3 2730 B4R0.2 OC=C=CO Amb24412119 [2,0,0,0,0,0|1,0,1]=4 2731 B4R0.2 OC\C=C/I Amb23539305 [2,0,0,0,0,0|1,0,1]=4 2732 B4R0.2 OC\C=C\I Amb24642752 [2,0,0,0,0,0|1,0,1]=4 2733 B4R0.2 ON=CC=O Amb25746308 [2,0,0,0,0,0|2,0,0]=4 2734 B4R0.2 O\C=C/C=O Amb24567056 [2,0,0,0,0,0|1,0,0]=3 2735 B4R0.2 O\C=C/CCl Amb22338049 [2,0,0,0,0,0|1,0,1]=4 2736 B4R0.2 O\C=C\C=S Amb25057743 [2,0,0,0,0,0|1,0,0]=3 2737 B6R0.1 C/C(CO)=C\C=C Amb17843900 [1,1,0,0,0,0|1,0,1]=4 2738 B6R0.1 C=CC(=O)\C=C/Cl Amb24619851 [1,1,0,0,0,0|2,0,0]=4 2739 B6R0.1 C=CC(=O)\C=C\Br Amb24655019 [1,1,0,0,0,0|2,0,0]=4 2740 B6R0.1 C=CNC(=O)NO Amb25339032 [1,1,0,0,0,0|1,0,1]=4 2741 B6R0.1 C=C\C=C(/Br)\C=O Amb25277164 [1,1,0,0,0,0|1,0,1]=4 2742 B6R0.1 C=C\C=C(\Br)/C=O Amb18126250 [1,1,0,0,0,0|1,0,1]=4 2743 B6R0.1 CC(CO)=CC=N Amb25057805 [1,1,0,0,0,0|2,0,0]=4 2744 B6R0.1 CC=CC(O)CC Amb22228839 [1,1,0,0,0,0|1,0,1]=4 2745 B6R0.1 CCC(=O)\C=C/N Amb24625829 [1,1,0,0,0,0|2,0,0]=4 2746 B6R0.1 CCC(=O)\C=C\Br Amb25286103 [1,1,0,0,0,0|2,0,0]=4 2747 B6R0.1 CCC(=O)\C=C\Cl Amb17593220 [1,1,0,0,0,0|2,0,0]=4 2748 B6R0.1 CCC(=O)\C=C\O Amb25326651 [1,1,0,0,0,0|2,0,0]=4 2749 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,2]=4 2750 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [1,1,0,0,0,0|0,0,2]=4 2751 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,1]=4 2752 B6R0.1 CCNC(=O)ON Amb25108031 [1,1,0,0,0,0|1,0,1]=4 2753 B6R0.1 CC\C=C(/Br)\C=O Amb25278288 [1,1,0,0,0,0|1,0,1]=4 2754 B6R0.1 CC\C=C(/C)\CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 2755 B6R0.1 CC\C=C(/F)\C=O Amb25122538 [1,1,0,0,0,0|1,0,1]=4 2756 B6R0.1 CC\C=C(\Br)/C=O Amb18645748 [1,1,0,0,0,0|1,0,1]=4 2757 B6R0.1 CC\C=C(\C)/CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 2758 B6R0.1 CC\C=C(\Cl)/C=O Amb18640561 [1,1,0,0,0,0|1,0,1]=4 2759 B6R0.1 CC\C=C(\F)/CO Amb25692315 [1,1,0,0,0,0|1,0,1]=4 2760 B6R0.1 CNC(=O)C=NC Amb25833118 [1,1,0,0,0,0|2,0,0]=4 2761 B6R0.1 CNC(=O)\C=C/Cl Amb25082264 [1,1,0,0,0,0|2,0,0]=4 2762 B6R0.1 CNC(=O)\C=C\Cl Amb25244140 [1,1,0,0,0,0|2,0,0]=4 2763 B6R0.1 CNCC(=O)NO Amb24640961 [1,1,0,0,0,0|1,0,1]=4 2764 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,1]=4 2765 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,1]=4 2766 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 2767 B6R0.1 CN\C=C(\C)/C=O Amb24641474 [1,1,0,0,0,0|2,0,0]=4 2768 B6R0.1 COC(=C)\C=C\Cl Amb24467764 [1,1,0,0,0,0|2,0,0]=4 2769 B6R0.1 COC(=O)C=C=C Amb24478408 [1,1,0,0,0,0|0,0,2]=4 2770 B6R0.1 COC(=O)C=[N+]=[N-] Amb25746091 [1,1,0,0,0,0|2,0,0]=4 2771 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 2772 B6R0.1 COC(=O)NC=C Amb24479688 [1,1,0,0,0,0|1,0,1]=4 2773 B6R0.1 COC(=O)NC=O Amb20242244 [1,1,0,0,0,0|2,0,0]=4 2774 B6R0.1 COC(=O)NOC Amb24480502 [1,1,0,0,0,0|2,0,0]=4 2775 B6R0.1 COC(=O)OCC Amb22732530 [1,1,0,0,0,0|1,0,1]=4 2776 B6R0.1 COC(=O)\C=C/Br Amb10067501 [1,1,0,0,0,0|1,0,0]=3 2777 B6R0.1 COC(=O)\C=C/I Amb2455616 [1,1,0,0,0,0|1,0,0]=3 2778 B6R0.1 COC(=O)\C=C\Br Amb24641633 [1,1,0,0,0,0|1,0,0]=3 2779 B6R0.1 COC(=O)\C=C\I Amb20241347 [1,1,0,0,0,0|1,0,0]=3 2780 B6R0.1 COC(=O)\C=C\S Amb25680634 [1,1,0,0,0,0|1,0,0]=3 2781 B6R0.1 COC(C)=CC=O Amb25328678 [1,1,0,0,0,0|2,0,0]=4 2782 B6R0.1 COCC(=O)CO Amb24364722 [1,1,0,0,0,0|1,0,1]=4 2783 B6R0.1 COCC(=O)O[Na] Amb2227682 [1,1,0,0,0,0|1,0,1]=4 2784 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [1,1,0,0,0,0|1,0,1]=4 2785 B6R0.1 CO\C(\C)=C/C=O Amb25326199 [1,1,0,0,0,0|2,0,0]=4 2786 B6R0.1 CO\C(\C)=C\C=O Amb18121410 [1,1,0,0,0,0|2,0,0]=4 2787 B6R0.1 CO\C=C(/F)\CO Amb22546782 [1,1,0,0,0,0|2,0,0]=4 2788 B6R0.1 CO\C=C(\C)/C=O Amb25358935 [1,1,0,0,0,0|2,0,0]=4 2789 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,1]=4 2790 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,1]=4 2791 B6R0.1 C\C(\C=O)=C/C=C Amb24559820 [1,1,0,0,0,0|1,0,1]=4 2792 B6R0.1 C\C(\C=O)=C\C=C Amb18638851 [1,1,0,0,0,0|1,0,1]=4 2793 B6R0.1 C\C(\C=O)=C\CC Amb18120867 [1,1,0,0,0,0|1,0,1]=4 2794 B6R0.1 C\C(\CO)=C/C=O Amb24417925 [1,1,0,0,0,0|2,0,0]=4 2795 B6R0.1 C\C(\CO)=C\C=C Amb25229626 [1,1,0,0,0,0|1,0,1]=4 2796 B6R0.1 C\C=C(/C)\C=C\C Amb22731156 [1,1,0,0,0,0|2,0,0]=4 2797 B6R0.1 C\C=C/C(/C)=C\Cl Amb24425554 [1,1,0,0,0,0|2,0,0]=4 2798 B6R0.1 C\C=C/C(=O)CO Amb24530239 [1,1,0,0,0,0|0,0,0]=2 2799 B6R0.1 C\C=C/C(O)CBr Amb24333663 [1,1,0,0,0,0|1,0,1]=4 2800 B6R0.1 C\C=C\C(=C)OC Amb25333090 [1,1,0,0,0,0|1,0,0]=3 2801 B6R0.1 C\C=C\C(=N)NO Amb25024615 [1,1,0,0,0,0|1,0,0]=3 2802 B6R0.1 C\C=C\C(=O)C=C Amb25745529 [1,1,0,0,0,0|1,0,0]=3 2803 B6R0.1 C\C=C\C(=O)CO Amb24633379 [1,1,0,0,0,0|0,0,0]=2 2804 B6R0.1 C\C=C\C(=O)NC Amb25067932 [1,1,0,0,0,0|1,0,0]=3 2805 B6R0.1 C\C=C\C(=O)NN Amb25796185 [1,1,0,0,0,0|1,0,0]=3 2806 B6R0.1 C\C=C\C(=O)NO Amb25076258 [1,1,0,0,0,0|0,0,0]=2 2807 B6R0.1 C\C=C\C(Cl)=CBr Amb25179235 [1,1,0,0,0,0|2,0,0]=4 2808 B6R0.1 C\C=C\C(N)CO Amb25702422 [1,1,0,0,0,0|1,0,1]=4 2809 B6R0.1 C\C=C\C(O)C=C Amb24684907 [1,1,0,0,0,0|1,0,1]=4 2810 B6R0.1 C\C=C\C(O)CBr Amb25201492 [1,1,0,0,0,0|1,0,1]=4 2811 B6R0.1 C\C=C\C(O)CC Amb22731799 [1,1,0,0,0,0|1,0,1]=4 2812 B6R0.1 C\C=C\C(O)CN Amb18639704 [1,1,0,0,0,0|1,0,1]=4 2813 B6R0.1 C\C=C\[C@@H](O)C#N Amb24581212 [1,1,0,0,0,0|1,0,1]=4 2814 B6R0.1 C\C=C\[C@H](C)CO Amb25381306 [1,1,0,0,0,0|1,0,1]=4 2815 B6R0.1 C\C=C\[C@H](O)C#C Amb24332911 [1,1,0,0,0,0|1,0,1]=4 2816 B6R0.1 ClC=CC(=O)CCl Amb13952715 [1,1,0,0,0,0|2,0,0]=4 2817 B6R0.1 O=C(CCl)\C=C\Br Amb24595386 [1,1,0,0,0,0|2,0,0]=4 2818 B6R0.1 O=C(CCl)\C=C\Cl Amb20620940 [1,1,0,0,0,0|2,0,0]=4 2819 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,1,0,0,0,0|0,0,2]=4 2820 B6R0.2 CC(=C)CC(=O)C Amb17593075 [1,1,0,0,0,0|1,0,1]=4 2821 B6R0.2 CC(=CC(=O)N)C Amb10561758 [1,1,0,0,0,0|1,0,0]=3 2822 B6R0.2 CC(=CC(=O)O)C Amb1485519 [1,1,0,0,0,0|0,0,0]=2 2823 B6R0.2 CC(=N)C=C(C)N Amb25339858 [1,1,0,0,0,0|2,0,0]=4 2824 B6R0.2 CC(=N)CC(N)=O Amb25259783 [1,1,0,0,0,0|1,0,1]=4 2825 B6R0.2 CC(=O)C=S(C)C Amb25370005 [1,1,0,0,0,0|2,0,0]=4 2826 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [1,1,0,0,0,0|1,0,1]=4 2827 B6R0.2 CC(=O)CC(C)=N Amb22345922 [1,1,0,0,0,0|1,0,1]=4 2828 B6R0.2 CC(=O)CC(C)=O Amb22727963 [1,1,0,0,0,0|1,0,1]=4 2829 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,1,0,0,0,0|0,0,1]=3 2830 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,1,0,0,0,0|0,1,1]=4 2831 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [1,1,0,0,0,0|0,0,2]=4 2832 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22045487 [1,1,0,0,0,0|1,0,0]=3 2833 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22053694 [1,1,0,0,0,0|1,0,0]=3 2834 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22054021 [1,1,0,0,0,0|1,0,0]=3 2835 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730050 [1,1,0,0,0,0|1,0,0]=3 2836 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730391 [1,1,0,0,0,0|1,0,0]=3 2837 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22733055 [1,1,0,0,0,0|1,0,0]=3 2838 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734591 [1,1,0,0,0,0|1,0,0]=3 2839 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734615 [1,1,0,0,0,0|1,0,0]=3 2840 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734932 [1,1,0,0,0,0|1,0,0]=3 2841 B6R0.2 CC(=S)C=C(C)O Amb24518407 [1,1,0,0,0,0|1,0,0]=3 2842 B6R0.2 CC(=S)CC(N)=O Amb24479846 [1,1,0,0,0,0|1,0,1]=4 2843 B6R0.2 CC(=S)\C=C(\C)/N Amb24332649 [1,1,0,0,0,0|1,1,0]=4 2844 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [1,1,0,0,0,0|0,0,0]=2 2845 B6R0.2 CC(C)=CC(N)=N Amb24677991 [1,1,0,0,0,0|2,0,0]=4 2846 B6R0.2 CC(C)=CC(N)=S Amb18108367 [1,1,0,0,0,0|1,1,0]=4 2847 B6R0.2 CC(C)=C[N+]([O-])=O Amb22167019 [1,1,0,0,0,0|1,0,1]=4 2848 B6R0.2 CC(C)=NC(N)=O Amb24682478 [1,1,0,0,0,0|2,0,0]=4 2849 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,1,0,0,0,0|0,0,2]=4 2850 B6R0.2 CC(Cl)=CC(N)=O Amb24567853 [1,1,0,0,0,0|1,0,0]=3 2851 B6R0.2 CC(F)=CC(O)=O Amb24676595 [1,1,0,0,0,0|0,0,0]=2 2852 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,1,0,0,0,0|0,0,2]=4 2853 B6R0.2 CC(I)=CC(O)=O Amb24668934 [1,1,0,0,0,0|0,0,0]=2 2854 B6R0.2 CC(N)=CC(N)=S Amb24097463 [1,1,0,0,0,0|1,1,0]=4 2855 B6R0.2 CC(N)=CC(O)=O Amb25856437 [1,1,0,0,0,0|0,0,0]=2 2856 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,1,0,0,0,0|0,0,2]=4 2857 B6R0.2 CC(O)=CC(O)O Amb24431523 [1,1,0,0,0,0|0,0,2]=4 2858 B6R0.2 CC(O)C=C(C)C Amb22229846 [1,1,0,0,0,0|1,0,1]=4 2859 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,1,0,0,0,0|0,0,2]=4 2860 B6R0.2 CC(O)\C=C(\C)/S Amb25800756 [1,1,0,0,0,0|1,0,1]=4 2861 B6R0.2 CC(S)=CC(C)=O Amb24611600 [1,1,0,0,0,0|1,0,0]=3 2862 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,1,0,0,0,0|0,0,2]=4 2863 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,1,0,0,0,0|1,0,1]=4 2864 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,1,0,0,0,0|1,0,1]=4 2865 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,1,0,0,0,0|1,0,1]=4 2866 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,1,0,0,0,0|1,0,1]=4 2867 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,1,0,0,0,0|1,0,1]=4 2868 B6R0.2 CS(C)=CC(O)=O Amb25717234 [1,1,0,0,0,0|1,0,0]=3 2869 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [1,1,0,0,0,0|2,0,0]=4 2870 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,1,0,0,0,0|0,0,2]=4 2871 B6R0.2 C[C@@H](O)C=C(C)C Amb25700154 [1,1,0,0,0,0|1,0,1]=4 2872 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,1,0,0,0,0|0,0,2]=4 2873 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,1,0,0,0,0|0,0,2]=4 2874 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,1,0,0,0,0|0,0,2]=4 2875 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,1,0,0,0,0|0,0,2]=4 2876 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,1,0,0,0,0|0,0,2]=4 2877 B6R0.2 C[C@H](O)C=C(C)C Amb24734239 [1,1,0,0,0,0|1,0,1]=4 2878 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,1,0,0,0,0|0,0,2]=4 2879 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,1,0,0,0,0|0,0,2]=4 2880 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,1,0,0,0,0|1,0,1]=4 2881 B6R0.2 C\C(=C/C(=O)C)\N Amb1149988 [1,1,0,0,0,0|1,0,0]=3 2882 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [1,1,0,0,0,0|0,0,0]=2 2883 B6R0.2 C\C(\Cl)=C/C(C)=O Amb25795658 [1,1,0,0,0,0|1,0,0]=3 2884 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [1,1,0,0,0,0|0,0,0]=2 2885 B6R0.2 C\C(\Cl)=C\C(N)=O Amb24714532 [1,1,0,0,0,0|1,0,0]=3 2886 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [1,1,0,0,0,0|0,0,0]=2 2887 B6R0.2 C\C(\F)=C/C(C)=O Amb24614698 [1,1,0,0,0,0|1,0,0]=3 2888 B6R0.2 C\C(\F)=C\C(C)=O Amb25717786 [1,1,0,0,0,0|1,0,0]=3 2889 B6R0.2 C\C(\I)=C/C(N)=O Amb25378941 [1,1,0,0,0,0|1,0,0]=3 2890 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [1,1,0,0,0,0|0,0,0]=2 2891 B6R0.2 C\C(\N)=C\C(N)=O Amb22002462 [1,1,0,0,0,0|1,0,0]=3 2892 B6R0.2 C\C(\N)=C\C(N)=S Amb19929130 [1,1,0,0,0,0|1,1,0]=4 2893 B6R0.2 C\C(\N)=C\[N+]([O-])=O Amb21953595 [1,1,0,0,0,0|1,0,1]=4 2894 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [1,1,0,0,0,0|1,0,0]=3 2895 B6R0.2 C\C(\[O-])=C/C(C)=O Amb19894693 [1,1,0,0,0,0|1,0,0]=3 2896 B6R0.2 C\C(\[O-])=C\C(C)=O Amb19959976 [1,1,0,0,0,0|1,0,0]=3 2897 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239360 [1,1,0,0,0,0|1,0,0]=3 2898 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239373 [1,1,0,0,0,0|1,0,0]=3 2899 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239374 [1,1,0,0,0,0|1,0,0]=3 2900 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239443 [1,1,0,0,0,0|1,0,0]=3 2901 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20246565 [1,1,0,0,0,0|1,0,0]=3 2902 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045337 [1,1,0,0,0,0|1,0,0]=3 2903 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045339 [1,1,0,0,0,0|1,0,0]=3 2904 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045350 [1,1,0,0,0,0|1,0,0]=3 2905 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045370 [1,1,0,0,0,0|1,0,0]=3 2906 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045376 [1,1,0,0,0,0|1,0,0]=3 2907 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045378 [1,1,0,0,0,0|1,0,0]=3 2908 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045379 [1,1,0,0,0,0|1,0,0]=3 2909 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045386 [1,1,0,0,0,0|1,0,0]=3 2910 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045388 [1,1,0,0,0,0|1,0,0]=3 2911 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045392 [1,1,0,0,0,0|1,0,0]=3 2912 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045393 [1,1,0,0,0,0|1,0,0]=3 2913 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045408 [1,1,0,0,0,0|1,0,0]=3 2914 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045419 [1,1,0,0,0,0|1,0,0]=3 2915 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045578 [1,1,0,0,0,0|1,0,0]=3 2916 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045602 [1,1,0,0,0,0|1,0,0]=3 2917 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045712 [1,1,0,0,0,0|1,0,0]=3 2918 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045835 [1,1,0,0,0,0|1,0,0]=3 2919 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045854 [1,1,0,0,0,0|1,0,0]=3 2920 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045869 [1,1,0,0,0,0|1,0,0]=3 2921 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22052617 [1,1,0,0,0,0|1,0,0]=3 2922 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053071 [1,1,0,0,0,0|1,0,0]=3 2923 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053499 [1,1,0,0,0,0|1,0,0]=3 2924 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053500 [1,1,0,0,0,0|1,0,0]=3 2925 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053502 [1,1,0,0,0,0|1,0,0]=3 2926 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053503 [1,1,0,0,0,0|1,0,0]=3 2927 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053559 [1,1,0,0,0,0|1,0,0]=3 2928 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053596 [1,1,0,0,0,0|1,0,0]=3 2929 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053692 [1,1,0,0,0,0|1,0,0]=3 2930 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053697 [1,1,0,0,0,0|1,0,0]=3 2931 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053737 [1,1,0,0,0,0|1,0,0]=3 2932 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053933 [1,1,0,0,0,0|1,0,0]=3 2933 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053935 [1,1,0,0,0,0|1,0,0]=3 2934 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053939 [1,1,0,0,0,0|1,0,0]=3 2935 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053940 [1,1,0,0,0,0|1,0,0]=3 2936 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053954 [1,1,0,0,0,0|1,0,0]=3 2937 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054002 [1,1,0,0,0,0|1,0,0]=3 2938 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054020 [1,1,0,0,0,0|1,0,0]=3 2939 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054022 [1,1,0,0,0,0|1,0,0]=3 2940 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054119 [1,1,0,0,0,0|1,0,0]=3 2941 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22466635 [1,1,0,0,0,0|1,0,0]=3 2942 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22728947 [1,1,0,0,0,0|1,0,0]=3 2943 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729908 [1,1,0,0,0,0|1,0,0]=3 2944 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729969 [1,1,0,0,0,0|1,0,0]=3 2945 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729970 [1,1,0,0,0,0|1,0,0]=3 2946 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730028 [1,1,0,0,0,0|1,0,0]=3 2947 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730125 [1,1,0,0,0,0|1,0,0]=3 2948 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22731170 [1,1,0,0,0,0|1,0,0]=3 2949 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733289 [1,1,0,0,0,0|1,0,0]=3 2950 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733723 [1,1,0,0,0,0|1,0,0]=3 2951 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22735083 [1,1,0,0,0,0|1,0,0]=3 2952 B6R0.2 C\C(\[O-])=C\[N+]([O-])=O Amb22549288 [1,1,0,0,0,0|1,0,1]=4 2953 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,1,0,0,0,0|1,0,1]=4 2954 B6R0.2 NC(=O)C=C(Cl)Cl Amb25728096 [1,1,0,0,0,0|2,0,0]=4 2955 B6R0.2 O=C(Cl)C=C(Br)Br Amb25026151 [1,1,0,0,0,0|2,0,0]=4 2956 B6R0.2 OB(C=C(C)C)O Amb2455988 [1,1,0,0,0,0|1,0,1]=4 2957 B6R0.2 OC(=O)C=C(Br)Br Amb24435008 [1,1,0,0,0,0|1,0,0]=3 2958 B6R0.2 OC(=O)C=C(F)F Amb24116995 [1,1,0,0,0,0|1,0,0]=3 2959 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,1,0,0,0,0|1,0,1]=4 2960 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,1,0,0,0,0|1,0,1]=4 2961 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,1,0,0,0,0|1,0,1]=4 2962 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,1,0,0,0,0|1,0,1]=4 2963 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,1,0,0,0,0|1,0,1]=4 2964 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,1,0,0,0,0|1,0,1]=4 2965 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,1,0,0,0,0|1,0,1]=4 2966 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [1,1,0,0,0,0|2,0,0]=4 2967 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [1,1,0,0,0,0|2,0,0]=4 2968 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [1,1,0,0,0,0|2,0,0]=4 2969 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,1,0,0,0,0|1,0,1]=4 2970 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [1,1,0,0,0,0|0,0,1]=3 2971 B6R0.4 C=CC#CC(O)=O Amb24479724 [1,1,0,0,0,0|0,0,2]=4 2972 B6R0.4 C=C\C=C\C(N)=O Amb25222345 [1,1,0,0,0,0|1,0,1]=4 2973 B6R0.4 CC#CCC(O)=O Amb17939740 [1,1,0,0,0,0|0,0,2]=4 2974 B6R0.4 CC(=C)\C=C\CBr Amb24544776 [1,1,0,0,0,0|2,0,0]=4 2975 B6R0.4 CC(=O)C=C=CBr Amb25772659 [1,1,0,0,0,0|2,0,0]=4 2976 B6R0.4 CC(=O)C\C=C/Cl Amb25276014 [1,1,0,0,0,0|2,0,0]=4 2977 B6R0.4 CC(=O)C\C=C\Cl Amb25094325 [1,1,0,0,0,0|2,0,0]=4 2978 B6R0.4 CC(=O)N=CCO Amb24420730 [1,1,0,0,0,0|2,0,0]=4 2979 B6R0.4 CC(=O)O\C=C/Cl Amb25190035 [1,1,0,0,0,0|2,0,0]=4 2980 B6R0.4 CC(=O)\C=C/C#C Amb24584422 [1,1,0,0,0,0|1,0,1]=4 2981 B6R0.4 CC(=O)\C=C\C#C Amb25735826 [1,1,0,0,0,0|1,0,1]=4 2982 B6R0.4 CC(=O)\C=C\C#N Amb18638658 [1,1,0,0,0,0|1,0,1]=4 2983 B6R0.4 CC(=O)\C=C\C=N Amb24722970 [1,1,0,0,0,0|1,0,1]=4 2984 B6R0.4 CC(=O)\C=C\C=O Amb18120765 [1,1,0,0,0,0|1,0,1]=4 2985 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,1,0,0,0,0|1,0,0]=3 2986 B6R0.4 CC(=O)\C=C\CO Amb24414835 [1,1,0,0,0,0|1,0,0]=3 2987 B6R0.4 CC(O)\C=C/CN Amb24603728 [1,1,0,0,0,0|1,0,1]=4 2988 B6R0.4 CC(O)\C=C\CCl Amb25311877 [1,1,0,0,0,0|1,0,1]=4 2989 B6R0.4 CC(O)\C=C\CO Amb24671370 [1,1,0,0,0,0|1,0,1]=4 2990 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,1,0,0,0,0|0,0,0]=2 2991 B6R0.4 CC=NNC(N)=O Amb24351023 [1,1,0,0,0,0|2,0,0]=4 2992 B6R0.4 CCC=CB(O)O Amb24078362 [1,1,0,0,0,0|1,0,1]=4 2993 B6R0.4 CCC=CC(C)=O Amb22731698 [1,1,0,0,0,0|1,0,0]=3 2994 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,1,0,0,0,0|0,0,2]=4 2995 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|0,0,2]=4 2996 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|0,0,2]=4 2997 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,1,0,0,0,0|0,0,0]=2 2998 B6R0.4 CC\C=C\B(O)O Amb17610159 [1,1,0,0,0,0|1,0,1]=4 2999 B6R0.4 CC\C=C\C(N)=N Amb24699380 [1,1,0,0,0,0|2,0,0]=4 3000 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,1,0,0,0,0|1,0,0]=3 3001 B6R0.4 CC\C=C\[N+]([O-])=O Amb25190046 [1,1,0,0,0,0|1,0,1]=4 3002 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,1,0,0,0,0|1,0,1]=4 3003 B6R0.4 CN=C=CC(C)=O Amb25233778 [1,1,0,0,0,0|1,0,1]=4 3004 B6R0.4 CN=CCC(C)=O Amb25261368 [1,1,0,0,0,0|1,0,1]=4 3005 B6R0.4 CN=CNC(N)=O Amb24561634 [1,1,0,0,0,0|2,0,0]=4 3006 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|0,0,2]=4 3007 B6R0.4 CNN=CC(C)=O Amb24481082 [1,1,0,0,0,0|2,0,0]=4 3008 B6R0.4 CNNCC(O)=O Amb21929288 [1,1,0,0,0,0|1,0,1]=4 3009 B6R0.4 CNOCC(O)=O Amb25104714 [1,1,0,0,0,0|1,0,1]=4 3010 B6R0.4 CN\C=C/C(C)=O Amb24646447 [1,1,0,0,0,0|1,0,0]=3 3011 B6R0.4 CN\C=C\C(=O)C Amb17593076 [1,1,0,0,0,0|1,0,0]=3 3012 B6R0.4 CN\C=C\C(N)=O Amb24621805 [1,1,0,0,0,0|1,0,0]=3 3013 B6R0.4 CON=CC(C)=O Amb25236948 [1,1,0,0,0,0|2,0,0]=4 3014 B6R0.4 CON=CC(N)=O Amb24719410 [1,1,0,0,0,0|2,0,0]=4 3015 B6R0.4 CON=CC(O)=O Amb25292253 [1,1,0,0,0,0|1,0,0]=3 3016 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [1,1,0,0,0,0|1,0,0]=3 3017 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,1,0,0,0,0|0,0,0]=2 3018 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,0]=3 3019 B6R0.4 CO\N=C\C(N)=O Amb24663668 [1,1,0,0,0,0|2,0,0]=4 3020 B6R0.4 CS(=O)\C=C\CO Amb25794648 [1,1,0,0,0,0|2,0,0]=4 3021 B6R0.4 CSSCC(O)=O Amb25378801 [1,1,0,0,0,0|1,0,1]=4 3022 B6R0.4 CS\C=C\C(C)=O Amb25768455 [1,1,0,0,0,0|1,0,0]=3 3023 B6R0.4 CS\C=C\C(N)=O Amb24507669 [1,1,0,0,0,0|1,0,0]=3 3024 B6R0.4 CS\C=C\C(O)=O Amb18641964 [1,1,0,0,0,0|0,0,0]=2 3025 B6R0.4 C[C@@H](O)\C=C\CO Amb24632440 [1,1,0,0,0,0|1,0,1]=4 3026 B6R0.4 C[C@H](O)\C=C\CCl Amb24377675 [1,1,0,0,0,0|1,0,1]=4 3027 B6R0.4 C[C@H](O)\C=C\CO Amb24333195 [1,1,0,0,0,0|1,0,1]=4 3028 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,1,0,0,0,0|1,0,0]=3 3029 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,1,0,0,0,0|0,0,0]=2 3030 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,1,0,0,0,0|1,0,0]=3 3031 B6R0.4 C\C=C\CC(C)O Amb24480541 [1,1,0,0,0,0|1,0,1]=4 3032 B6R0.4 C\C=C\CC(N)=N Amb25176208 [1,1,0,0,0,0|2,0,0]=4 3033 B6R0.4 C\C=C\CC(N)=S Amb24401512 [1,1,0,0,0,0|1,1,0]=4 3034 B6R0.4 C\C=C\CC(O)O Amb25803009 [1,1,0,0,0,0|0,0,2]=4 3035 B6R0.4 C\C=C\NC(N)=O Amb25340023 [1,1,0,0,0,0|1,0,0]=3 3036 B6R0.4 C\C=C\NC(N)=S Amb20246779 [1,1,0,0,0,0|1,1,0]=4 3037 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,1,0,0,0,0|0,0,1]=3 3038 B6R0.4 FCCCC(=O)O Amb17593104 [1,1,0,0,0,0|0,0,2]=4 3039 B6R0.4 N#C\C=C\C(O)=O Amb25853809 [1,1,0,0,0,0|0,0,1]=3 3040 B6R0.4 N=CNCC(O)=O Amb24670244 [1,1,0,0,0,0|1,0,1]=4 3041 B6R0.4 NC(=O)\C=C\C#N Amb24560908 [1,1,0,0,0,0|1,0,1]=4 3042 B6R0.4 NC(=O)\C=C\C=O Amb24480849 [1,1,0,0,0,0|1,0,1]=4 3043 B6R0.4 NC(=O)\C=C\CBr Amb25109131 [1,1,0,0,0,0|1,0,0]=3 3044 B6R0.4 NC(=O)\C=C\CCl Amb25328319 [1,1,0,0,0,0|1,0,0]=3 3045 B6R0.4 NCC#CC(O)=O Amb25703096 [1,1,0,0,0,0|0,0,2]=4 3046 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|0,0,2]=4 3047 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,1,0,0,0,0|0,0,0]=2 3048 B6R0.4 NC\C=C/P(O)=O Amb22011758 [1,1,0,0,0,0|1,0,0]=3 3049 B6R0.4 NC\C=C\B(O)O Amb25824731 [1,1,0,0,0,0|1,0,1]=4 3050 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,1,0,0,0,0|0,0,0]=2 3051 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,1,0,0,0,0|0,0,0]=2 3052 B6R0.4 NC\C=C\P(O)=O Amb25136979 [1,1,0,0,0,0|1,0,0]=3 3053 B6R0.4 NC\C=C\P(O)O Amb24394427 [1,1,0,0,0,0|1,0,1]=4 3054 B6R0.4 NN\C=C\C(O)=O Amb25849332 [1,1,0,0,0,0|1,0,0]=3 3055 B6R0.4 O=C(Cl)C\C=C\Cl Amb24531407 [1,1,0,0,0,0|2,0,0]=4 3056 B6R0.4 O=C(Cl)\C=C\CBr Amb25747116 [1,1,0,0,0,0|1,0,0]=3 3057 B6R0.4 O=C(Cl)\C=C\CCl Amb24531479 [1,1,0,0,0,0|1,0,0]=3 3058 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|1,0,1]=4 3059 B6R0.4 OB(O)\C=C\CCl Amb22002556 [1,1,0,0,0,0|1,0,1]=4 3060 B6R0.4 OC(=O)CCC=O Amb17673897 [1,1,0,0,0,0|1,0,1]=4 3061 B6R0.4 OC(=O)CCCI Amb22295911 [1,1,0,0,0,0|0,0,2]=4 3062 B6R0.4 OC(=O)CCCP Amb24717184 [1,1,0,0,0,0|0,0,2]=4 3063 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,1,0,0,0,0|1,0,0]=3 3064 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|1,0,0]=3 3065 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,1,0,0,0,0|1,0,0]=3 3066 B6R0.4 OC(=O)\C=C/OI Amb24418427 [1,1,0,0,0,0|1,0,0]=3 3067 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|0,0,0]=2 3068 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|0,0,0]=2 3069 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,1,0,0,0,0|0,0,0]=2 3070 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,1,0,0,0,0|0,0,0]=2 3071 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,1,0,0,0,0|0,0,0]=2 3072 B6R0.4 OC(=O)\C=C\I=O Amb25075597 [1,1,0,0,0,0|1,0,0]=3 3073 B6R0.4 OC(=O)\C=C\OI Amb24655000 [1,1,0,0,0,0|1,0,0]=3 3074 B6R0.4 OCC#CC(O)=O Amb22002375 [1,1,0,0,0,0|0,0,2]=4 3075 B6R0.4 OCCCC(=O)O Amb17615189 [1,1,0,0,0,0|0,0,2]=4 3076 B6R0.4 OCCCC(O)=O Amb18640332 [1,1,0,0,0,0|0,0,2]=4 3077 B6R0.4 OC\C=C\B(O)O Amb25354850 [1,1,0,0,0,0|1,0,1]=4 3078 B6R0.4 ON\C=C\C(O)=O Amb25058383 [1,1,0,0,0,0|1,0,0]=3 3079 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,1,0,0,0,0|0,0,2]=4 3080 B6R0.4 SCCCC(=O)O Amb16185429 [1,1,0,0,0,0|0,0,2]=4 3081 B6R0.5 CC=CS(=O)(=O)Cl Amb20669514 [1,1,0,0,0,0|1,0,1]=4 3082 B6R0.5 C\C=C/P(O)(O)=O Amb22234303 [1,1,0,0,0,0|1,0,0]=3 3083 B6R0.5 C\C=C\C(C)(C)O Amb24699156 [1,1,0,0,0,0|1,0,1]=4 3084 B6R0.5 C\C=C\P(O)(O)=O Amb24480500 [1,1,0,0,0,0|1,0,0]=3 3085 B6R0.5 C\C=C\S(=O)(=O)Cl Amb25763916 [1,1,0,0,0,0|1,0,1]=4 3086 B6R0.5 OS(=O)(=O)\C=C\Cl Amb24478969 [1,1,0,0,0,0|2,0,0]=4 3087 B6R0.8 CC(C)(C=C)C=O Amb18639188 [1,1,0,0,0,0|0,0,2]=4 3088 B6R0.8 CC(N)(C=O)C=O Amb25785258 [1,1,0,0,0,0|1,0,1]=4 3089 B6R0.8 CC([Na])(C=O)C=O Amb24741553 [1,1,0,0,0,0|1,0,1]=4 3090 B6R0.8 CCC(C)(Br)C=O Amb24757675 [1,1,0,0,0,0|0,0,2]=4 3091 B6R0.8 CCC(C)(C)C=O Amb19148820 [1,1,0,0,0,0|0,0,2]=4 3092 B6R0.8 CCC(C)(Cl)C=O Amb18641096 [1,1,0,0,0,0|0,0,2]=4 3093 B6R0.8 CCC(C)(O)C=O Amb18639932 [1,1,0,0,0,0|0,0,2]=4 3094 B6R0.8 COC(C)(C)C=O Amb25173664 [1,1,0,0,0,0|1,0,1]=4 3095 B6R0.8 CSC(C)(C)C=O Amb18124124 [1,1,0,0,0,0|1,0,1]=4 3096 B6R0.9 C=C\C(\CCl)=C/Cl Amb25026187 [1,1,0,0,0,0|1,0,1]=4 3097 B6R0.9 C=C\C(\CCl)=C\Cl Amb24616265 [1,1,0,0,0,0|1,0,1]=4 3098 B6R0.9 CC=C(C#N)NC Amb24530111 [1,1,0,0,0,0|1,0,1]=4 3099 B6R0.9 CC=C(C=O)C=O Amb18120778 [1,1,0,0,0,0|0,0,1]=3 3100 B6R0.9 CC=C(CBr)OC Amb25258340 [1,1,0,0,0,0|1,0,1]=4 3101 B6R0.9 CC=C(CC)C=O Amb25235895 [1,1,0,0,0,0|0,0,0]=2 3102 B6R0.9 CC=C(CI)OC Amb25176571 [1,1,0,0,0,0|1,0,1]=4 3103 B6R0.9 CC=C(OC)OC Amb25231933 [1,1,0,0,0,0|2,0,0]=4 3104 B6R0.9 CCC(=CBr)OC Amb24400630 [1,1,0,0,0,0|1,0,1]=4 3105 B6R0.9 CCC(=CCl)SC Amb24511896 [1,1,0,0,0,0|1,0,1]=4 3106 B6R0.9 CCC(C=O)=CBr Amb25147584 [1,1,0,0,0,0|1,0,0]=3 3107 B6R0.9 CCC(C=O)C=O Amb25798416 [1,1,0,0,0,0|1,0,1]=4 3108 B6R0.9 CCC(C=O)OC Amb18121854 [1,1,0,0,0,0|0,0,2]=4 3109 B6R0.9 CCC(C=O)SC Amb25123224 [1,1,0,0,0,0|0,0,2]=4 3110 B6R0.9 CCC(CC)=CCl Amb25775028 [1,1,0,0,0,0|1,0,1]=4 3111 B6R0.9 CCC(CCl)=CC Amb24519584 [1,1,0,0,0,0|1,0,1]=4 3112 B6R0.9 CCC(CF)=NO Amb24428651 [1,1,0,0,0,0|1,0,1]=4 3113 B6R0.9 CCC(CI)C=O Amb24364376 [1,1,0,0,0,0|0,0,2]=4 3114 B6R0.9 CCC(CN)=CC Amb24519596 [1,1,0,0,0,0|1,0,1]=4 3115 B6R0.9 CCC(NC)=NO Amb24575302 [1,1,0,0,0,0|1,0,1]=4 3116 B6R0.9 CCN(CO)C=O Amb25048371 [1,1,0,0,0,0|1,0,1]=4 3117 B6R0.9 CC\C(=C/C)\C=O Amb10606406 [1,1,0,0,0,0|0,0,0]=2 3118 B6R0.9 CC\C(=C\C)\C#N Amb18638703 [1,1,0,0,0,0|1,0,1]=4 3119 B6R0.9 CC\C(\C=C)=C/Br Amb24523667 [1,1,0,0,0,0|1,0,1]=4 3120 B6R0.9 CC\C(\C=O)=C/Br Amb25313085 [1,1,0,0,0,0|1,0,0]=3 3121 B6R0.9 CC\C(\C=O)=C/Cl Amb18124155 [1,1,0,0,0,0|1,0,0]=3 3122 B6R0.9 CC\C(\CO)=C/Br Amb25061874 [1,1,0,0,0,0|1,0,1]=4 3123 B6R0.9 COC(=CCl)OC Amb25088450 [1,1,0,0,0,0|2,0,0]=4 3124 B6R0.9 COC(=CN)C=O Amb25127730 [1,1,0,0,0,0|1,0,0]=3 3125 B6R0.9 COC(C=O)C=O Amb24622474 [1,1,0,0,0,0|1,0,1]=4 3126 B6R0.9 COC(C=O)OC Amb10071226 [1,1,0,0,0,0|1,0,1]=4 3127 B6R0.9 COC(C=O)SC Amb24646584 [1,1,0,0,0,0|1,0,1]=4 3128 B6R0.9 COC(CO)C=O Amb18640344 [1,1,0,0,0,0|1,0,1]=4 3129 B6R0.9 CO[C@@H](C=C)C=O Amb24531697 [1,1,0,0,0,0|0,0,2]=4 3130 B6R0.9 CO[C@@H](CO)C=O Amb24639077 [1,1,0,0,0,0|1,0,1]=4 3131 B6R0.9 CO\C(=C\O)\C=O Amb24383108 [1,1,0,0,0,0|1,0,0]=3 3132 B6R0.9 CSC(=CO)C=O Amb24513218 [1,1,0,0,0,0|1,0,0]=3 3133 B6R0.9 C\C=C(\C=C)/C=O Amb25223057 [1,1,0,0,0,0|0,0,1]=3 3134 B6R0.9 C\C=C(\CBr)/C#N Amb24479584 [1,1,0,0,0,0|1,0,1]=4 3135 B6R0.9 C\C=C(\CC)/C=C Amb25024610 [1,1,0,0,0,0|1,0,0]=3 3136 B6R0.9 C\C=C(\CN)/C#N Amb18120505 [1,1,0,0,0,0|1,0,1]=4 3137 B6R0.9 C\C=C(\CO)/C#N Amb18638994 [1,1,0,0,0,0|0,0,2]=4 3138 B6R0.9 C\C=C(\CO)/C=C Amb25810653 [1,1,0,0,0,0|1,0,0]=3 3139 B6R0.9 N#C\C(\C=O)=C/Cl Amb25290191 [1,1,0,0,0,0|1,0,1]=4 3140 B6R0.9 N=C\C(=C\O)\C=O Amb24386481 [1,1,0,0,0,0|1,0,1]=4 3141 B6R0.9 N\C=C(\C=O)/C#N Amb25169586 [1,1,0,0,0,0|1,0,1]=4 3142 B6R0.9 O=CN(CCl)C=O Amb25173503 [1,1,0,0,0,0|2,0,0]=4 3143 B6R0.9 ON=C(CCl)C=O Amb25773767 [1,1,0,0,0,0|2,0,0]=4 3144 B6R0.7 CC(=C)C(C)(C)O Amb22228300 [1,1,0,0,0,0|1,0,1]=4 3145 B6R0.7 CC(=C)P(O)(O)=O Amb22388780 [1,1,0,0,0,0|1,0,0]=3 3146 B6R0.7 CC(=C)S(=O)(=O)Cl Amb20667711 [1,1,0,0,0,0|1,0,1]=4 3147 B6R0.7 CC(=C)S(C)(=O)=O Amb24690396 [1,1,0,0,0,0|1,0,1]=4 3148 B6R0.7 CC(=C)S(N)(=O)=O Amb25072742 [1,1,0,0,0,0|1,0,1]=4 3149 B6R0.7 CC(=O)C(Br)(C)C Amb2389573 [1,1,0,0,0,0|1,0,1]=4 3150 B6R0.7 CC(=O)C(C)(C)F Amb24479081 [1,1,0,0,0,0|1,0,1]=4 3151 B6R0.7 CC(=O)C(C)(C)N Amb22283888 [1,1,0,0,0,0|1,0,1]=4 3152 B6R0.7 CC(=O)C(N)(C)C Amb1087903 [1,1,0,0,0,0|1,0,1]=4 3153 B6R0.7 CC(=O)P(O)(O)=O Amb25229259 [1,1,0,0,0,0|2,0,0]=4 3154 B6R0.7 CC(=O)[N+](C)(C)C Amb25737047 [1,1,0,0,0,0|2,0,0]=4 3155 B6R0.7 CC(=O)[Si](C)(C)C Amb19894190 [1,1,0,0,0,0|1,1,0]=4 3156 B6R0.7 CC(C)(Br)C(=O)Cl Amb18090808 [1,1,0,0,0,0|1,0,1]=4 3157 B6R0.7 CC(C)(C)C(=O)Br Amb25684718 [1,1,0,0,0,0|1,0,1]=4 3158 B6R0.7 CC(C)(C)C(=O)S Amb20240548 [1,1,0,0,0,0|0,1,1]=4 3159 B6R0.7 CC(C)(C)C(O)=O Amb22360669 [1,1,0,0,0,0|0,0,1]=3 3160 B6R0.7 CC(C)(C)C([O-])=O Amb22523341 [1,1,0,0,0,0|0,0,2]=4 3161 B6R0.7 CC(C)(C)C([O-])=O Amb24325153 [1,1,0,0,0,0|0,0,2]=4 3162 B6R0.7 CC(C)(C)S(O)=O Amb25194337 [1,1,0,0,0,0|1,0,1]=4 3163 B6R0.7 CC(C)(Cl)C(=O)Cl Amb20668299 [1,1,0,0,0,0|1,0,1]=4 3164 B6R0.7 CC(C)(Cl)C(N)=O Amb24122839 [1,1,0,0,0,0|1,0,1]=4 3165 B6R0.7 CC(C)(F)C(=O)Cl Amb24055889 [1,1,0,0,0,0|1,0,1]=4 3166 B6R0.7 CC(C)(F)C(N)=O Amb20671475 [1,1,0,0,0,0|1,0,1]=4 3167 B6R0.7 CC(C)(I)C(N)=O Amb25186301 [1,1,0,0,0,0|1,0,1]=4 3168 B6R0.7 CC(C)(N)C(=O)Cl Amb24479876 [1,1,0,0,0,0|1,0,1]=4 3169 B6R0.7 CC(C)(N)P(O)=O Amb24479807 [1,1,0,0,0,0|1,0,1]=4 3170 B6R0.7 CC(C)(O)C([O-])=O Amb22343241 [1,1,0,0,0,0|0,0,2]=4 3171 B6R0.7 CC(C)(P)C(O)=O Amb25836244 [1,1,0,0,0,0|0,0,1]=3 3172 B6R0.7 CC(C)(S)C(N)=O Amb25366790 [1,1,0,0,0,0|1,0,1]=4 3173 B6R0.7 CC(C)([15NH2])C(O)=O Amb22367632 [1,1,0,0,0,0|0,0,1]=3 3174 B6R0.7 CC(Cl)(Br)C(O)=O Amb24739657 [1,1,0,0,0,0|1,0,1]=4 3175 B6R0.7 CC(Cl)(Cl)C(O)=O Amb22352970 [1,1,0,0,0,0|1,0,1]=4 3176 B6R0.7 CC(F)(Br)C(O)=O Amb19895446 [1,1,0,0,0,0|1,0,1]=4 3177 B6R0.7 CC(F)(Cl)C(O)=O Amb22011870 [1,1,0,0,0,0|1,0,1]=4 3178 B6R0.7 CC(N)(Cl)C(O)=O Amb25040032 [1,1,0,0,0,0|1,0,1]=4 3179 B6R0.7 CC(N)(N)C(O)=O Amb24479882 [1,1,0,0,0,0|1,0,1]=4 3180 B6R0.7 CC(O)(O)C(O)=O Amb25337924 [1,1,0,0,0,0|1,0,1]=4 3181 B6R0.7 CC(P)(P)C(O)=O Amb25330045 [1,1,0,0,0,0|1,0,1]=4 3182 B6R0.7 CC(S)(S)C(O)=O Amb24687073 [1,1,0,0,0,0|1,0,1]=4 3183 B6R0.7 CN(C)P(O)(O)=O Amb24604756 [1,1,0,0,0,0|2,0,0]=4 3184 B6R0.7 C[C@@](N)(Cl)C(O)=O Amb24479866 [1,1,0,0,0,0|1,0,1]=4 3185 B6R0.7 C[C@@](N)(F)C(O)=O Amb25810196 [1,1,0,0,0,0|1,0,1]=4 3186 B6R0.7 C[C@@](N)(S)C(O)=O Amb25108484 [1,1,0,0,0,0|1,0,1]=4 3187 B6R0.7 C[C@](N)(F)C(O)=O Amb24333513 [1,1,0,0,0,0|1,0,1]=4 3188 B6R0.7 NC(=O)C(Br)(C)C Amb10071123 [1,1,0,0,0,0|1,0,1]=4 3189 B6R0.7 NC(=O)C(C)(C)C Amb1151239 [1,1,0,0,0,0|1,0,1]=4 3190 B6R0.7 NC(=O)C(N)(C)C Amb10608162 [1,1,0,0,0,0|1,0,1]=4 3191 B6R0.7 NC(=O)C(N)(C)C Amb10609802 [1,1,0,0,0,0|1,0,1]=4 3192 B6R0.7 OC(=O)C(O)(C)C Amb1159101 [1,1,0,0,0,0|0,0,1]=3 3193 B6R0.7 OC(=O)C(S)(C)C Amb17501520 [1,1,0,0,0,0|0,0,1]=3 3194 B6R0.7 [2H]C(C)(N)C(O)=O Amb22353531 [1,1,0,0,0,0|1,0,1]=4 3195 B6R0.7 [2H]C(C)(N)[13C](O)=O Amb22367245 [1,1,0,0,0,0|1,0,1]=4 3196 B6R0.7 [2H]C([13CH3])(N)C(O)=O Amb22351832 [1,1,0,0,0,0|1,0,1]=4 3197 B6R0.7 [2H]C([2H])(C)C(O)=O Amb22366992 [1,1,0,0,0,0|1,0,1]=4 3198 B6R0.7 [2H][13C](C)(N)C(O)=O Amb22367247 [1,1,0,0,0,0|1,0,1]=4 3199 B6R0.7 [2H][C@@](C)(N)C(O)=O Amb22800178 [1,1,0,0,0,0|1,0,1]=4 3200 B6R0.7 [O-]C(=O)C(C)(C)C Amb16192974 [1,1,0,0,0,0|0,0,2]=4 3201 B8R0.2 C=C(C=C)[C@H](N)C(O)=O Amb24580353 [0,1,0,0,0,1|0,0,2]=4 3202 B8R0.2 CC(=O)C(C)=C(C)C=O Amb25275053 [0,1,0,0,0,1|2,0,0]=4 3203 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,1,0,0,0,1|0,0,2]=4 3204 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,1,0,0,0,1|1,0,1]=4 3205 B8R0.2 CC(C(O)=O)=C(Br)C=O Amb24571694 [0,1,0,0,0,1|2,0,0]=4 3206 B8R0.2 CC(C(O)=O)=C(Cl)CC Amb24719968 [0,1,0,0,0,1|1,0,1]=4 3207 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,1,0,0,0,1|2,0,0]=4 3208 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,1,0,0,0,1|0,0,2]=4 3209 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,1,0,0,0,1|0,0,2]=4 3210 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,1,0,0,0,1|0,0,2]=4 3211 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,1,0,0,0,1|0,0,2]=4 3212 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,1,0,0,0,1|1,0,1]=4 3213 B8R0.2 CC(CC)=C(F)C(O)=O Amb25305731 [0,1,0,0,0,1|0,0,1]=3 3214 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,1,0,0,0,1|0,0,2]=4 3215 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,1,0,0,0,1|0,0,2]=4 3216 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,1,0,0,0,1|0,0,2]=4 3217 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,1,0,0,0,1|0,0,2]=4 3218 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,1,0,0,0,1|0,0,2]=4 3219 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,1,0,0,0,1|0,0,2]=4 3220 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,1,0,0,0,1|0,0,2]=4 3221 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,1,0,0,0,1|1,0,1]=4 3222 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,1,0,0,0,1|1,0,1]=4 3223 B8R0.2 CC(NC)=C(Br)C(C)=O Amb25179136 [0,1,0,0,0,1|2,0,0]=4 3224 B8R0.2 CC(NC)=C(Cl)C(C)=O Amb25265225 [0,1,0,0,0,1|2,0,0]=4 3225 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,1,0,0,0,1|1,0,1]=4 3226 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,1,0,0,0,1|1,0,1]=4 3227 B8R0.2 CC(O)C(O)\C(\C)=C/C Amb25847844 [0,1,0,0,0,1|1,0,1]=4 3228 B8R0.2 CC(OC)=C(Cl)C(C)=O Amb24631620 [0,1,0,0,0,1|2,0,0]=4 3229 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,1,0,0,0,1|1,0,1]=4 3230 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,1,0,0,0,1|1,0,1]=4 3231 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,1,0,0,0,1|0,0,2]=4 3232 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,1,0,0,0,1|0,0,2]=4 3233 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,1,0,0,0,1|0,0,2]=4 3234 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,1,0,0,0,1|1,0,1]=4 3235 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,1,0,0,0,1|0,0,2]=4 3236 B8R0.2 CCC(C)=C(C)C(C)=O Amb24721878 [0,1,0,0,0,1|1,0,1]=4 3237 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,1,0,0,0,1|0,0,2]=4 3238 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,1,0,0,0,1|0,0,2]=4 3239 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,1,0,0,0,1|0,0,2]=4 3240 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,1,0,0,0,1|0,0,2]=4 3241 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,1,0,0,0,1|0,0,2]=4 3242 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,1,0,0,0,1|0,0,2]=4 3243 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,1,0,0,0,1|1,0,1]=4 3244 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,1,0,0,0,1|0,0,2]=4 3245 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,1,0,0,0,1|0,0,2]=4 3246 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,1,0,0,0,1|0,0,2]=4 3247 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,1,0,0,0,1|0,0,2]=4 3248 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,1,0,0,0,1|0,0,2]=4 3249 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,1,0,0,0,1|0,0,2]=4 3250 B8R0.2 CC\C(\C)=C(\C)/C(C)=O Amb25767749 [0,1,0,0,0,1|1,0,1]=4 3251 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,1,0,0,0,1|2,0,0]=4 3252 B8R0.2 CNC(=O)C(=O)C(O)=O Amb25075425 [0,1,0,0,0,1|2,0,0]=4 3253 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,1,0,0,0,1|1,0,1]=4 3254 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,1,0,0,0,1|1,0,1]=4 3255 B8R0.2 COC(=O)C(=O)C(O)=O Amb18124343 [0,1,0,0,0,1|2,0,0]=4 3256 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,1,0,0,0,1|2,0,0]=4 3257 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,1,0,0,0,1|2,0,0]=4 3258 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,1,0,0,0,1|2,0,0]=4 3259 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,1,0,0,0,1|2,0,0]=4 3260 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,1,0,0,0,1|1,0,1]=4 3261 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,1,0,0,0,1|1,0,1]=4 3262 B8R0.2 COC(C)=C(C)C(C)=O Amb24678123 [0,1,0,0,0,1|2,0,0]=4 3263 B8R0.2 COC(C)C(=C)C(O)=O Amb25706403 [0,1,0,0,0,1|1,0,1]=4 3264 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,1,0,0,0,1|1,0,1]=4 3265 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,1,0,0,0,1|1,0,1]=4 3266 B8R0.2 CO[C@@H](C)C(=O)C(O)=O Amb24597638 [0,1,0,0,0,1|1,0,1]=4 3267 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,1,0,0,0,1|1,0,1]=4 3268 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,1,0,0,0,1|1,0,1]=4 3269 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,1,0,0,0,1|1,0,1]=4 3270 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,1,0,0,0,1|1,0,1]=4 3271 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,1,0,0,0,1|1,0,1]=4 3272 B8R0.2 CO\C(\C)=C(/C)\C(C)=O Amb25683972 [0,1,0,0,0,1|2,0,0]=4 3273 B8R0.2 CO\C(\C)=C(/C)\C(N)=O Amb24518090 [0,1,0,0,0,1|2,0,0]=4 3274 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,1,0,0,0,1|1,0,1]=4 3275 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,1,0,0,0,1|1,0,1]=4 3276 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,1,0,0,0,1|2,0,0]=4 3277 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,1,0,0,0,1|0,0,2]=4 3278 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,1,0,0,0,1|1,0,1]=4 3279 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,1,0,0,0,1|0,0,2]=4 3280 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,1,0,0,0,1|0,0,2]=4 3281 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,1,0,0,0,1|0,0,2]=4 3282 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,1,0,0,0,1|0,0,2]=4 3283 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,1,0,0,0,1|0,0,2]=4 3284 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,1,0,0,0,1|0,0,2]=4 3285 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,1,0,0,0,1|0,0,2]=4 3286 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,1,0,0,0,1|0,0,2]=4 3287 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,1,0,0,0,1|1,0,1]=4 3288 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,1,0,0,0,1|1,0,1]=4 3289 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,1,0,0,0,1|1,0,1]=4 3290 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,1,0,0,0,1|1,0,1]=4 3291 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,1,0,0,0,1|1,0,1]=4 3292 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,1,0,0,0,1|1,0,1]=4 3293 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,1,0,0,0,1|1,0,1]=4 3294 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,1,0,0,0,1|0,0,2]=4 3295 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,1,0,0,0,1|1,0,1]=4 3296 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,1,0,0,0,1|0,0,2]=4 3297 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,1,0,0,0,1|0,0,2]=4 3298 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,1,0,0,0,1|0,0,2]=4 3299 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,1,0,0,0,1|0,0,2]=4 3300 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,1,0,0,0,1|0,0,2]=4 3301 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,1,0,0,0,1|0,0,2]=4 3302 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,1,0,0,0,1|0,0,2]=4 3303 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,1,0,0,0,1|0,0,2]=4 3304 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,1,0,0,0,1|1,0,1]=4 3305 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,1,0,0,0,1|1,0,1]=4 3306 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,1,0,0,0,1|1,0,1]=4 3307 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,1,0,0,0,1|0,0,2]=4 3308 B8R0.2 C[C@H]([C@H](C)O)\C(\C)=C/C Amb24687423 [0,1,0,0,0,1|1,0,1]=4 3309 B8R0.2 C\C(=C/C)\C(=O)C(C)=C Amb25042671 [0,1,0,0,0,1|2,0,0]=4 3310 B8R0.2 C\C(=C/C)\C(=O)C(C)O Amb25697088 [0,1,0,0,0,1|1,0,1]=4 3311 B8R0.2 C\C(=C/C)\C(C)C(C)=O Amb24689489 [0,1,0,0,0,1|1,0,0]=3 3312 B8R0.2 C\C(=C/C)\C(C)C(N)=O Amb24477780 [0,1,0,0,0,1|1,0,0]=3 3313 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,1,0,0,0,1|0,0,0]=2 3314 B8R0.2 C\C(=C/C)\C(O)C(C)=O Amb25708298 [0,1,0,0,0,1|1,0,0]=3 3315 B8R0.2 C\C(=C/C)\C(O)C(N)=O Amb25082841 [0,1,0,0,0,1|1,0,0]=3 3316 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,1,0,0,0,1|0,0,0]=2 3317 B8R0.2 C\C(=C\C)\C(=O)C(C)=C Amb24550541 [0,1,0,0,0,1|2,0,0]=4 3318 B8R0.2 C\C(=C\C)\C(O)C(C)=O Amb24561282 [0,1,0,0,0,1|1,0,0]=3 3319 B8R0.2 C\C(=C\C)\C(O)C(N)=O Amb25243454 [0,1,0,0,0,1|1,0,0]=3 3320 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,1,0,0,0,1|0,0,0]=2 3321 B8R0.2 C\C(=N/C)\N(C)C(C)=O Amb24096762 [0,1,0,0,0,1|2,0,0]=4 3322 B8R0.2 C\C(=N\C)\N(C)C(C)=O Amb24096677 [0,1,0,0,0,1|2,0,0]=4 3323 B8R0.2 C\C(\C(C)=O)=C(/C)\C=C Amb25694901 [0,1,0,0,0,1|1,0,1]=4 3324 B8R0.2 C\C(\C(O)=O)=C(\Br)/C=C Amb25361017 [0,1,0,0,0,1|1,0,1]=4 3325 B8R0.2 C\C(\C(O)=O)=C(\Br)/C=O Amb25200989 [0,1,0,0,0,1|2,0,0]=4 3326 B8R0.2 C\C(\NC)=C(/Br)\C(C)=O Amb24478725 [0,1,0,0,0,1|2,0,0]=4 3327 B8R0.2 C\C(\OC)=C(\Cl)/C(C)=O Amb25024494 [0,1,0,0,0,1|2,0,0]=4 3328 B8R0.2 O=C\C(=C(\C(=O)O)/Br)\Br Amb1981387 [0,1,0,0,0,1|2,0,0]=4 3329 B8R0.2 OC(=O)C(Cl)=C(Br)C=O Amb24591769 [0,1,0,0,0,1|2,0,0]=4 3330 B8R0.2 OC(=O)C(O)=C(Cl)C=O Amb24518465 [0,1,0,0,0,1|2,0,0]=4 3331 B8R0.2 OC(=O)\C(\Cl)=C(/Cl)\C=O Amb18602727 [0,1,0,0,0,1|2,0,0]=4 3332 B8R0.2 OC(=O)\C(\Cl)=C(\Br)/C=O Amb18657499 [0,1,0,0,0,1|2,0,0]=4 3333 B8R0.2 OC(=O)\C(\O)=C(\Cl)/C=O Amb25361999 [0,1,0,0,0,1|2,0,0]=4 3334 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,1,0,0,0,1|0,0,2]=4 3335 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [0,1,0,0,0,1|0,0,2]=4 3336 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,1,0,0,0,1|0,0,2]=4 3337 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,1,0,0,0,1|0,0,2]=4 3338 B8R0.5 CC(=CC#N)NC(C)=O Amb25284464 [0,1,0,0,0,1|1,0,1]=4 3339 B8R0.5 CC(=CC(C)=O)NOC Amb24713475 [0,1,0,0,0,1|2,0,0]=4 3340 B8R0.5 CC(=CC(N)=O)OCC Amb25773866 [0,1,0,0,0,1|1,0,1]=4 3341 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [0,1,0,0,0,1|0,0,1]=3 3342 B8R0.5 CC(=CC(O)=O)SCC Amb25229812 [0,1,0,0,0,1|0,0,1]=3 3343 B8R0.5 CC(=CCBr)OC(C)=O Amb25374954 [0,1,0,0,0,1|1,0,0]=3 3344 B8R0.5 CC(=O)CC(=O)\C=C\C Amb25807638 [0,1,0,0,0,1|2,0,0]=4 3345 B8R0.5 CC(=O)CC(Cl)=CCCl Amb25056100 [0,1,0,0,0,1|2,0,0]=4 3346 B8R0.5 CC(=O)C\C(\Br)=C\CCl Amb24370172 [0,1,0,0,0,1|2,0,0]=4 3347 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,1,0,0,0,1|2,0,0]=4 3348 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,1,0,0,0,1|2,0,0]=4 3349 B8R0.5 CC(=O)NC(=O)\C=C\C Amb25266462 [0,1,0,0,0,1|2,0,0]=4 3350 B8R0.5 CC(=O)S\C(\N)=C/CC Amb25341526 [0,1,0,0,0,1|2,0,0]=4 3351 B8R0.5 CC(=O)\C=C(\C)/C=C=O Amb24437418 [0,1,0,0,0,1|1,0,1]=4 3352 B8R0.5 CC(=O)\C=C(\C)/CCN Amb20621191 [0,1,0,0,0,1|1,0,1]=4 3353 B8R0.5 CC(C)=CC(C)=CCO Amb25032204 [0,1,0,0,0,1|2,0,0]=4 3354 B8R0.5 CC(C)=C\C(\C)=C\CC Amb22365218 [0,1,0,0,0,1|2,0,0]=4 3355 B8R0.5 CC(C=C(C)Cl)=CCO Amb24474553 [0,1,0,0,0,1|2,0,0]=4 3356 B8R0.5 CC(CC(C)=C)=CCO Amb25847843 [0,1,0,0,0,1|2,0,0]=4 3357 B8R0.5 CC(CC(C)=O)=CC#N Amb24602998 [0,1,0,0,0,1|1,0,1]=4 3358 B8R0.5 CC(CC(C)=O)=CCCl Amb24581453 [0,1,0,0,0,1|1,0,0]=3 3359 B8R0.5 CC(CC(C)=O)=NOC Amb25179533 [0,1,0,0,0,1|2,0,0]=4 3360 B8R0.5 CC(CC(O)=O)NC=O Amb18967805 [0,1,0,0,0,1|1,0,1]=4 3361 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,1,0,0,0,1|0,0,2]=4 3362 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,1,0,0,0,1|0,0,2]=4 3363 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,1,0,0,0,1|0,0,2]=4 3364 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,1,0,0,0,1|0,0,2]=4 3365 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,1,0,0,0,1|0,0,1]=3 3366 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,1,0,0,0,1|0,0,2]=4 3367 B8R0.5 CC(CCS)=CC(O)=O Amb25328912 [0,1,0,0,0,1|0,0,1]=3 3368 B8R0.5 CC(CNC)=CC(O)=O Amb25126794 [0,1,0,0,0,1|0,0,1]=3 3369 B8R0.5 CC(CNO)=CC(O)=O Amb25702672 [0,1,0,0,0,1|1,0,1]=4 3370 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,1,0,0,0,1|0,0,1]=3 3371 B8R0.5 CC(CSC)=CC(O)=O Amb25364860 [0,1,0,0,0,1|0,0,1]=3 3372 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,1,0,0,0,1|0,0,2]=4 3373 B8R0.5 CC(\C=C\C)=CC(N)=O Amb24476632 [0,1,0,0,0,1|1,0,0]=3 3374 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,1,0,0,0,1|0,0,2]=4 3375 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,1,0,0,0,1|1,0,1]=4 3376 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,1,0,0,0,1|0,0,2]=4 3377 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,1,0,0,0,1|0,0,2]=4 3378 B8R0.5 CCC\C(\C)=C/C(C)=O Amb24676836 [0,1,0,0,0,1|1,0,1]=4 3379 B8R0.5 CCC\C(\C)=C\C(C)=O Amb25735089 [0,1,0,0,0,1|1,0,1]=4 3380 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,1,0,0,0,1|1,0,1]=4 3381 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,1,0,0,0,1|1,0,1]=4 3382 B8R0.5 CCN\C(=C\C(=O)C)\C Amb10602727 [0,1,0,0,0,1|1,0,1]=4 3383 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,1,0,0,0,1|1,0,1]=4 3384 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,1,0,0,0,1|1,0,1]=4 3385 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,1,0,0,0,1|0,0,2]=4 3386 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,1,0,0,0,1|1,0,0]=3 3387 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,1,0,0,0,1|1,0,0]=3 3388 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,1,0,0,0,1|1,0,1]=4 3389 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,1,0,0,0,1|1,0,1]=4 3390 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,1,0,0,0,1|1,0,1]=4 3391 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,1,0,0,0,1|1,0,1]=4 3392 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,1,0,0,0,1|0,0,2]=4 3393 B8R0.5 CNNC(=N)CC(O)=O Amb25226519 [0,1,0,0,0,1|2,0,0]=4 3394 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,1,0,0,0,1|1,0,1]=4 3395 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,1,0,0,0,1|0,0,2]=4 3396 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,1,0,0,0,1|0,0,2]=4 3397 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,1,0,0,0,1|1,0,1]=4 3398 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,1,0,0,0,1|0,0,2]=4 3399 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,1,0,0,0,1|0,0,2]=4 3400 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,1,0,0,0,1|0,0,1]=3 3401 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [0,1,0,0,0,1|1,0,1]=4 3402 B8R0.5 C\C(=C/C(C)=O)\SCC Amb25031784 [0,1,0,0,0,1|1,0,1]=4 3403 B8R0.5 C\C(=C/C(O)=O)\C#CC Amb24644658 [0,1,0,0,0,1|0,0,1]=3 3404 B8R0.5 C\C(=C/CC)\NC(N)=O Amb24657227 [0,1,0,0,0,1|1,0,0]=3 3405 B8R0.5 C\C(=C\C(C)=O)\NCC Amb20241597 [0,1,0,0,0,1|1,0,1]=4 3406 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [0,1,0,0,0,1|1,0,1]=4 3407 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [0,1,0,0,0,1|0,0,1]=3 3408 B8R0.5 C\C(=C\CC)\NC(N)=O Amb24680900 [0,1,0,0,0,1|1,0,0]=3 3409 B8R0.5 C\C(=C\SC)\NC(C)=O Amb24660230 [0,1,0,0,0,1|1,0,0]=3 3410 B8R0.5 C\C(\C=C(Cl)Cl)=C\CCl Amb24518592 [0,1,0,0,0,1|2,0,0]=4 3411 B8R0.5 C\C(\C=NO)=C\C(C)=O Amb24679863 [0,1,0,0,0,1|2,0,0]=4 3412 B8R0.5 C\C(\C=N\O)=C/C(C)=O Amb25735799 [0,1,0,0,0,1|2,0,0]=4 3413 B8R0.5 C\C(\CC(C)=O)=C/OC Amb24334053 [0,1,0,0,0,1|1,0,0]=3 3414 B8R0.5 C\C(\CC(C)=O)=C\OC Amb24580390 [0,1,0,0,0,1|1,0,0]=3 3415 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,1,0,0,0,1|0,0,0]=2 3416 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,1,0,0,0,1|0,0,0]=2 3417 B8R0.5 C\C(\CC(O)=O)=C\CS Amb18124785 [0,1,0,0,0,1|0,0,0]=2 3418 B8R0.5 C\C(\CC=C)=C\C(O)=O Amb25810544 [0,1,0,0,0,1|0,0,1]=3 3419 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,1,0,0,0,1|0,0,1]=3 3420 B8R0.5 C\C(\CNC)=C/C(O)=O Amb24384927 [0,1,0,0,0,1|0,0,1]=3 3421 B8R0.5 C\C=C\C(C)=CC(C)=O Amb24656126 [0,1,0,0,0,1|1,0,0]=3 3422 B8R0.5 C\C=C\C(C)CC(C)=O Amb25211017 [0,1,0,0,0,1|1,0,1]=4 3423 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,1,0,0,0,1|0,0,1]=3 3424 B8R0.5 C\C=C\C(C)OC(C)=O Amb24678106 [0,1,0,0,0,1|1,0,1]=4 3425 B8R0.5 C\C=C\C(\C)=C/C(C)=O Amb25205837 [0,1,0,0,0,1|1,0,0]=3 3426 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,1,0,0,0,1|0,0,1]=3 3427 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,1,0,0,0,1|1,0,1]=4 3428 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,1,0,0,0,1|0,0,2]=4 3429 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,1,0,0,0,1|0,0,2]=4 3430 B8R0.16 CC(=O)C=C(CC)C=O Amb24518412 [0,1,0,0,0,1|2,0,0]=4 3431 B8R0.16 CC(=O)C=C(CC)CC Amb24551516 [0,1,0,0,0,1|1,0,1]=4 3432 B8R0.16 CC(=O)C=C(CC)OC Amb24529216 [0,1,0,0,0,1|1,0,1]=4 3433 B8R0.16 CC(=O)C=C(NC)OC Amb24666747 [0,1,0,0,0,1|2,0,0]=4 3434 B8R0.16 CC(=O)C=C(NC)SC Amb24495874 [0,1,0,0,0,1|2,0,0]=4 3435 B8R0.16 CC(=O)C=C(SC)SC Amb22490409 [0,1,0,0,0,1|2,0,0]=4 3436 B8R0.16 CC(=O)CC(=CBr)OC Amb25210500 [0,1,0,0,0,1|2,0,0]=4 3437 B8R0.16 CC(=O)CC(CC)=CC Amb24551554 [0,1,0,0,0,1|1,0,0]=3 3438 B8R0.16 CC(=O)NC(=CC)SC Amb25743002 [0,1,0,0,0,1|1,0,0]=3 3439 B8R0.16 CC(=O)N\C(\CC)=C\C Amb24559223 [0,1,0,0,0,1|1,0,0]=3 3440 B8R0.16 CC(=O)O\C(\C=O)=C/C Amb25785198 [0,1,0,0,0,1|1,0,1]=4 3441 B8R0.16 CC(=O)O\C(\C=O)=C\C Amb25242615 [0,1,0,0,0,1|1,0,1]=4 3442 B8R0.16 CC(=O)O\C(\CBr)=C/C Amb24480190 [0,1,0,0,0,1|1,0,0]=3 3443 B8R0.16 CC(=O)\C=C(/CC)\OC Amb24580486 [0,1,0,0,0,1|1,0,1]=4 3444 B8R0.16 CC(=O)\C=C(/CCl)\OC Amb25285740 [0,1,0,0,0,1|2,0,0]=4 3445 B8R0.16 CC(=O)\C=C(\NC)/OC Amb24602912 [0,1,0,0,0,1|2,0,0]=4 3446 B8R0.16 CC(=O)\C=C(\NC)/SC Amb24620349 [0,1,0,0,0,1|2,0,0]=4 3447 B8R0.16 CC(=O)\N=C(/NC)\SC Amb25836135 [0,1,0,0,0,1|2,0,0]=4 3448 B8R0.16 CCC(CC(N)=O)=CC Amb24610057 [0,1,0,0,0,1|1,0,0]=3 3449 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,1,0,0,0,1|0,0,2]=4 3450 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,1,0,0,0,1|1,0,1]=4 3451 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,1,0,0,0,1|0,0,2]=4 3452 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,1,0,0,0,1|0,0,2]=4 3453 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,1,0,0,0,1|0,0,2]=4 3454 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,1,0,0,0,1|0,0,2]=4 3455 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,1,0,0,0,1|0,0,2]=4 3456 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,1,0,0,0,1|0,0,2]=4 3457 B8R0.16 CCN(CC(O)=O)C=O Amb18972736 [0,1,0,0,0,1|2,0,0]=4 3458 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [0,1,0,0,0,1|1,0,1]=4 3459 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [0,1,0,0,0,1|1,0,1]=4 3460 B8R0.16 CC\C(\C=C)=C/C(O)=O Amb25368328 [0,1,0,0,0,1|0,0,1]=3 3461 B8R0.16 CC\C(\C=O)=C/C(O)=O Amb18642578 [0,1,0,0,0,1|1,0,0]=3 3462 B8R0.16 CC\C(\C=O)=C\C(O)=O Amb25770561 [0,1,0,0,0,1|1,0,0]=3 3463 B8R0.16 CC\C(\CC(O)=O)=C/C Amb18642626 [0,1,0,0,0,1|0,0,0]=2 3464 B8R0.16 CNC(=NC(N)=O)SC Amb25063778 [0,1,0,0,0,1|2,0,0]=4 3465 B8R0.16 CNC(NC)=NC(N)=O Amb25841217 [0,1,0,0,0,1|2,0,0]=4 3466 B8R0.16 COC(=CC(=C)O)OC Amb25309905 [0,1,0,0,0,1|2,0,0]=4 3467 B8R0.16 COC(CC(O)=O)C=C Amb18642791 [0,1,0,0,0,1|0,0,2]=4 3468 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,1,0,0,0,1|1,0,1]=4 3469 B8R0.16 COC(CC(O)=O)OC Amb22231899 [0,1,0,0,0,1|1,0,1]=4 3470 B8R0.16 COC(CCl)=CC(O)=O Amb25690575 [0,1,0,0,0,1|1,0,0]=3 3471 B8R0.16 CSC(=CC(N)=O)SC Amb25797763 [0,1,0,0,0,1|2,0,0]=4 3472 B8R0.16 CSC(=NC(N)=O)SC Amb25232645 [0,1,0,0,0,1|2,0,0]=4 3473 B8R0.16 C\C=C(/CC(C)O)\CO Amb25256755 [0,1,0,0,0,1|1,0,1]=4 3474 B8R0.16 OC(=O)C=C(CBr)CBr Amb24481720 [0,1,0,0,0,1|1,0,1]=4 3475 B8R0.16 OC(=O)C=C(CO)CO Amb25112732 [0,1,0,0,0,1|1,0,1]=4 3476 B8R0.16 OC(=O)\C=C(\CCl)/C=O Amb24656100 [0,1,0,0,0,1|1,0,0]=3 3477 B8R0.19 CC(=CC(=O)OC)NC Amb24401759 [0,1,0,0,0,1|1,0,0]=3 3478 B8R0.19 CC(=CC(=O)OC)OC Amb24534136 [0,1,0,0,0,1|1,0,0]=3 3479 B8R0.19 CC(CC(=O)OC)=CBr Amb24635219 [0,1,0,0,0,1|1,0,0]=3 3480 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [0,1,0,0,0,1|0,0,0]=2 3481 B8R0.19 CC(CC(=O)OC)=CCl Amb24511859 [0,1,0,0,0,1|1,0,0]=3 3482 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [0,1,0,0,0,1|1,0,0]=3 3483 B8R0.19 CC(CC)=CC(=O)CC Amb25683797 [0,1,0,0,0,1|1,0,1]=4 3484 B8R0.19 CC(CC)=CC(=O)NC Amb25314412 [0,1,0,0,0,1|1,0,1]=4 3485 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,1,0,0,0,1|0,0,1]=3 3486 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [0,1,0,0,0,1|1,0,1]=4 3487 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,1,0,0,0,1|1,0,1]=4 3488 B8R0.19 CCC(=O)CC(Cl)=CC Amb24617724 [0,1,0,0,0,1|2,0,0]=4 3489 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,1,0,0,0,1|0,0,2]=4 3490 B8R0.19 CCC(NC(=O)OC)C Amb10568221 [0,1,0,0,0,1|0,0,2]=4 3491 B8R0.19 CCC(O)CC(C)=CC Amb24062972 [0,1,0,0,0,1|1,0,1]=4 3492 B8R0.19 CC[C@@H](C)NC(=O)OC Amb25368349 [0,1,0,0,0,1|0,0,2]=4 3493 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,1,0,0,0,1|1,0,1]=4 3494 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [0,1,0,0,0,1|2,0,0]=4 3495 B8R0.19 CNC(=N)NC(=O)OC Amb24592585 [0,1,0,0,0,1|2,0,0]=4 3496 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,1,0,0,0,1|2,0,0]=4 3497 B8R0.19 CNC(=O)NC(=O)OC Amb24540421 [0,1,0,0,0,1|2,0,0]=4 3498 B8R0.19 CNC(=S)SC(=O)OC Amb24479933 [0,1,0,0,0,1|2,0,0]=4 3499 B8R0.19 CN\C(=C/C(=O)OC)\C Amb2386651 [0,1,0,0,0,1|1,0,0]=3 3500 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,1,0,0,0,1|2,0,0]=4 3501 B8R0.19 COC(=N)NC(=O)OC Amb24760898 [0,1,0,0,0,1|2,0,0]=4 3502 B8R0.19 COC(=O)CC(=C)C=O Amb24434902 [0,1,0,0,0,1|1,0,1]=4 3503 B8R0.19 COC(=O)CC(=O)C=C Amb17593339 [0,1,0,0,0,1|1,0,1]=4 3504 B8R0.19 COC(=O)CC(=O)C=O Amb25827200 [0,1,0,0,0,1|2,0,0]=4 3505 B8R0.19 COC(=O)CC(C)C=C Amb24712566 [0,1,0,0,0,1|0,0,2]=4 3506 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,1,0,0,0,1|1,0,1]=4 3507 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,1,0,0,0,1|1,0,1]=4 3508 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [0,1,0,0,0,1|2,0,0]=4 3509 B8R0.19 COC(=O)CN(C)C=O Amb22349764 [0,1,0,0,0,1|2,0,0]=4 3510 B8R0.19 COC(=O)NC(=O)OC Amb25103686 [0,1,0,0,0,1|2,0,0]=4 3511 B8R0.19 COC(=O)NC(C)C=C Amb25294663 [0,1,0,0,0,1|0,0,2]=4 3512 B8R0.19 COC(=O)NC(C)C=O Amb24359055 [0,1,0,0,0,1|1,0,1]=4 3513 B8R0.19 COC(=O)OC(=O)OC Amb20240544 [0,1,0,0,0,1|2,0,0]=4 3514 B8R0.19 COC(=O)\C=C(/Br)\C=O Amb18129838 [0,1,0,0,0,1|2,0,0]=4 3515 B8R0.19 COC(=O)\C=C(/Cl)\C=O Amb25063146 [0,1,0,0,0,1|2,0,0]=4 3516 B8R0.19 COC(=O)\C=C(\Br)/C=O Amb24513011 [0,1,0,0,0,1|2,0,0]=4 3517 B8R0.19 COC(=O)\C=C(\Cl)/C=O Amb25278210 [0,1,0,0,0,1|2,0,0]=4 3518 B8R0.19 COC(C)CC(=O)NO Amb24476739 [0,1,0,0,0,1|1,0,1]=4 3519 B8R0.19 C\C(=C/C(=O)CC)\NC Amb25043025 [0,1,0,0,0,1|2,0,0]=4 3520 B8R0.19 C\C(=C/C(=O)CC)\OC Amb24646507 [0,1,0,0,0,1|2,0,0]=4 3521 B8R0.19 C\C(=C/C(=O)OC)\OC Amb21927982 [0,1,0,0,0,1|1,0,0]=3 3522 B8R0.19 C\C(=C\C(=O)NC)\OC Amb24654254 [0,1,0,0,0,1|2,0,0]=4 3523 B8R0.19 C\C(=C\C(=O)OC)\C#N Amb24463763 [0,1,0,0,0,1|1,0,1]=4 3524 B8R0.19 C\C(=C\C(=O)OC)\O[Na] Amb22731349 [0,1,0,0,0,1|2,0,0]=4 3525 B8R0.19 C\C(\C=C)=C\C(=O)CC Amb24604763 [0,1,0,0,0,1|1,0,1]=4 3526 B8R0.19 C\C(\C=O)=C/C(=O)OC Amb25702407 [0,1,0,0,0,1|1,0,0]=3 3527 B8R0.19 C\C(\C=O)=C\C(=O)OC Amb18642569 [0,1,0,0,0,1|1,0,0]=3 3528 B8R0.19 C\C(\CC(=O)C=C)=C\C Amb25093521 [0,1,0,0,0,1|1,0,0]=3 3529 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [0,1,0,0,0,1|1,0,0]=3 3530 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [0,1,0,0,0,1|0,0,0]=2 3531 B8R0.19 C\C(\CC(=O)OC)=C\Cl Amb25210836 [0,1,0,0,0,1|1,0,0]=3 3532 B8R0.19 C\C(\CCl)=C\C(=O)OC Amb25230685 [0,1,0,0,0,1|1,0,1]=4 3533 B8R0.19 C\C=C(/C)\C[C@@H](C)C=O Amb24353179 [0,1,0,0,0,1|1,0,1]=4 3534 B8R0.19 C\C=C(/C)\C[C@H](C)C=O Amb25095170 [0,1,0,0,0,1|1,0,1]=4 3535 B8R0.19 C\C=C(\C)/C=C(C)CO Amb24593565 [0,1,0,0,0,1|1,0,0]=3 3536 B8R0.19 C\C=C(\C)/CC(C)C=O Amb24709133 [0,1,0,0,0,1|1,0,1]=4 3537 B8R0.19 C\C=C(\C)/CC(C)CO Amb25842247 [0,1,0,0,0,1|1,0,1]=4 3538 B8R0.19 C\C=C(\C)/CC(O)C=C Amb25796308 [0,1,0,0,0,1|1,0,1]=4 3539 B8R0.19 C\C=C(\C)/CC(O)CCl Amb24560937 [0,1,0,0,0,1|1,0,1]=4 3540 B8R0.19 C\C=C(\C)/C[C@H](C)CO Amb25722949 [0,1,0,0,0,1|1,0,1]=4 3541 B8R0.23 C=C(CC(O)=O)C(N)=O Amb22011744 [0,1,0,0,0,1|1,0,1]=4 3542 B8R0.23 CC(=C)C(=O)OC(N)=O Amb25662245 [0,1,0,0,0,1|2,0,0]=4 3543 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,1,0,0,0,1|0,0,1]=3 3544 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,1,0,0,0,1|1,0,1]=4 3545 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,1,0,0,0,1|1,0,1]=4 3546 B8R0.23 CC(=CC(=O)Cl)C(=O)Cl Amb24464565 [0,1,0,0,0,1|2,0,0]=4 3547 B8R0.23 CC(=CC(N)=O)C(O)=O Amb24744881 [0,1,0,0,0,1|2,0,0]=4 3548 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,1,0,0,0,1|0,0,1]=3 3549 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,1,0,0,0,1|0,0,1]=3 3550 B8R0.23 CC(=CC(O)=O)[N+]([O-])=O Amb24685014 [0,1,0,0,0,1|2,0,0]=4 3551 B8R0.23 CC(=NC(N)=O)N(C)C Amb25146193 [0,1,0,0,0,1|2,0,0]=4 3552 B8R0.23 CC(=O)C(=C)NC(C)=O Amb24096350 [0,1,0,0,0,1|1,0,1]=4 3553 B8R0.23 CC(=O)C(=O)CC(C)=O Amb25806867 [0,1,0,0,0,1|2,0,0]=4 3554 B8R0.23 CC(=O)C(=O)NC(N)=O Amb24411479 [0,1,0,0,0,1|2,0,0]=4 3555 B8R0.23 CC(=O)C(C)=NC(C)=O Amb25349449 [0,1,0,0,0,1|1,0,0]=3 3556 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,1,0,0,0,1|0,0,1]=3 3557 B8R0.23 CC(=O)C(C)OC(=O)Cl Amb24721759 [0,1,0,0,0,1|1,0,1]=4 3558 B8R0.23 CC(=O)C(C)SC(C)=O Amb25833387 [0,1,0,0,0,1|1,0,1]=4 3559 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,1,0,0,0,1|1,0,1]=4 3560 B8R0.23 CC(=O)C(O)=CC(O)=O Amb25261166 [0,1,0,0,0,1|1,0,0]=3 3561 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,1,0,0,0,1|1,0,1]=4 3562 B8R0.23 CC(=O)CC(=O)C(C)=C Amb17934088 [0,1,0,0,0,1|2,0,0]=4 3563 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,1,0,0,0,1|1,0,1]=4 3564 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,1,0,0,0,1|0,0,1]=3 3565 B8R0.23 CC(=O)[C@@H](C)OC(C)=O Amb25205804 [0,1,0,0,0,1|1,0,1]=4 3566 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,1|1,0,1]=4 3567 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,1,0,0,0,1|0,0,1]=3 3568 B8R0.23 CC(=O)[C@H](C)NC(C)=O Amb24072918 [0,1,0,0,0,1|1,0,1]=4 3569 B8R0.23 CC(=O)\C(\C)=C/C(C)=O Amb24447751 [0,1,0,0,0,1|1,0,0]=3 3570 B8R0.23 CC(=O)\C(\C)=C\C(C)=O Amb25773462 [0,1,0,0,0,1|1,0,0]=3 3571 B8R0.23 CC(=O)\C(\C)=C\C(O)=O Amb22359749 [0,1,0,0,0,1|0,0,0]=2 3572 B8R0.23 CC(=O)\C(\C)=C\[N+]([O-])=O Amb24730259 [0,1,0,0,0,1|1,0,1]=4 3573 B8R0.23 CC(=O)\C(\C)=N/C(C)=O Amb24072927 [0,1,0,0,0,1|1,0,0]=3 3574 B8R0.23 CC(=O)\C=C(/C)\C(O)=O Amb18642577 [0,1,0,0,0,1|2,0,0]=4 3575 B8R0.23 CC(=O)\C=C(/Cl)\C(C)=C Amb25322822 [0,1,0,0,0,1|2,0,0]=4 3576 B8R0.23 CC(=O)\C=C(\C)/C(O)=O Amb24582978 [0,1,0,0,0,1|2,0,0]=4 3577 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,1|0,0,2]=4 3578 B8R0.23 CC(C)=C(Br)CC(N)=O Amb24478813 [0,1,0,0,0,1|2,0,0]=4 3579 B8R0.23 CC(C)=C(C)C=C(C)C Amb22365199 [0,1,0,0,0,1|2,0,0]=4 3580 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,1,0,0,0,1|0,0,0]=2 3581 B8R0.23 CC(C)=C(Cl)CC(N)=O Amb24679667 [0,1,0,0,0,1|2,0,0]=4 3582 B8R0.23 CC(C)C(/C)=C/C(C)=O Amb17778974 [0,1,0,0,0,1|1,0,1]=4 3583 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,1,0,0,0,1|0,0,2]=4 3584 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,1,0,0,0,1|1,0,1]=4 3585 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,1,0,0,0,1|1,0,1]=4 3586 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,1,0,0,0,1|1,0,1]=4 3587 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,1,0,0,0,1|1,0,1]=4 3588 B8R0.23 CC(CC(O)=O)=P(O)=O Amb25264110 [0,1,0,0,0,1|2,0,0]=4 3589 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,1|0,0,2]=4 3590 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,1,0,0,0,1|1,0,1]=4 3591 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,1,0,0,0,1|1,0,1]=4 3592 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,1,0,0,0,1|1,0,1]=4 3593 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,1,0,0,0,1|1,0,1]=4 3594 B8R0.23 CC(N)=[N+](C)CC([O-])=O Amb25339595 [0,1,0,0,0,1|1,0,1]=4 3595 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,1|0,0,2]=4 3596 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,1,0,0,0,1|0,0,1]=3 3597 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,1,0,0,0,1|2,0,0]=4 3598 B8R0.23 CN(CC(O)=O)C(N)=N Amb22002328 [0,1,0,0,0,1|2,0,0]=4 3599 B8R0.23 CN(CC(O)=O)C(N)=N Amb22167307 [0,1,0,0,0,1|2,0,0]=4 3600 B8R0.23 CN(CC(O)=O)C(N)=S Amb25115737 [0,1,0,0,0,1|2,0,0]=4 3601 B8R0.23 CN(CC(O)=O)[13C](N)=N Amb22367285 [0,1,0,0,0,1|2,0,0]=4 3602 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,1,0,0,0,1|2,0,0]=4 3603 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,1|0,0,2]=4 3604 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,1,0,0,0,1|1,0,1]=4 3605 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,1,0,0,0,1|1,0,1]=4 3606 B8R0.23 C\C(=C/C(C)=O)\C(C)=C Amb25143380 [0,1,0,0,0,1|1,0,0]=3 3607 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,1,0,0,0,1|0,0,1]=3 3608 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,1,0,0,0,1|0,0,1]=3 3609 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,1,0,0,0,1|0,0,1]=3 3610 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,1,0,0,0,1|0,0,1]=3 3611 B8R0.23 C\C(=C\C(C)=C)\C(C)=O Amb24478341 [0,1,0,0,0,1|2,0,0]=4 3612 B8R0.23 C\C(=C\C(C)=O)\C(=C)Cl Amb25202638 [0,1,0,0,0,1|1,0,1]=4 3613 B8R0.23 C\C(=C\C(C)=O)\C(C)C Amb25706913 [0,1,0,0,0,1|1,0,1]=4 3614 B8R0.23 C\C(=C\C(C)=O)\N(C)C Amb25767857 [0,1,0,0,0,1|2,0,0]=4 3615 B8R0.23 C\C(=C\C(C)O)\C(C)=C Amb25198173 [0,1,0,0,0,1|1,0,1]=4 3616 B8R0.23 C\C(=C\C(N)=O)\C(N)=O Amb25146105 [0,1,0,0,0,1|2,0,0]=4 3617 B8R0.23 C\C(=C\C(N)=O)\C(O)=O Amb25199871 [0,1,0,0,0,1|2,0,0]=4 3618 B8R0.23 C\C(=C\C(O)=O)\C(=N)O Amb24387420 [0,1,0,0,0,1|1,0,0]=3 3619 B8R0.23 OC(=O)C(=S)CC(O)=O Amb25304511 [0,1,0,0,0,1|2,0,0]=4 3620 B8R0.23 OC(=O)CC(=C(Cl)Cl)Cl Amb2227973 [0,1,0,0,0,1|2,0,0]=4 3621 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,1,0,0,0,1|1,0,0]=3 3622 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,1,0,0,0,1|1,0,1]=4 3623 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,1,0,0,0,1|1,0,0]=3 3624 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,1,0,0,0,1|2,0,0]=4 3625 B8R0.23 OC(=O)CN(C(=S)S)C Amb1042470 [0,1,0,0,0,1|2,0,0]=4 3626 B8R0.23 OC(=O)\C(\Br)=C/C(O)=O Amb25746120 [0,1,0,0,0,1|2,0,0]=4 3627 B8R0.23 OC(=O)\C(\Cl)=C/C(O)=O Amb24481892 [0,1,0,0,0,1|2,0,0]=4 3628 B8R0.23 OC(=O)\C(\F)=C/C(O)=O Amb18124397 [0,1,0,0,0,1|2,0,0]=4 3629 B8R0.23 OC(=O)\C(\I)=C/C(O)=O Amb25736420 [0,1,0,0,0,1|2,0,0]=4 3630 B8R0.23 OC(=O)\C=C(\C(=C)C)/C Amb17593311 [0,1,0,0,0,1|0,0,0]=2 3631 B8R0.23 [13CH3]N(CC(O)=O)C(N)=N Amb22367286 [0,1,0,0,0,1|2,0,0]=4 3632 B8R0.24 CC(CS(O)(=O)=O)=CCl Amb25179000 [0,1,0,0,0,1|2,0,0]=4 3633 B8R0.24 C\C(\CS(O)(=O)=O)=C\Cl Amb25374814 [0,1,0,0,0,1|2,0,0]=4 3634 B8R0.24 C\C=C(\C)/OP(O)(O)=O Amb24760652 [0,1,0,0,0,1|1,0,0]=3 3635 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,1,0,0,0,1|0,0,2]=4 3636 B8R0.34 CC(O)(CC(O)=O)C=C Amb18642755 [0,1,0,0,0,1|0,0,2]=4 3637 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,1,0,0,0,1|0,0,2]=4 3638 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,1,0,0,0,1|0,0,2]=4 3639 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,1,0,0,0,1|0,0,2]=4 3640 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,1,0,0,0,1|0,0,2]=4 3641 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,1,0,0,0,1|0,0,2]=4 3642 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,1,0,0,0,1|0,0,2]=4 3643 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,1,0,0,0,1|0,0,2]=4 3644 B8R0.34 CC[N+](C)(C)CC(O)=O Amb24390383 [0,1,0,0,0,1|1,0,1]=4 3645 B8R0.34 CNC(C)(C)CC(O)=O Amb25710043 [0,1,0,0,0,1|1,0,1]=4 3646 B8R0.34 CSC(C)(C)CC(O)=O Amb25304571 [0,1,0,0,0,1|1,0,1]=4 3647 B8R0.3 CC#CC(=O)C(=O)OC Amb25031662 [0,2,0,0,0,0|1,0,1]=4 3648 B8R0.3 CC#CC(O)\C(\C)=C/C Amb25107536 [0,2,0,0,0,0|1,0,1]=4 3649 B8R0.3 CC(=C=C)C(=O)OCC Amb25147228 [0,2,0,0,0,0|0,0,2]=4 3650 B8R0.3 CC(=CC#N)C(=O)OC Amb24592215 [0,2,0,0,0,0|0,0,1]=3 3651 B8R0.3 CC(=CC)C(=N)OCC Amb25248637 [0,2,0,0,0,0|1,0,0]=3 3652 B8R0.3 CC(=CC)C(=O)OCC Amb24718920 [0,2,0,0,0,0|0,0,0]=2 3653 B8R0.3 CC(=CCCl)C(=O)OC Amb19149007 [0,2,0,0,0,0|0,0,0]=2 3654 B8R0.3 CC(=CCS)C(=O)OC Amb25077622 [0,2,0,0,0,0|0,0,0]=2 3655 B8R0.3 CC(=CNC)C(=O)CC Amb25174869 [0,2,0,0,0,0|1,0,0]=3 3656 B8R0.3 CC(=CO)C(=O)CCC Amb24642051 [0,2,0,0,0,0|2,0,0]=4 3657 B8R0.3 CC(=CO)C(=O)OCC Amb25802793 [0,2,0,0,0,0|1,0,0]=3 3658 B8R0.3 CC(=NOC)C(=O)CBr Amb24390926 [0,2,0,0,0,0|2,0,0]=4 3659 B8R0.3 CC(=NOC)C(=O)CC Amb24708598 [0,2,0,0,0,0|2,0,0]=4 3660 B8R0.3 CC(=NOC)C(N)=NO Amb25254144 [0,2,0,0,0,0|2,0,0]=4 3661 B8R0.3 CC(=[N+]=[N-])C(=O)OCC Amb24481992 [0,2,0,0,0,0|2,0,0]=4 3662 B8R0.3 CC(C(=O)OC)CCCl Amb16230918 [0,2,0,0,0,0|0,0,2]=4 3663 B8R0.3 CC(CC=C)C(=O)CO Amb25662371 [0,2,0,0,0,0|0,0,2]=4 3664 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|0,0,2]=4 3665 B8R0.3 CC(CCN)C(=O)NO Amb24387287 [0,2,0,0,0,0|0,0,2]=4 3666 B8R0.3 CC(CO)C(C)=CCO Amb25265627 [0,2,0,0,0,0|1,0,1]=4 3667 B8R0.3 CC(NC)=C(C)C=NC Amb24428718 [0,2,0,0,0,0|2,0,0]=4 3668 B8R0.3 CCC(=C)C(=O)OCC Amb22353551 [0,2,0,0,0,0|0,0,2]=4 3669 B8R0.3 CCC(=N)C(=O)OCC Amb24063521 [0,2,0,0,0,0|1,0,1]=4 3670 B8R0.3 CCC(=O)\C(\F)=C/CC Amb24511455 [0,2,0,0,0,0|2,0,0]=4 3671 B8R0.3 CCC(=O)\C(\F)=C\CC Amb25358941 [0,2,0,0,0,0|2,0,0]=4 3672 B8R0.3 CCC(C)=C(C)CCO Amb25136261 [0,2,0,0,0,0|1,0,1]=4 3673 B8R0.3 CCC(C)C(=O)NOC Amb24709831 [0,2,0,0,0,0|0,0,2]=4 3674 B8R0.3 CCC(C)C(=O)\C=N\O Amb25768458 [0,2,0,0,0,0|0,0,2]=4 3675 B8R0.3 CCCC(=C)C(=O)OC Amb25689366 [0,2,0,0,0,0|0,0,2]=4 3676 B8R0.3 CCCC(=O)C(=O)OC Amb22755107 [0,2,0,0,0,0|1,0,1]=4 3677 B8R0.3 CCCC(=O)C(Cl)=CC Amb25252050 [0,2,0,0,0,0|2,0,0]=4 3678 B8R0.3 CCCC(C)C(=O)CO Amb25134141 [0,2,0,0,0,0|0,0,2]=4 3679 B8R0.3 CCCC(O)C(C)=CC Amb24355191 [0,2,0,0,0,0|1,0,1]=4 3680 B8R0.3 CCCN(C)C(=O)CO Amb25761673 [0,2,0,0,0,0|1,0,1]=4 3681 B8R0.3 CCCN(C)C(=O)OC Amb25044414 [0,2,0,0,0,0|1,0,1]=4 3682 B8R0.3 CCN(C)C(=O)NOC Amb25711901 [0,2,0,0,0,0|1,0,1]=4 3683 B8R0.3 CCNC(=O)C(=O)NO Amb25757913 [0,2,0,0,0,0|1,0,1]=4 3684 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|0,0,2]=4 3685 B8R0.3 CCOC(=O)C(/C)=C\O Amb17844070 [0,2,0,0,0,0|1,0,0]=3 3686 B8R0.3 CCOC(=O)C(=N)SC Amb25795405 [0,2,0,0,0,0|2,0,0]=4 3687 B8R0.3 CCOC(=O)C(=O)CC Amb15701231 [0,2,0,0,0,0|1,0,1]=4 3688 B8R0.3 CCOC(=O)C(=O)CO Amb25333851 [0,2,0,0,0,0|1,0,1]=4 3689 B8R0.3 CCOC(=O)C(=O)O[K] Amb22043915 [0,2,0,0,0,0|1,0,1]=4 3690 B8R0.3 CCOC(=O)C(=S)NC Amb24681047 [0,2,0,0,0,0|2,0,0]=4 3691 B8R0.3 CCOC(=O)C(C)C=C Amb24461946 [0,2,0,0,0,0|0,0,2]=4 3692 B8R0.3 CCOC(=O)C(C)NC Amb18523843 [0,2,0,0,0,0|1,0,1]=4 3693 B8R0.3 CCOC(=O)C(C)SC Amb19374135 [0,2,0,0,0,0|1,0,1]=4 3694 B8R0.3 CCOC(=O)C(Cl)=NC Amb24395155 [0,2,0,0,0,0|2,0,0]=4 3695 B8R0.3 CCOC(=O)C(N)=CN Amb24571281 [0,2,0,0,0,0|2,0,0]=4 3696 B8R0.3 CCOC(=O)[C@H](C)NC Amb24399999 [0,2,0,0,0,0|1,0,1]=4 3697 B8R0.3 CCOC(=O)\C(\Br)=C\Br Amb24339171 [0,2,0,0,0,0|2,0,0]=4 3698 B8R0.3 CCOC(=O)\C(\N)=C\N Amb25810118 [0,2,0,0,0,0|2,0,0]=4 3699 B8R0.3 CCON(C)C(=O)CO Amb24631803 [0,2,0,0,0,0|1,0,1]=4 3700 B8R0.3 CCSC(C)C(=O)OC Amb24457258 [0,2,0,0,0,0|0,0,2]=4 3701 B8R0.3 CC\C(\C)=C(/C)\CC=O Amb25743409 [0,2,0,0,0,0|1,0,1]=4 3702 B8R0.3 CC\C=C(/N)\C(=O)OC Amb24447011 [0,2,0,0,0,0|1,0,0]=3 3703 B8R0.3 CC\C=C(\C)/C(O)C#C Amb24518511 [0,2,0,0,0,0|1,0,1]=4 3704 B8R0.3 CC\C=C(\C)/C(O)C#N Amb25746169 [0,2,0,0,0,0|1,0,1]=4 3705 B8R0.3 CC\C=C(\C)/[C@@H](O)C#C Amb25056806 [0,2,0,0,0,0|1,0,1]=4 3706 B8R0.3 CC\C=C(\C)/[C@@H](O)C#N Amb25098679 [0,2,0,0,0,0|1,0,1]=4 3707 B8R0.3 CC\C=C(\C)/[C@H](O)C#C Amb24672567 [0,2,0,0,0,0|1,0,1]=4 3708 B8R0.3 CN(CC)C(=O)OCC Amb25837294 [0,2,0,0,0,0|1,0,1]=4 3709 B8R0.3 CN(CC=O)C(=O)CO Amb24084373 [0,2,0,0,0,0|2,0,0]=4 3710 B8R0.3 CNC(=O)C(=O)NOC Amb24476711 [0,2,0,0,0,0|2,0,0]=4 3711 B8R0.3 CNC(C)C(=O)NOC Amb24425869 [0,2,0,0,0,0|1,0,1]=4 3712 B8R0.3 CN[C@@H](C)C(=O)NOC Amb24380175 [0,2,0,0,0,0|1,0,1]=4 3713 B8R0.3 COC(=C)C(=O)CCO Amb25718027 [0,2,0,0,0,0|1,0,1]=4 3714 B8R0.3 COC(=C)C(=O)COC Amb24662273 [0,2,0,0,0,0|1,0,1]=4 3715 B8R0.3 COC(=O)C(=C)CC=O Amb25827223 [0,2,0,0,0,0|1,0,1]=4 3716 B8R0.3 COC(=O)C(=C)CCBr Amb25190553 [0,2,0,0,0,0|0,0,2]=4 3717 B8R0.3 COC(=O)C(=N)OCC Amb24657206 [0,2,0,0,0,0|1,0,1]=4 3718 B8R0.3 COC(=O)C(=O)OCC Amb25245154 [0,2,0,0,0,0|1,0,1]=4 3719 B8R0.3 COC(=O)C(=O)\C=C\N Amb24614540 [0,2,0,0,0,0|1,0,1]=4 3720 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 3721 B8R0.3 COC(=O)C(C)NC=O Amb25147028 [0,2,0,0,0,0|1,0,1]=4 3722 B8R0.3 COC(=O)C(F)=CCBr Amb24739721 [0,2,0,0,0,0|1,0,0]=3 3723 B8R0.3 COC(=O)N(C)CC=O Amb25216418 [0,2,0,0,0,0|2,0,0]=4 3724 B8R0.3 COC(=O)N(C)CCN Amb18975991 [0,2,0,0,0,0|1,0,1]=4 3725 B8R0.3 COC(=O)[C@@H](C)CC=O Amb25683366 [0,2,0,0,0,0|1,0,1]=4 3726 B8R0.3 COC(=O)[C@@H](C)NC=O Amb25716179 [0,2,0,0,0,0|1,0,1]=4 3727 B8R0.3 COC(=O)[C@@H](C)OCC Amb25113653 [0,2,0,0,0,0|0,0,2]=4 3728 B8R0.3 COC(=O)[C@H](C)NC=O Amb24476955 [0,2,0,0,0,0|1,0,1]=4 3729 B8R0.3 COC(=O)\C(=C/C#N)\Cl Amb17593649 [0,2,0,0,0,0|1,0,1]=4 3730 B8R0.3 COC(=O)\C(\F)=C\OC Amb22641700 [0,2,0,0,0,0|1,0,0]=3 3731 B8R0.3 COC(C)C(=O)OCC Amb25692036 [0,2,0,0,0,0|1,0,1]=4 3732 B8R0.3 COC(C)C(C)=CCO Amb25295591 [0,2,0,0,0,0|1,0,1]=4 3733 B8R0.3 COCC(=O)C(=O)SC Amb24529027 [0,2,0,0,0,0|2,0,0]=4 3734 B8R0.3 CON(C)C(=O)COC Amb20672170 [0,2,0,0,0,0|2,0,0]=4 3735 B8R0.3 CON(C)C(=O)NOC Amb24732084 [0,2,0,0,0,0|2,0,0]=4 3736 B8R0.3 CON(C)C(=O)OCC Amb22338318 [0,2,0,0,0,0|2,0,0]=4 3737 B8R0.3 CO[C@H](C)C(=O)OCC Amb25146887 [0,2,0,0,0,0|1,0,1]=4 3738 B8R0.3 C[C@H](NCC)C(=O)NO Amb24700450 [0,2,0,0,0,0|0,0,2]=4 3739 B8R0.3 C\C(=C/Br)\C(=O)OCC Amb19889793 [0,2,0,0,0,0|1,0,0]=3 3740 B8R0.3 C\C(=C/Br)\C(\C)=C\CO Amb24480267 [0,2,0,0,0,0|2,0,0]=4 3741 B8R0.3 C\C(=C/C)\C(=O)N=[N+]=[N-] Amb25095098 [0,2,0,0,0,0|1,0,0]=3 3742 B8R0.3 C\C(=C/C=O)\C(=O)OC Amb25286310 [0,2,0,0,0,0|0,0,1]=3 3743 B8R0.3 C\C(=C/CC)\C(=O)C=C Amb24690819 [0,2,0,0,0,0|1,0,0]=3 3744 B8R0.3 C\C(=C/CC)\C(=O)NN Amb24428182 [0,2,0,0,0,0|1,0,0]=3 3745 B8R0.3 C\C(=C/CC)\C(=O)OC Amb22360680 [0,2,0,0,0,0|0,0,0]=2 3746 B8R0.3 C\C(=C/CC)\C(O)CC Amb22052676 [0,2,0,0,0,0|1,0,1]=4 3747 B8R0.3 C\C(=C/CCl)\C(=O)OC Amb24685271 [0,2,0,0,0,0|0,0,0]=2 3748 B8R0.3 C\C(=C/CN)\C(=O)OC Amb25031314 [0,2,0,0,0,0|0,0,0]=2 3749 B8R0.3 C\C(=C/N)\C(=O)OCC Amb25077150 [0,2,0,0,0,0|1,0,0]=3 3750 B8R0.3 C\C(=C/NC)\C(=O)CC Amb25833280 [0,2,0,0,0,0|1,0,0]=3 3751 B8R0.3 C\C(=C/O)\C(=O)COC Amb24424847 [0,2,0,0,0,0|1,0,0]=3 3752 B8R0.3 C\C(=C/OC)\C(=O)CC Amb22337425 [0,2,0,0,0,0|1,0,0]=3 3753 B8R0.3 C\C(=C/OC)\C(=O)OC Amb22547337 [0,2,0,0,0,0|0,0,0]=2 3754 B8R0.3 C\C(=C\C#N)\C(=O)NC Amb24477026 [0,2,0,0,0,0|1,0,1]=4 3755 B8R0.3 C\C(=C\CC)\C(=N)NO Amb25294318 [0,2,0,0,0,0|1,0,0]=3 3756 B8R0.3 C\C(=C\CC)\C(=O)C=C Amb24633407 [0,2,0,0,0,0|1,0,0]=3 3757 B8R0.3 C\C(=C\CC)\C(=O)NN Amb24592301 [0,2,0,0,0,0|1,0,0]=3 3758 B8R0.3 C\C(=C\CC)\C(=O)NN Amb25108374 [0,2,0,0,0,0|1,0,0]=3 3759 B8R0.3 C\C(=C\Cl)\C(=O)OCC Amb25045062 [0,2,0,0,0,0|1,0,0]=3 3760 B8R0.3 C\C(=C\NC)\C(=O)CC Amb25202679 [0,2,0,0,0,0|1,0,0]=3 3761 B8R0.3 C\C(=N/CC)\C(=O)CC Amb24340117 [0,2,0,0,0,0|1,0,1]=4 3762 B8R0.3 C\C(=N/OC)\C(=O)CC Amb25348555 [0,2,0,0,0,0|2,0,0]=4 3763 B8R0.3 C\C(=N/OC)\C(\N)=N\O Amb24745599 [0,2,0,0,0,0|2,0,0]=4 3764 B8R0.3 C\C(=N\N)\C(=O)OCC Amb24478280 [0,2,0,0,0,0|2,0,0]=4 3765 B8R0.3 C\C(=N\NC)\C(=O)OC Amb25229493 [0,2,0,0,0,0|1,0,0]=3 3766 B8R0.3 C\C(=N\O)\C(=O)OCC Amb2459671 [0,2,0,0,0,0|2,0,0]=4 3767 B8R0.3 C\C(\C=O)=C(\O)/CCC Amb25313114 [0,2,0,0,0,0|2,0,0]=4 3768 B8R0.3 C\C(\CC=C)=C(\Br)/CO Amb24420839 [0,2,0,0,0,0|1,0,1]=4 3769 B8R0.3 C\C(\CO)=C(\C)/CC=C Amb24405577 [0,2,0,0,0,0|1,0,1]=4 3770 B8R0.3 C\C=C(\C)/C(/C)=C\CO Amb24361810 [0,2,0,0,0,0|1,0,0]=3 3771 B8R0.3 C\C=C(\C)/C(C)CCO Amb25105911 [0,2,0,0,0,0|1,0,1]=4 3772 B8R0.3 C\C=C(\C)/C(O)CC#C Amb25346205 [0,2,0,0,0,0|1,0,1]=4 3773 B8R0.3 C\C=C(\C)/C(O)CC=C Amb25855830 [0,2,0,0,0,0|1,0,1]=4 3774 B8R0.3 C\C=C(\C)/C(O)CCO Amb25296375 [0,2,0,0,0,0|0,0,2]=4 3775 B8R0.3 C\C=C/C(C)C(=O)CC Amb24575922 [0,2,0,0,0,0|1,0,1]=4 3776 B8R0.3 C\C=C/[C@@H](N)C(=O)OC Amb24744726 [0,2,0,0,0,0|1,0,1]=4 3777 B8R0.3 C\C=C\C(=O)C(=O)OC Amb24587426 [0,2,0,0,0,0|1,0,0]=3 3778 B8R0.3 C\C=C\C(=O)C(=O)SC Amb24752931 [0,2,0,0,0,0|1,1,0]=4 3779 B8R0.3 C\C=C\C(=O)\C(\Cl)=C/C Amb24512491 [0,2,0,0,0,0|2,0,0]=4 3780 B8R0.3 C\C=C\C(C)=C(C)CO Amb25792270 [0,2,0,0,0,0|1,0,0]=3 3781 B8R0.3 C\C=C\C(C)C(=C)C=O Amb24513043 [0,2,0,0,0,0|1,0,1]=4 3782 B8R0.3 C\C=C\C(C)C(=O)CO Amb24723648 [0,2,0,0,0,0|0,0,1]=3 3783 B8R0.3 C\C=C\C(O)C(=O)OC Amb25091584 [0,2,0,0,0,0|1,0,1]=4 3784 B8R0.3 C\C=C\[C@H](C)C(=C)CO Amb25108472 [0,2,0,0,0,0|1,0,1]=4 3785 B8R0.3 C\C=C\[C@H](O)C(=O)OC Amb24430980 [0,2,0,0,0,0|1,0,1]=4 3786 B8R0.3 OCCC(=O)C(=O)C=O Amb25303101 [0,2,0,0,0,0|2,0,0]=4 3787 B8R0.3 OCC\C(=C(/CO)\C)\C Amb17593379 [0,2,0,0,0,0|1,0,1]=4 3788 B8R0.8 C#CCCC(=O)C(O)=O Amb24657416 [0,2,0,0,0,0|1,0,1]=4 3789 B8R0.8 C=C(CCC=C)C(O)=O Amb18642395 [0,2,0,0,0,0|0,0,2]=4 3790 B8R0.8 C=C(CCCN)C(O)=O Amb18642697 [0,2,0,0,0,0|0,0,2]=4 3791 B8R0.8 C=C(CCON)C(O)=O Amb25859256 [0,2,0,0,0,0|0,0,2]=4 3792 B8R0.8 C=C(C\C=C/Cl)C(O)=O Amb24462692 [0,2,0,0,0,0|0,0,2]=4 3793 B8R0.8 C=C(C\C=C\Cl)C(O)=O Amb25174909 [0,2,0,0,0,0|0,0,2]=4 3794 B8R0.8 C=CCCC(=O)C(O)=O Amb25738669 [0,2,0,0,0,0|1,0,1]=4 3795 B8R0.8 CC#CC[C@@H](C)C(O)=O Amb24589724 [0,2,0,0,0,0|0,0,2]=4 3796 B8R0.8 CC#C\C=C(/C)\C(C)=O Amb24408442 [0,2,0,0,0,0|1,0,0]=3 3797 B8R0.8 CC#C\C=C(\C)/C(C)=O Amb25370738 [0,2,0,0,0,0|1,0,0]=3 3798 B8R0.8 CC(=C=NCC)C(C)=O Amb25145508 [0,2,0,0,0,0|1,0,1]=4 3799 B8R0.8 CC(=CCCCl)C(C)=C Amb25196243 [0,2,0,0,0,0|2,0,0]=4 3800 B8R0.8 CC(=CCCF)C(O)=O Amb24359141 [0,2,0,0,0,0|0,0,0]=2 3801 B8R0.8 CC(=CCCO)C(C)=C Amb25071397 [0,2,0,0,0,0|2,0,0]=4 3802 B8R0.8 CC(=NCCC)C(N)=O Amb25372262 [0,2,0,0,0,0|1,0,1]=4 3803 B8R0.8 CC(=O)C(=C)C\C=C\C Amb24690625 [0,2,0,0,0,0|1,0,1]=4 3804 B8R0.8 CC(=O)C(=C)\C=C\CC Amb25074493 [0,2,0,0,0,0|1,0,1]=4 3805 B8R0.8 CC(=O)C(Br)=COCC Amb24097521 [0,2,0,0,0,0|2,0,0]=4 3806 B8R0.8 CC(=O)C(C)=CCCO Amb24617765 [0,2,0,0,0,0|1,0,0]=3 3807 B8R0.8 CC(=O)C(C)=NCCO Amb24625306 [0,2,0,0,0,0|1,0,1]=4 3808 B8R0.8 CC(=O)\C(\Br)=C/OCC Amb25715760 [0,2,0,0,0,0|2,0,0]=4 3809 B8R0.8 CC(=O)\C(\C)=C\CCO Amb25735231 [0,2,0,0,0,0|1,0,0]=3 3810 B8R0.8 CC(=O)\C(\C)=N/NC=O Amb24478105 [0,2,0,0,0,0|2,0,0]=4 3811 B8R0.8 CC(=O)\C(\C)=N\NC=O Amb25747449 [0,2,0,0,0,0|2,0,0]=4 3812 B8R0.8 CC(=O)\C(\Cl)=C\CCC Amb24388360 [0,2,0,0,0,0|2,0,0]=4 3813 B8R0.8 CC(=O)\C(\Cl)=C\OCC Amb25272669 [0,2,0,0,0,0|2,0,0]=4 3814 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [0,2,0,0,0,0|0,0,2]=4 3815 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [0,2,0,0,0,0|0,0,2]=4 3816 B8R0.8 CC(C=CCO)=C(Cl)Cl Amb25725423 [0,2,0,0,0,0|2,0,0]=4 3817 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [0,2,0,0,0,0|0,0,2]=4 3818 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [0,2,0,0,0,0|0,0,2]=4 3819 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [0,2,0,0,0,0|0,0,2]=4 3820 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [0,2,0,0,0,0|0,0,2]=4 3821 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [0,2,0,0,0,0|0,0,2]=4 3822 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [0,2,0,0,0,0|0,0,2]=4 3823 B8R0.8 CC(CNC=O)C(O)=O Amb18299693 [0,2,0,0,0,0|1,0,1]=4 3824 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [0,2,0,0,0,0|0,0,2]=4 3825 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [0,2,0,0,0,0|0,0,2]=4 3826 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [0,2,0,0,0,0|0,0,2]=4 3827 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [0,2,0,0,0,0|0,0,2]=4 3828 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [0,2,0,0,0,0|0,0,2]=4 3829 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [0,2,0,0,0,0|0,0,2]=4 3830 B8R0.8 CCCCC(=C)C(O)=O Amb18642649 [0,2,0,0,0,0|0,0,2]=4 3831 B8R0.8 CCCCC(=O)C(O)=O Amb18642761 [0,2,0,0,0,0|1,0,1]=4 3832 B8R0.8 CCCCC(=O)C(O)=O Amb22348245 [0,2,0,0,0,0|1,0,1]=4 3833 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [0,2,0,0,0,0|0,0,2]=4 3834 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [0,2,0,0,0,0|0,0,2]=4 3835 B8R0.8 CCCOC(=C)C(O)=O Amb18642781 [0,2,0,0,0,0|0,0,2]=4 3836 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [0,2,0,0,0,0|0,0,2]=4 3837 B8R0.8 CCC\C=C(/C)\[N+]([O-])=O Amb24732512 [0,2,0,0,0,0|1,0,1]=4 3838 B8R0.8 CCC\C=C(/N)\C(N)=O Amb25146004 [0,2,0,0,0,0|2,0,0]=4 3839 B8R0.8 CCC\C=C(\C(=O)C)/C Amb17593317 [0,2,0,0,0,0|1,0,0]=3 3840 B8R0.8 CCC\C=C(\N)/C(N)=O Amb24515061 [0,2,0,0,0,0|2,0,0]=4 3841 B8R0.8 CCNCC(=C)C(O)=O Amb24368916 [0,2,0,0,0,0|0,0,2]=4 3842 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [0,2,0,0,0,0|0,0,2]=4 3843 B8R0.8 CCO\C=C(/F)\C(O)=O Amb25128018 [0,2,0,0,0,0|1,0,0]=3 3844 B8R0.8 CCSCC(=O)C(O)=O Amb24670679 [0,2,0,0,0,0|1,0,1]=4 3845 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,2,0,0,0,0|1,0,1]=4 3846 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [0,2,0,0,0,0|0,0,1]=3 3847 B8R0.8 CC\C=C\C(N)C(O)=O Amb18642708 [0,2,0,0,0,0|1,0,1]=4 3848 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [0,2,0,0,0,0|0,0,2]=4 3849 B8R0.8 COCCC(C)C(O)=O Amb18523823 [0,2,0,0,0,0|0,0,2]=4 3850 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [0,2,0,0,0,0|0,0,2]=4 3851 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [0,2,0,0,0,0|0,0,2]=4 3852 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [0,2,0,0,0,0|0,0,2]=4 3853 B8R0.8 COC\C=C(\Br)/C(O)=O Amb24580462 [0,2,0,0,0,0|1,0,0]=3 3854 B8R0.8 CO\C=C/C(C)C(C)=O Amb25723165 [0,2,0,0,0,0|1,0,1]=4 3855 B8R0.8 CO\C=C/C(C)C(O)=O Amb18642780 [0,2,0,0,0,0|0,0,1]=3 3856 B8R0.8 CO\C=C\C(=O)C(=O)Cl Amb25135276 [0,2,0,0,0,0|2,0,0]=4 3857 B8R0.8 CO\C=C\C(=O)C(O)=O Amb24740124 [0,2,0,0,0,0|1,0,0]=3 3858 B8R0.8 CO\C=C\C(C)C(O)=O Amb25188040 [0,2,0,0,0,0|0,0,1]=3 3859 B8R0.8 CO\C=C\C(N)C(O)=O Amb18642835 [0,2,0,0,0,0|1,0,1]=4 3860 B8R0.8 CO\C=C\[C@H](N)C(O)=O Amb24478831 [0,2,0,0,0,0|1,0,1]=4 3861 B8R0.8 CSCCC(=O)C(O)=O Amb18643588 [0,2,0,0,0,0|1,0,1]=4 3862 B8R0.8 CSCCC(=O)C(O)=O Amb22274154 [0,2,0,0,0,0|1,0,1]=4 3863 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [0,2,0,0,0,0|0,0,2]=4 3864 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [0,2,0,0,0,0|0,0,2]=4 3865 B8R0.8 C[C@@H](NCC#N)C(O)=O Amb24481672 [0,2,0,0,0,0|1,0,1]=4 3866 B8R0.8 C[C@@H](NCC=C)C(O)=O Amb24481671 [0,2,0,0,0,0|0,0,2]=4 3867 B8R0.8 C[C@@H](OCC#N)C(O)=O Amb25050099 [0,2,0,0,0,0|1,0,1]=4 3868 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [0,2,0,0,0,0|0,0,2]=4 3869 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [0,2,0,0,0,0|0,0,2]=4 3870 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [0,2,0,0,0,0|0,0,2]=4 3871 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [0,2,0,0,0,0|0,0,2]=4 3872 B8R0.8 C[C@H](NCC#C)C(O)=O Amb25697652 [0,2,0,0,0,0|1,0,1]=4 3873 B8R0.8 C[C@H](OCC#C)C(O)=O Amb25852095 [0,2,0,0,0,0|1,0,1]=4 3874 B8R0.8 C\C(=C/C=C/C)\C(O)=O Amb18642423 [0,2,0,0,0,0|0,0,0]=2 3875 B8R0.8 C\C(=C/CC=C)\C(O)=O Amb18642394 [0,2,0,0,0,0|0,0,0]=2 3876 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [0,2,0,0,0,0|0,0,0]=2 3877 B8R0.8 C\C(=C/NCC)\C(C)=O Amb25767856 [0,2,0,0,0,0|1,0,0]=3 3878 B8R0.8 C\C(=C\C#CC)\C(O)=O Amb24655041 [0,2,0,0,0,0|0,0,0]=2 3879 B8R0.8 C\C(=C\CC=C)\C(O)=O Amb25264925 [0,2,0,0,0,0|0,0,0]=2 3880 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [0,2,0,0,0,0|0,0,0]=2 3881 B8R0.8 C\C(=C\OCC)\C(O)=O Amb25741753 [0,2,0,0,0,0|0,0,0]=2 3882 B8R0.8 C\C(=N\CC=C)\C(C)=O Amb24340133 [0,2,0,0,0,0|1,0,1]=4 3883 B8R0.8 C\C(=N\OCC)\C(C)=O Amb25188961 [0,2,0,0,0,0|1,0,1]=4 3884 B8R0.8 C\C=C/C[C@H](N)C(O)=O Amb24713154 [0,2,0,0,0,0|1,0,1]=4 3885 B8R0.8 C\C=C\C=C(Br)C(O)=O Amb25294936 [0,2,0,0,0,0|1,0,0]=3 3886 B8R0.8 C\C=C\C=C(C)C(C)=O Amb25298494 [0,2,0,0,0,0|1,0,0]=3 3887 B8R0.8 C\C=C\C=C(Cl)C(O)=O Amb25259369 [0,2,0,0,0,0|1,0,0]=3 3888 B8R0.8 C\C=C\C=C(F)C(O)=O Amb24514833 [0,2,0,0,0,0|1,0,0]=3 3889 B8R0.8 C\C=C\C=C(O)C(O)=O Amb24550203 [0,2,0,0,0,0|1,0,0]=3 3890 B8R0.8 C\C=C\CC(=O)C(O)=O Amb18642583 [0,2,0,0,0,0|1,0,0]=3 3891 B8R0.8 C\C=C\CC(C)C(O)=O Amb18642630 [0,2,0,0,0,0|0,0,1]=3 3892 B8R0.8 C\C=C\CC(O)C(O)=O Amb18642742 [0,2,0,0,0,0|1,0,1]=4 3893 B8R0.8 C\C=C\C[C@@H](N)C(O)=O Amb24632390 [0,2,0,0,0,0|1,0,1]=4 3894 B8R0.8 N#CCNC(=O)C(O)=O Amb18063035 [0,2,0,0,0,0|2,0,0]=4 3895 B8R0.8 N=C(NCCO)C(O)=O Amb18124348 [0,2,0,0,0,0|1,0,1]=4 3896 B8R0.8 NC(\C=C\CO)C(O)=O Amb24586215 [0,2,0,0,0,0|1,0,1]=4 3897 B8R0.8 NC(\C=C\CP)C(O)=O Amb24351617 [0,2,0,0,0,0|1,0,1]=4 3898 B8R0.8 NCCCC(=O)C(O)=O Amb24081348 [0,2,0,0,0,0|1,0,1]=4 3899 B8R0.8 NCCNC(=O)C(O)=O Amb18977789 [0,2,0,0,0,0|1,0,1]=4 3900 B8R0.8 NC\C=C\C(N)C(O)=O Amb18642793 [0,2,0,0,0,0|1,0,1]=4 3901 B8R0.8 NC\C=C\[C@H](N)C(O)=O Amb24580033 [0,2,0,0,0,0|1,0,1]=4 3902 B8R0.8 OC(=O)C(=O)CCCBr Amb24711405 [0,2,0,0,0,0|1,0,1]=4 3903 B8R0.8 OC(=O)C(=O)CCCCl Amb25274323 [0,2,0,0,0,0|1,0,1]=4 3904 B8R0.8 OC(=O)C(=O)NCCO Amb24117944 [0,2,0,0,0,0|1,0,1]=4 3905 B8R0.8 OC(=O)C(=O)OCCCl Amb25378823 [0,2,0,0,0,0|1,0,1]=4 3906 B8R0.8 OC(=O)C(=O)\C=C\C=O Amb24392793 [0,2,0,0,0,0|1,0,1]=4 3907 B8R0.8 OC(=O)\C(\Br)=C\C=N\O Amb25779954 [0,2,0,0,0,0|1,0,1]=4 3908 B8R0.12 C=CCC(C(=O)O)(C)C Amb10603495 [0,2,0,0,0,0|0,0,2]=4 3909 B8R0.12 CC(C(=O)O)(CCC)Cl Amb17593751 [0,2,0,0,0,0|0,0,2]=4 3910 B8R0.12 CC(C)(CC=O)C(O)=O Amb24340256 [0,2,0,0,0,0|1,0,1]=4 3911 B8R0.12 CC(C)(CCBr)C(O)=O Amb24739595 [0,2,0,0,0,0|0,0,2]=4 3912 B8R0.12 CC(C)(CCO)C(O)=O Amb24763728 [0,2,0,0,0,0|0,0,2]=4 3913 B8R0.12 CC(C)(NC=O)C(O)=O Amb18281022 [0,2,0,0,0,0|1,0,1]=4 3914 B8R0.12 CC(C)(\C=C\Br)C(O)=O Amb24420866 [0,2,0,0,0,0|0,0,2]=4 3915 B8R0.12 CC(C)(\C=C\Cl)C(O)=O Amb25229330 [0,2,0,0,0,0|0,0,2]=4 3916 B8R0.12 CC(N)(C=C=O)C(O)=O Amb25245392 [0,2,0,0,0,0|0,0,2]=4 3917 B8R0.12 CC(N)(CC=C)C(O)=O Amb22733281 [0,2,0,0,0,0|0,0,2]=4 3918 B8R0.12 CC(N)(CC=C)C(O)=O Amb22898994 [0,2,0,0,0,0|0,0,2]=4 3919 B8R0.12 CC(N)(CCN)C(O)=O Amb24060975 [0,2,0,0,0,0|0,0,2]=4 3920 B8R0.12 CC(N)(CCO)C(O)=O Amb24340273 [0,2,0,0,0,0|0,0,2]=4 3921 B8R0.12 CC(N)(\C=C\I)C(O)=O Amb25234592 [0,2,0,0,0,0|0,0,2]=4 3922 B8R0.12 CC(O)(C=C=C)C(O)=O Amb24746705 [0,2,0,0,0,0|0,0,2]=4 3923 B8R0.12 CC(O)(CC=C)C(O)=O Amb25077172 [0,2,0,0,0,0|0,0,2]=4 3924 B8R0.12 CC(O)(CCO)C(O)=O Amb25250520 [0,2,0,0,0,0|0,0,2]=4 3925 B8R0.12 CC(O)(NC=O)C(O)=O Amb24417430 [0,2,0,0,0,0|1,0,1]=4 3926 B8R0.12 CC(S)(NC=O)C(O)=O Amb24477811 [0,2,0,0,0,0|1,0,1]=4 3927 B8R0.12 CCCC(C)(Br)C(O)=O Amb25772819 [0,2,0,0,0,0|0,0,2]=4 3928 B8R0.12 CCCC(C)(O)C(O)=O Amb18288835 [0,2,0,0,0,0|0,0,2]=4 3929 B8R0.12 CCC[C@](C)(F)C(O)=O Amb24579970 [0,2,0,0,0,0|0,0,2]=4 3930 B8R0.12 CCC[C@](C)(O)C(O)=O Amb25114242 [0,2,0,0,0,0|0,0,2]=4 3931 B8R0.12 CCNC(C(=O)O)(C)C Amb13952777 [0,2,0,0,0,0|0,0,2]=4 3932 B8R0.12 CCOC(C)(C)C(O)=O Amb18976723 [0,2,0,0,0,0|0,0,2]=4 3933 B8R0.12 CCSC(C(=O)O)(C)C Amb17501487 [0,2,0,0,0,0|0,0,2]=4 3934 B8R0.12 CNCC(C)(N)C(O)=O Amb24061057 [0,2,0,0,0,0|0,0,2]=4 3935 B8R0.12 CNNC(C)(C)C(O)=O Amb25252974 [0,2,0,0,0,0|1,0,1]=4 3936 B8R0.12 CNOC(C)(C)C(O)=O Amb24472643 [0,2,0,0,0,0|1,0,1]=4 3937 B8R0.12 COCC(C(=O)O)(C)C Amb10608195 [0,2,0,0,0,0|0,0,2]=4 3938 B8R0.12 COCC(C)(Cl)C(O)=O Amb24692925 [0,2,0,0,0,0|0,0,2]=4 3939 B8R0.12 COCC(C)(N)C(O)=O Amb18990135 [0,2,0,0,0,0|0,0,2]=4 3940 B8R0.12 COCC(C)(N)C(O)=O Amb20622455 [0,2,0,0,0,0|0,0,2]=4 3941 B8R0.12 COCC(C)(O)C(O)=O Amb18992608 [0,2,0,0,0,0|0,0,2]=4 3942 B8R0.12 COC[C@](C)(N)C(O)=O Amb24568285 [0,2,0,0,0,0|0,0,2]=4 3943 B8R0.12 CSCC(C)(C)C(O)=O Amb18124874 [0,2,0,0,0,0|0,0,2]=4 3944 B8R0.12 CSCC(C)(N)C(O)=O Amb18294541 [0,2,0,0,0,0|0,0,2]=4 3945 B8R0.12 CSCC(C)(O)C(O)=O Amb18644426 [0,2,0,0,0,0|0,0,2]=4 3946 B8R0.12 CSSC(C)(C)C(O)=O Amb24481616 [0,2,0,0,0,0|1,0,1]=4 3947 B8R0.12 C[C@@](C(=O)O)(CCC)N Amb16232632 [0,2,0,0,0,0|0,0,2]=4 3948 B8R0.12 C[C@@](F)(CC=C)C(O)=O Amb25032094 [0,2,0,0,0,0|0,0,2]=4 3949 B8R0.12 C[C@@](N)(CC=C)C(O)=O Amb23402145 [0,2,0,0,0,0|0,0,2]=4 3950 B8R0.12 C[C@@](N)(CCF)C(O)=O Amb25146094 [0,2,0,0,0,0|0,0,2]=4 3951 B8R0.12 C[C@](F)(CC=C)C(O)=O Amb25251491 [0,2,0,0,0,0|0,0,2]=4 3952 B8R0.12 C[C@](N)(CCF)C(O)=O Amb24383347 [0,2,0,0,0,0|0,0,2]=4 3953 B8R0.12 C[C@](N)(CCN)C(O)=O Amb25348479 [0,2,0,0,0,0|0,0,2]=4 3954 B8R0.12 C[C@](N)(CCO)C(O)=O Amb24720458 [0,2,0,0,0,0|0,0,2]=4 3955 B8R0.12 C\C=C\C(C)(C)C(N)=O Amb24713126 [0,2,0,0,0,0|1,0,1]=4 3956 B8R0.12 C\C=C\C(C)(C)C(O)=O Amb18642634 [0,2,0,0,0,0|0,0,1]=3 3957 B8R0.12 C\C=C\C(C)(N)C(O)=O Amb24671255 [0,2,0,0,0,0|0,0,1]=3 3958 B8R0.15 C=CC(CC#N)C(O)=O Amb25047315 [0,2,0,0,0,0|0,0,2]=4 3959 B8R0.15 C=CCC(=C=C)C(O)=O Amb25666226 [0,2,0,0,0,0|0,0,2]=4 3960 B8R0.15 C=CCC(CO)C(O)=O Amb24763754 [0,2,0,0,0,0|0,0,2]=4 3961 B8R0.15 C=CC[C@H](CN)C(O)=O Amb24679707 [0,2,0,0,0,0|0,0,2]=4 3962 B8R0.15 C=CC\C(=C/Cl)\C(O)=O Amb24409542 [0,2,0,0,0,0|1,0,0]=3 3963 B8R0.15 C=CC\C(=N\O)\C(O)=O Amb25730709 [0,2,0,0,0,0|1,0,1]=4 3964 B8R0.15 C=C\C(=C/C=O)\C(O)=O Amb25103697 [0,2,0,0,0,0|0,0,2]=4 3965 B8R0.15 CC#CC(CC)C(O)=O Amb25119285 [0,2,0,0,0,0|0,0,2]=4 3966 B8R0.15 CC(=O)C(=CC)SCC Amb24723402 [0,2,0,0,0,0|1,0,0]=3 3967 B8R0.15 CC(=O)C(CC)=CSC Amb24518136 [0,2,0,0,0,0|1,0,0]=3 3968 B8R0.15 CC(=O)C(CC)=NOC Amb25347431 [0,2,0,0,0,0|1,0,1]=4 3969 B8R0.15 CC(=O)C(CCC)=CBr Amb25173007 [0,2,0,0,0,0|2,0,0]=4 3970 B8R0.15 CC(=O)C(CCC)=C[O-] Amb25322896 [0,2,0,0,0,0|2,0,0]=4 3971 B8R0.15 CC(=O)\C(=C/C)\SC#N Amb25798479 [0,2,0,0,0,0|1,0,1]=4 3972 B8R0.15 CC(=O)\C(=C/C=C)\SC Amb24711782 [0,2,0,0,0,0|1,0,1]=4 3973 B8R0.15 CC(=O)\C(=C/OC)\C#N Amb25025960 [0,2,0,0,0,0|1,0,1]=4 3974 B8R0.15 CC(=O)\C(=C\C)\SCC Amb24387930 [0,2,0,0,0,0|1,0,0]=3 3975 B8R0.15 CC(=O)\C(=C\C=C)\SC Amb25064699 [0,2,0,0,0,0|1,0,1]=4 3976 B8R0.15 CC(=O)\C(=C\OC)\C#N Amb24100396 [0,2,0,0,0,0|1,0,1]=4 3977 B8R0.15 CC(=O)\C(\C=C)=C/SC Amb24752730 [0,2,0,0,0,0|1,0,1]=4 3978 B8R0.15 CC(=O)\C(\CC)=C\OC Amb25373025 [0,2,0,0,0,0|1,0,0]=3 3979 B8R0.15 CC(=O)\C(\CCC)=C/[O-] Amb24647177 [0,2,0,0,0,0|2,0,0]=4 3980 B8R0.15 CC(=O)\C(\CCC)=C\C Amb25347402 [0,2,0,0,0,0|1,0,0]=3 3981 B8R0.15 CC=NC(CO)C(O)=O Amb24740970 [0,2,0,0,0,0|0,0,1]=3 3982 B8R0.15 CCC(=CCCl)C(O)=O Amb25102307 [0,2,0,0,0,0|0,0,0]=2 3983 B8R0.15 CCC(=CCN)C(O)=O Amb24393918 [0,2,0,0,0,0|0,0,0]=2 3984 B8R0.15 CCC(=CCO)C(O)=O Amb24478695 [0,2,0,0,0,0|0,0,0]=2 3985 B8R0.15 CCC(=CCS)C(O)=O Amb24478694 [0,2,0,0,0,0|0,0,0]=2 3986 B8R0.15 CCC(=COC)C(O)=O Amb24622208 [0,2,0,0,0,0|0,0,0]=2 3987 B8R0.15 CCC(CC#C)C(O)=O Amb18115864 [0,2,0,0,0,0|0,0,2]=4 3988 B8R0.15 CCC(CC#N)C(O)=O Amb25760267 [0,2,0,0,0,0|0,0,2]=4 3989 B8R0.15 CCC(CC=C)C(O)=O Amb18642632 [0,2,0,0,0,0|0,0,2]=4 3990 B8R0.15 CCC(CCC)C(O)=O Amb19009626 [0,2,0,0,0,0|0,0,2]=4 3991 B8R0.15 CCC(CCN)C(O)=O Amb24699884 [0,2,0,0,0,0|0,0,2]=4 3992 B8R0.15 CCC(CCO)C(O)=O Amb18642884 [0,2,0,0,0,0|0,0,2]=4 3993 B8R0.15 CCC(COC)C(O)=O Amb18124352 [0,2,0,0,0,0|0,0,2]=4 3994 B8R0.15 CCCC(=CC)C(N)=O Amb25174852 [0,2,0,0,0,0|1,0,0]=3 3995 B8R0.15 CCCC(CN)C(O)=O Amb19373497 [0,2,0,0,0,0|0,0,2]=4 3996 B8R0.15 CCCC(NC)C(O)=O Amb21961534 [0,2,0,0,0,0|0,0,2]=4 3997 B8R0.15 CCCC(NC)C(O)=O Amb22587444 [0,2,0,0,0,0|0,0,2]=4 3998 B8R0.15 CCC[C@@H](CO)C(O)=O Amb24571859 [0,2,0,0,0,0|0,0,2]=4 3999 B8R0.15 CCC[C@@H](NC)C(O)=O Amb25771939 [0,2,0,0,0,0|0,0,2]=4 4000 B8R0.15 CCC[C@H](CO)C(O)=O Amb25063310 [0,2,0,0,0,0|0,0,2]=4 4001 B8R0.15 CCC[C@H](NC)C(O)=O Amb25062610 [0,2,0,0,0,0|0,0,2]=4 4002 B8R0.15 CCC\C(=C/C)\C(N)=O Amb25295458 [0,2,0,0,0,0|1,0,0]=3 4003 B8R0.15 CCNC(C=C)C(O)=O Amb25346510 [0,2,0,0,0,0|0,0,2]=4 4004 B8R0.15 CCNC(CN)C(O)=O Amb25825729 [0,2,0,0,0,0|0,0,2]=4 4005 B8R0.15 CCNC(CO)C(O)=O Amb24477808 [0,2,0,0,0,0|0,0,2]=4 4006 B8R0.15 CCNC(CS)C(O)=O Amb25694444 [0,2,0,0,0,0|0,0,2]=4 4007 B8R0.15 CCN[C@@H](CO)C(O)=O Amb24477673 [0,2,0,0,0,0|0,0,2]=4 4008 B8R0.15 CCN[C@@H](CS)C(O)=O Amb25801938 [0,2,0,0,0,0|0,0,2]=4 4009 B8R0.15 CCN[C@H](CO)C(O)=O Amb25328424 [0,2,0,0,0,0|0,0,2]=4 4010 B8R0.15 CCN[C@H](CS)C(O)=O Amb24692505 [0,2,0,0,0,0|0,0,2]=4 4011 B8R0.15 CCOC(=CC)C(N)=O Amb24531494 [0,2,0,0,0,0|1,0,0]=3 4012 B8R0.15 CCOC(=CC)C(O)=O Amb24622222 [0,2,0,0,0,0|0,0,0]=2 4013 B8R0.15 CCOC(C=C)C(O)=O Amb18642775 [0,2,0,0,0,0|0,0,2]=4 4014 B8R0.15 CCOC(CO)C(O)=O Amb18316294 [0,2,0,0,0,0|0,0,2]=4 4015 B8R0.15 CCOC(CS)C(O)=O Amb19037339 [0,2,0,0,0,0|0,0,2]=4 4016 B8R0.15 CCO\C(=C/C)\C(N)=O Amb25730484 [0,2,0,0,0,0|1,0,0]=3 4017 B8R0.15 CCO\C(=C/C)\C(O)=O Amb18642768 [0,2,0,0,0,0|0,0,0]=2 4018 B8R0.15 CCSC(CCl)C(O)=O Amb25837308 [0,2,0,0,0,0|0,0,2]=4 4019 B8R0.15 CCSC(CN)C(O)=O Amb25808987 [0,2,0,0,0,0|0,0,2]=4 4020 B8R0.15 CCSC(CO)C(O)=O Amb25803319 [0,2,0,0,0,0|0,0,2]=4 4021 B8R0.15 CC[C@@H](CCC)C(O)=O Amb24529114 [0,2,0,0,0,0|0,0,2]=4 4022 B8R0.15 CC[C@@H](NC=O)C(O)=O Amb24700206 [0,2,0,0,0,0|1,0,1]=4 4023 B8R0.15 CC[C@H](CC#N)C(O)=O Amb24358365 [0,2,0,0,0,0|0,0,2]=4 4024 B8R0.15 CC[C@H](CC=C)C(O)=O Amb25145662 [0,2,0,0,0,0|0,0,2]=4 4025 B8R0.15 CC[C@H](CCC)C(O)=O Amb24376457 [0,2,0,0,0,0|0,0,2]=4 4026 B8R0.15 CC\C(=C/CC)\[N+]([O-])=O Amb25134709 [0,2,0,0,0,0|1,0,1]=4 4027 B8R0.15 CC\C(=C\CC)\B(O)O Amb24481980 [0,2,0,0,0,0|1,0,1]=4 4028 B8R0.15 CC\C=C(/C#N)\C(O)=O Amb25360217 [0,2,0,0,0,0|0,0,1]=3 4029 B8R0.15 CC\C=C(/CC)\C(O)=O Amb24446994 [0,2,0,0,0,0|0,0,0]=2 4030 B8R0.15 CC\C=C(/OC)\C(O)=O Amb25294112 [0,2,0,0,0,0|0,0,0]=2 4031 B8R0.15 CC\C=C(\C#N)/C(O)=O Amb24334329 [0,2,0,0,0,0|0,0,1]=3 4032 B8R0.15 CC\C=C(\OC)/C(O)=O Amb24592549 [0,2,0,0,0,0|0,0,0]=2 4033 B8R0.15 CNC(CNC)C(O)=O Amb25066748 [0,2,0,0,0,0|0,0,2]=4 4034 B8R0.15 CNC(COC)C(O)=O Amb19304133 [0,2,0,0,0,0|0,0,2]=4 4035 B8R0.15 CNC(COC)C(O)=O Amb22059040 [0,2,0,0,0,0|0,0,2]=4 4036 B8R0.15 CNCC(OC)C(O)=O Amb25744334 [0,2,0,0,0,0|0,0,2]=4 4037 B8R0.15 CN[C@@H](CCS)C(O)=O Amb24533728 [0,2,0,0,0,0|0,0,2]=4 4038 B8R0.15 CN[C@@H](CNC)C(O)=O Amb24361748 [0,2,0,0,0,0|0,0,2]=4 4039 B8R0.15 CN[C@@H](COC)C(O)=O Amb25075397 [0,2,0,0,0,0|0,0,2]=4 4040 B8R0.15 CN[C@@H](CSC)C(O)=O Amb24377120 [0,2,0,0,0,0|0,0,2]=4 4041 B8R0.15 COC(CC=C)C(O)=O Amb24428233 [0,2,0,0,0,0|0,0,2]=4 4042 B8R0.15 COC(CSC)C(O)=O Amb25309562 [0,2,0,0,0,0|0,0,2]=4 4043 B8R0.15 COC(OCC)C(O)=O Amb25367206 [0,2,0,0,0,0|0,0,2]=4 4044 B8R0.15 COCC(C=O)C(O)=O Amb24640433 [0,2,0,0,0,0|1,0,1]=4 4045 B8R0.15 CON=C(C#N)C(O)=O Amb24470674 [0,2,0,0,0,0|1,0,1]=4 4046 B8R0.15 CONC(C=C)C(O)=O Amb25705766 [0,2,0,0,0,0|0,0,2]=4 4047 B8R0.15 CONC(CN)C(O)=O Amb25688022 [0,2,0,0,0,0|1,0,1]=4 4048 B8R0.15 CO[C@@H](CCN)C(O)=O Amb25146111 [0,2,0,0,0,0|0,0,2]=4 4049 B8R0.15 CO[C@H](COC)C(O)=O Amb25122791 [0,2,0,0,0,0|0,0,2]=4 4050 B8R0.15 CO\C=C(/OC)\C(O)=O Amb18642871 [0,2,0,0,0,0|0,0,0]=2 4051 B8R0.15 CO\C=C(\C#N)/C(O)=O Amb25291274 [0,2,0,0,0,0|0,0,1]=3 4052 B8R0.15 CO\N=C(/C#N)\C(O)=O Amb21858116 [0,2,0,0,0,0|1,0,1]=4 4053 B8R0.15 CSC(CC=C)C(O)=O Amb18644287 [0,2,0,0,0,0|0,0,2]=4 4054 B8R0.15 CSC(CSC)C(O)=O Amb24595007 [0,2,0,0,0,0|0,0,2]=4 4055 B8R0.15 CSC(NC=O)C(O)=O Amb24654838 [0,2,0,0,0,0|1,0,1]=4 4056 B8R0.15 CS\C=C(/SC)\C(O)=O Amb24357852 [0,2,0,0,0,0|0,0,0]=2 4057 B8R0.15 CS\C=C(\SC)/C(O)=O Amb25241511 [0,2,0,0,0,0|0,0,0]=2 4058 B8R0.15 C\C=C(/CCO)\C(O)=O Amb18642783 [0,2,0,0,0,0|0,0,0]=2 4059 B8R0.15 C\C=C(\CC=C)/C(O)=O Amb25304688 [0,2,0,0,0,0|0,0,0]=2 4060 B8R0.15 C\C=C(\CCO)/C(O)=O Amb24568883 [0,2,0,0,0,0|0,0,0]=2 4061 B8R0.15 C\C=C\C(CC)C(C)=O Amb25262734 [0,2,0,0,0,0|1,0,1]=4 4062 B8R0.15 C\C=C\C(CC)C(O)=O Amb18642657 [0,2,0,0,0,0|0,0,1]=3 4063 B8R0.15 C\C=C\C(SC)C(O)=O Amb18643349 [0,2,0,0,0,0|0,0,1]=3 4064 B8R0.15 NCCC(=NO)C(O)=O Amb25174966 [0,2,0,0,0,0|1,0,1]=4 4065 B8R0.15 NCCC(CF)C(O)=O Amb25174518 [0,2,0,0,0,0|0,0,2]=4 4066 B8R0.15 NC\C=C(\CCl)/C(O)=O Amb24760314 [0,2,0,0,0,0|0,0,0]=2 4067 B8R0.15 NC\C=C(\CF)/C(O)=O Amb25174859 [0,2,0,0,0,0|0,0,0]=2 4068 B8R0.15 OC(=O)C(CS)NC=O Amb20093366 [0,2,0,0,0,0|1,0,1]=4 4069 B8R0.15 OC(=O)[C@H](CS)NC=O Amb24727230 [0,2,0,0,0,0|1,0,1]=4 4070 B8R0.15 OC(=O)\C(\C=N\O)=N\O Amb24432147 [0,2,0,0,0,0|2,0,0]=4 4071 B8R0.15 OC(=O)\C(\CCO)=N/O Amb25104712 [0,2,0,0,0,0|1,0,1]=4 4072 B8R0.15 OCC(NC=O)C(O)=O Amb18290435 [0,2,0,0,0,0|1,0,1]=4 4073 B8R0.15 OCNC(CS)C(O)=O Amb24369164 [0,2,0,0,0,0|1,0,1]=4 4074 B8R0.15 OC[C@H](NC=O)C(O)=O Amb24362974 [0,2,0,0,0,0|1,0,1]=4 4075 B8R0.13 CCC(C)(Br)C(=O)OC Amb24643650 [0,2,0,0,0,0|0,0,2]=4 4076 B8R0.13 CCC(C)(N)C(=O)OC Amb18288973 [0,2,0,0,0,0|0,0,2]=4 4077 B8R0.13 CCC(C)(N)C(=O)OC Amb19514608 [0,2,0,0,0,0|0,0,2]=4 4078 B8R0.13 CCC(C)(O)C(=O)OC Amb24116777 [0,2,0,0,0,0|0,0,2]=4 4079 B8R0.13 CC[C@](C)(N)C(=O)OC Amb19888376 [0,2,0,0,0,0|0,0,2]=4 4080 B8R0.13 CNC(C)(C)C(=O)NO Amb24477846 [0,2,0,0,0,0|1,0,1]=4 4081 B8R0.13 CNC(C)(C)C(=O)OC Amb18523806 [0,2,0,0,0,0|1,0,1]=4 4082 B8R0.13 COC(=O)C(C)(C)C=O Amb18642747 [0,2,0,0,0,0|1,0,1]=4 4083 B8R0.13 COC(C)(C)C(=O)CO Amb25858639 [0,2,0,0,0,0|1,0,1]=4 4084 B8R0.13 COC(C)(C)C(=O)NO Amb24524136 [0,2,0,0,0,0|1,0,1]=4 4085 B8R0.13 C\C=C(\C)/C(C)(C)C=O Amb24745892 [0,2,0,0,0,0|1,0,1]=4 4086 B8R0.13 C\C=C(\C)/C(C)(C)CO Amb24352273 [0,2,0,0,0,0|1,0,1]=4 4087 B8R0.13 C\C=C(\C)/C(C)(O)CN Amb24746770 [0,2,0,0,0,0|1,0,1]=4 4088 B8R0.20 CC(C=O)=C(CC)CC Amb18642443 [0,2,0,0,0,0|1,0,1]=4 4089 B8R0.20 CC(C=O)=C(CC)OC Amb25264790 [0,2,0,0,0,0|1,0,1]=4 4090 B8R0.20 CC(CC)=C(CC)C=O Amb24616751 [0,2,0,0,0,0|1,0,1]=4 4091 B8R0.20 CC=C(C#N)C(=O)OC Amb24630583 [0,2,0,0,0,0|0,0,1]=3 4092 B8R0.20 CC=C(C=O)C(=O)OC Amb25258907 [0,2,0,0,0,0|0,0,1]=3 4093 B8R0.20 CC=C(CBr)C(=O)OC Amb25233156 [0,2,0,0,0,0|0,0,0]=2 4094 B8R0.20 CC=C(CO)C(=O)OC Amb24367431 [0,2,0,0,0,0|0,0,0]=2 4095 B8R0.20 CC=C(OC)C(=O)C#N Amb24631361 [0,2,0,0,0,0|1,0,0]=3 4096 B8R0.20 CCC(=CC)C(=N)NO Amb24628932 [0,2,0,0,0,0|1,0,0]=3 4097 B8R0.20 CCC(=CC)C(=O)C#C Amb25296697 [0,2,0,0,0,0|1,0,0]=3 4098 B8R0.20 CCC(=CC)C(=O)NC Amb25716116 [0,2,0,0,0,0|1,0,0]=3 4099 B8R0.20 CCC(=CC)C(=O)NN Amb24745719 [0,2,0,0,0,0|1,0,0]=3 4100 B8R0.20 CCC(=CC)C(=O)OC Amb25235294 [0,2,0,0,0,0|0,0,0]=2 4101 B8R0.20 CCC(=CC)C(O)C#N Amb24403806 [0,2,0,0,0,0|1,0,1]=4 4102 B8R0.20 CCC(=CC)[C@@H](O)C#N Amb25681477 [0,2,0,0,0,0|1,0,1]=4 4103 B8R0.20 CCC(=O)\C(\CC)=C\C Amb24582494 [0,2,0,0,0,0|1,0,0]=3 4104 B8R0.20 CCC(C=O)C(=O)OC Amb18642787 [0,2,0,0,0,0|1,0,1]=4 4105 B8R0.20 CCC(CCl)C(=O)OC Amb24648796 [0,2,0,0,0,0|0,0,2]=4 4106 B8R0.20 CCC(CN)C(=O)NO Amb25203915 [0,2,0,0,0,0|0,0,2]=4 4107 B8R0.20 CCC(CN)C(=O)OC Amb24698179 [0,2,0,0,0,0|0,0,2]=4 4108 B8R0.20 CCC(NC)C(=O)OC Amb19516943 [0,2,0,0,0,0|0,0,2]=4 4109 B8R0.20 CCC(NC)C(=O)OC Amb21961536 [0,2,0,0,0,0|0,0,2]=4 4110 B8R0.20 CCC(SC)C(=O)OC Amb22043324 [0,2,0,0,0,0|0,0,2]=4 4111 B8R0.20 CCN(C(=O)CO)CC Amb1157486 [0,2,0,0,0,0|1,0,1]=4 4112 B8R0.20 CCN(CC)C(=O)OC Amb17797144 [0,2,0,0,0,0|1,0,1]=4 4113 B8R0.20 CCN(CC)C(=O)ON Amb24068791 [0,2,0,0,0,0|1,0,1]=4 4114 B8R0.20 CC[C@@H](CN)C(=O)OC Amb25046723 [0,2,0,0,0,0|0,0,2]=4 4115 B8R0.20 CC[C@H](CO)C(=O)OC Amb25084318 [0,2,0,0,0,0|0,0,2]=4 4116 B8R0.20 CC\C(=C/C)\C(=O)NN Amb25224891 [0,2,0,0,0,0|1,0,0]=3 4117 B8R0.20 CC\C(=C/Cl)\C(=O)C=C Amb25807580 [0,2,0,0,0,0|2,0,0]=4 4118 B8R0.20 CC\C(=C\Cl)\C(=O)C=C Amb24480002 [0,2,0,0,0,0|2,0,0]=4 4119 B8R0.20 CN(C=O)C(=CO)C=O Amb24617734 [0,2,0,0,0,0|2,0,0]=4 4120 B8R0.20 CN(C=O)\C(=C/O)\C=O Amb24682425 [0,2,0,0,0,0|2,0,0]=4 4121 B8R0.20 CNC(C=O)C(=O)OC Amb25228103 [0,2,0,0,0,0|1,0,1]=4 4122 B8R0.20 CNC(CO)C(=O)OC Amb25809607 [0,2,0,0,0,0|1,0,1]=4 4123 B8R0.20 CN[C@@H](CO)C(=O)OC Amb24116973 [0,2,0,0,0,0|1,0,1]=4 4124 B8R0.20 CN[C@H](C=C)C(=O)OC Amb25745930 [0,2,0,0,0,0|0,0,2]=4 4125 B8R0.20 COC(=O)C(=CC)OC Amb20668276 [0,2,0,0,0,0|0,0,0]=2 4126 B8R0.20 COC(=O)C(=CCl)OC Amb24519005 [0,2,0,0,0,0|1,0,0]=3 4127 B8R0.20 COC(=O)C(=CCl)SC Amb24365926 [0,2,0,0,0,0|1,0,0]=3 4128 B8R0.20 COC(=O)C(=CN)C=O Amb24571270 [0,2,0,0,0,0|1,0,1]=4 4129 B8R0.20 COC(=O)C(=CO)SC Amb25357499 [0,2,0,0,0,0|1,0,0]=3 4130 B8R0.20 COC(=O)C(=NO)SC Amb24540911 [0,2,0,0,0,0|2,0,0]=4 4131 B8R0.20 COC(=O)C(CCl)OC Amb25757010 [0,2,0,0,0,0|1,0,1]=4 4132 B8R0.20 COC(=O)C(CN)OC Amb24440902 [0,2,0,0,0,0|1,0,1]=4 4133 B8R0.20 COC(=O)C(CN)SC Amb24481948 [0,2,0,0,0,0|1,0,1]=4 4134 B8R0.20 COC(=O)C(CO)C=C Amb25358272 [0,2,0,0,0,0|0,0,2]=4 4135 B8R0.20 COC(=O)[C@@H](CO)OC Amb25058561 [0,2,0,0,0,0|1,0,1]=4 4136 B8R0.20 COC(=O)[C@H](CO)OC Amb25721195 [0,2,0,0,0,0|1,0,1]=4 4137 B8R0.20 COC(=O)\C(=C/C)\OC Amb24532128 [0,2,0,0,0,0|0,0,0]=2 4138 B8R0.20 COC(=O)\C(=C/N)\C=O Amb24614786 [0,2,0,0,0,0|1,0,1]=4 4139 B8R0.20 COC(=O)\C(=C/O)\C=O Amb25758374 [0,2,0,0,0,0|1,0,1]=4 4140 B8R0.20 COC(=O)\C(=C\Br)\C#N Amb24480129 [0,2,0,0,0,0|1,0,1]=4 4141 B8R0.20 COC(=O)\C(=C\Cl)\C#N Amb18644224 [0,2,0,0,0,0|1,0,1]=4 4142 B8R0.20 CO[C@@H](CO)C(=O)CO Amb24456628 [0,2,0,0,0,0|1,0,1]=4 4143 B8R0.20 CSC(SC)=C(F)C=O Amb24736408 [0,2,0,0,0,0|2,0,0]=4 4144 B8R0.20 CSC(SC)=C(F)CO Amb25080540 [0,2,0,0,0,0|2,0,0]=4 4145 B8R0.20 C\C(\C=O)=C(/CC)\OC Amb25806935 [0,2,0,0,0,0|1,0,1]=4 4146 B8R0.20 C\C=C(/C)\C(CBr)OC Amb25248997 [0,2,0,0,0,0|1,0,1]=4 4147 B8R0.20 C\C=C(/CBr)\C(=O)OC Amb25328192 [0,2,0,0,0,0|0,0,0]=2 4148 B8R0.20 C\C=C(/OC)\C(=O)C#N Amb25052777 [0,2,0,0,0,0|1,0,0]=3 4149 B8R0.20 C\C=C(\C)/C(CO)C=C Amb24747370 [0,2,0,0,0,0|1,0,1]=4 4150 B8R0.36 C=CC(N)(CO)C(O)=O Amb18642831 [0,2,0,0,0,0|0,0,2]=4 4151 B8R0.36 C=CC(O)(CN)C(O)=O Amb18642832 [0,2,0,0,0,0|0,0,2]=4 4152 B8R0.36 CC(CO)(C=C)C(O)=O Amb18642777 [0,2,0,0,0,0|0,0,2]=4 4153 B8R0.36 CC(OC)(OC)C(O)=O Amb25697385 [0,2,0,0,0,0|1,0,1]=4 4154 B8R0.36 CCC(Br)(CC)C(O)=O Amb18127183 [0,2,0,0,0,0|0,0,2]=4 4155 B8R0.36 CCC(C(=O)O)(CC)C Amb16232089 [0,2,0,0,0,0|0,0,2]=4 4156 B8R0.36 CCC(C(=O)O)(CC)S Amb17504415 [0,2,0,0,0,0|0,0,2]=4 4157 B8R0.36 CCC(C)(C#N)C(O)=O Amb18642501 [0,2,0,0,0,0|0,0,2]=4 4158 B8R0.36 CCC(C)(CN)C(O)=O Amb22157184 [0,2,0,0,0,0|0,0,2]=4 4159 B8R0.36 CCC(C)(CO)C(O)=O Amb25367931 [0,2,0,0,0,0|0,0,2]=4 4160 B8R0.36 CCC(C)(NO)C(O)=O Amb25340502 [0,2,0,0,0,0|0,0,2]=4 4161 B8R0.36 CCC(F)(CC)C(O)=O Amb24120633 [0,2,0,0,0,0|0,0,2]=4 4162 B8R0.36 CCC(F)(CN)C(O)=O Amb25127619 [0,2,0,0,0,0|0,0,2]=4 4163 B8R0.36 CCC(N)(CO)C(O)=O Amb18642917 [0,2,0,0,0,0|0,0,2]=4 4164 B8R0.36 CC[C@@](C)(CN)C(O)=O Amb24761388 [0,2,0,0,0,0|0,0,2]=4 4165 B8R0.36 CC[C@@](C)(CO)C(O)=O Amb25678633 [0,2,0,0,0,0|0,0,2]=4 4166 B8R0.36 CC[C@@](N)(CN)C(O)=O Amb25145998 [0,2,0,0,0,0|0,0,2]=4 4167 B8R0.36 CC[C@@](N)(CO)C(O)=O Amb24534463 [0,2,0,0,0,0|0,0,2]=4 4168 B8R0.36 CC[C@@](O)(CBr)C(O)=O Amb25337727 [0,2,0,0,0,0|0,0,2]=4 4169 B8R0.36 CC[C@](C(=O)O)(OC)C Amb10603236 [0,2,0,0,0,0|0,0,2]=4 4170 B8R0.36 CC[C@](N)(CN)C(O)=O Amb25188914 [0,2,0,0,0,0|0,0,2]=4 4171 B8R0.36 CC[C@](N)(CO)C(O)=O Amb25339948 [0,2,0,0,0,0|0,0,2]=4 4172 B8R0.36 CC[C@](O)(CN)C(O)=O Amb24657235 [0,2,0,0,0,0|0,0,2]=4 4173 B8R0.36 CC[C@](O)(CO)C(O)=O Amb24669128 [0,2,0,0,0,0|0,0,2]=4 4174 B8R0.36 CNC(C)(CF)C(O)=O Amb25287223 [0,2,0,0,0,0|1,0,1]=4 4175 B8R0.36 CN[C@@](C)(CF)C(O)=O Amb24477045 [0,2,0,0,0,0|1,0,1]=4 4176 B8R0.36 CN[C@](C)(CF)C(O)=O Amb25840877 [0,2,0,0,0,0|1,0,1]=4 4177 B8R0.36 COC(C)(CN)C(O)=O Amb24697658 [0,2,0,0,0,0|1,0,1]=4 4178 B8R0.36 CSC(C)(CCl)C(O)=O Amb18126501 [0,2,0,0,0,0|1,0,1]=4 4179 B8R0.36 CS[C@@](C)(CN)C(O)=O Amb24476638 [0,2,0,0,0,0|1,0,1]=4 4180 B8R0.37 BrC(=C)C(C(=O)O)(C)C Amb17595054 [0,2,0,0,0,0|0,0,2]=4 4181 B8R0.37 CC(=C)C(C(=O)O)(C)C Amb15701602 [0,2,0,0,0,0|0,0,1]=3 4182 B8R0.37 CC(=C)C(C)(C)C(N)=O Amb25032100 [0,2,0,0,0,0|1,0,1]=4 4183 B8R0.37 CC(=C)C(C)(O)C(O)=O Amb18642760 [0,2,0,0,0,0|0,0,1]=3 4184 B8R0.37 CC(=O)C(C(=O)C)(C)C Amb17593343 [0,2,0,0,0,0|1,0,1]=4 4185 B8R0.37 CC(=O)C(C)(C)C(O)=O Amb18642784 [0,2,0,0,0,0|0,0,1]=3 4186 B8R0.37 CC(=O)C(C)(C)C(O)=S Amb24061048 [0,2,0,0,0,0|0,1,1]=4 4187 B8R0.37 CC(=O)C(C)(Cl)C(C)=C Amb24621439 [0,2,0,0,0,0|1,0,1]=4 4188 B8R0.37 CC(=O)C(C)(O)C(N)=O Amb24084329 [0,2,0,0,0,0|1,0,1]=4 4189 B8R0.37 CC(=O)C(C)(O)C(O)=O Amb18642870 [0,2,0,0,0,0|0,0,1]=3 4190 B8R0.37 CC(=O)C(O)(O)C(O)=O Amb24101440 [0,2,0,0,0,0|1,0,1]=4 4191 B8R0.37 CC(=S)C(C)(C)C(C)=O Amb24677277 [0,2,0,0,0,0|1,0,1]=4 4192 B8R0.37 CC(Br)(C(O)=O)C(O)=O Amb24429036 [0,2,0,0,0,0|1,0,1]=4 4193 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,2,0,0,0,0|0,0,2]=4 4194 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,2,0,0,0,0|0,0,2]=4 4195 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,2,0,0,0,0|0,0,2]=4 4196 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,2,0,0,0,0|0,0,2]=4 4197 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,2,0,0,0,0|0,0,2]=4 4198 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,2,0,0,0,0|0,0,2]=4 4199 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,2,0,0,0,0|0,0,2]=4 4200 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,2,0,0,0,0|0,0,2]=4 4201 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,2,0,0,0,0|0,0,2]=4 4202 B8R0.37 CC(O)(C(O)=O)C(O)=O Amb18124398 [0,2,0,0,0,0|1,0,1]=4 4203 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,2,0,0,0,0|0,0,2]=4 4204 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,2,0,0,0,0|0,0,2]=4 4205 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,2,0,0,0,0|0,0,2]=4 4206 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,2,0,0,0,0|0,0,2]=4 4207 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,2,0,0,0,0|0,0,2]=4 4208 B8R0.37 CN(C)C(C)(C)C(O)=O Amb20627821 [0,2,0,0,0,0|1,0,1]=4 4209 B8R0.37 CS(=O)C(C)(C)C(O)=O Amb18644428 [0,2,0,0,0,0|1,0,1]=4 4210 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,2,0,0,0,0|0,0,2]=4 4211 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,2,0,0,0,0|0,0,2]=4 4212 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,2,0,0,0,0|0,0,2]=4 4213 B8R0.37 C[C@@](N)(C(O)=O)C(N)=O Amb25077574 [0,2,0,0,0,0|1,0,1]=4 4214 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,2,0,0,0,0|0,0,2]=4 4215 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,2,0,0,0,0|0,0,2]=4 4216 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,2,0,0,0,0|0,0,2]=4 4217 B8R0.37 ClC(=C)C(C(=O)O)(C)C Amb17613253 [0,2,0,0,0,0|0,0,2]=4 4218 B8R0.37 OC(=O)C(C(=O)Cl)(C)C Amb17593749 [0,2,0,0,0,0|1,0,1]=4 4219 B8R0.37 OC(=O)C(C(=S)N)(C)C Amb17465757 [0,2,0,0,0,0|1,0,1]=4 4220 B8R0.26 CN\C(=N/C)\S(O)(=O)=O Amb25375904 [0,2,0,0,0,0|2,0,0]=4 4221 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,2,0,0,0,0|0,0,2]=4 4222 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|0,0,2]=4 4223 B8R0.27 CC(C(O)=O)[N+](C)(C)C Amb24759071 [0,2,0,0,0,0|1,0,1]=4 4224 B8R0.27 CC(C(O)=O)[N+](C)(C)N Amb25306005 [0,2,0,0,0,0|1,0,1]=4 4225 B8R0.27 CC(C)(Br)C(=O)C(O)=O Amb24433030 [0,2,0,0,0,0|1,0,1]=4 4226 B8R0.27 CC(C)(C)C(=C)C(O)=O Amb18642653 [0,2,0,0,0,0|0,0,2]=4 4227 B8R0.27 CC(C)(F)C(=O)C(O)=O Amb25079631 [0,2,0,0,0,0|1,0,1]=4 4228 B8R0.27 CC(C)(O)C(=O)C(O)=O Amb25064348 [0,2,0,0,0,0|1,0,1]=4 4229 B8R0.27 CC(C)(S)C(=O)C(O)=O Amb24640907 [0,2,0,0,0,0|1,0,1]=4 4230 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,2,0,0,0,0|0,0,2]=4 4231 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,2,0,0,0,0|0,0,2]=4 4232 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,2,0,0,0,0|0,0,2]=4 4233 B8R0.27 C[C@H](C(O)=O)S(C)(=O)=O Amb24480187 [0,2,0,0,0,0|1,0,1]=4 4234 B8R0.27 C[N+](C)(N)C(=C)C(O)=O Amb25835264 [0,2,0,0,0,0|1,0,1]=4 4235 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,2,0,0,0,0|0,0,2]=4 4236 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,2,0,0,0,0|0,0,2]=4 4237 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,2,0,0,0,0|0,0,2]=4 4238 B8R0.18 CC(=C)C(=C=O)C(O)=O Amb24524157 [0,2,0,0,0,0|0,0,1]=3 4239 B8R0.18 CC(=C)C(CC)C(N)=O Amb24673757 [0,2,0,0,0,0|1,0,1]=4 4240 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,2,0,0,0,0|0,0,1]=3 4241 B8R0.18 CC(=C)\C(=C\C)\C(N)=O Amb25853234 [0,2,0,0,0,0|1,0,0]=3 4242 B8R0.18 CC(=C)\C(=C\C)\C(O)=O Amb25341613 [0,2,0,0,0,0|0,0,0]=2 4243 B8R0.18 CC(=O)C(=C[O-])C(C)=O Amb24524328 [0,2,0,0,0,0|1,0,1]=4 4244 B8R0.18 CC(=O)C(=NN)C(N)=O Amb25190247 [0,2,0,0,0,0|2,0,0]=4 4245 B8R0.18 CC(=O)C(=S=O)C(C)=O Amb25185299 [0,2,0,0,0,0|2,0,0]=4 4246 B8R0.18 CC(=O)C(CC)C(C)=C Amb25244374 [0,2,0,0,0,0|1,0,1]=4 4247 B8R0.18 CC(=O)C(CC)C(N)=O Amb25082383 [0,2,0,0,0,0|1,0,1]=4 4248 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22167697 [0,2,0,0,0,0|0,0,2]=4 4249 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22730810 [0,2,0,0,0,0|0,0,2]=4 4250 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22734577 [0,2,0,0,0,0|0,0,2]=4 4251 B8R0.18 CC(=O)C(CO)C(C)=O Amb25288499 [0,2,0,0,0,0|1,0,1]=4 4252 B8R0.18 CC(=O)\C(=N/O)\C(O)=O Amb24100395 [0,2,0,0,0,0|1,0,0]=3 4253 B8R0.18 CC(=O)\C(\C#N)=C(\C)/N Amb24706751 [0,2,0,0,0,0|1,0,1]=4 4254 B8R0.18 CC(=O)\C(\C#N)=C(\C)/O Amb24621648 [0,2,0,0,0,0|1,0,1]=4 4255 B8R0.18 CC(=O)\C(\C=O)=C(/C)\[O-] Amb22334124 [0,2,0,0,0,0|1,0,1]=4 4256 B8R0.18 CC(=O)\C(\N=O)=C(/C)\O Amb24339368 [0,2,0,0,0,0|2,0,0]=4 4257 B8R0.18 CC(=O)\C(\OC)=C(\C)/O Amb24577822 [0,2,0,0,0,0|1,0,0]=3 4258 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,2,0,0,0,0|0,0,2]=4 4259 B8R0.18 CC(C)=C(C#N)C(N)=O Amb18642189 [0,2,0,0,0,0|1,0,1]=4 4260 B8R0.18 CC(C)=C(C=O)C(O)=O Amb25328515 [0,2,0,0,0,0|0,0,1]=3 4261 B8R0.18 CC(C)=C(CC)C(O)=O Amb18642607 [0,2,0,0,0,0|0,0,0]=2 4262 B8R0.18 CC(C)=C(CO)C(C)=C Amb24555501 [0,2,0,0,0,0|2,0,0]=4 4263 B8R0.18 CC(C)=C(CO)C(C)=O Amb24467348 [0,2,0,0,0,0|1,0,0]=3 4264 B8R0.18 CC(C)=C(CO)C(C)O Amb25786540 [0,2,0,0,0,0|1,0,1]=4 4265 B8R0.18 CC(C)=C(OC)C(O)=O Amb18642778 [0,2,0,0,0,0|0,0,0]=2 4266 B8R0.18 CC(C)=C(ON)C(O)=O Amb24432339 [0,2,0,0,0,0|1,0,0]=3 4267 B8R0.18 CC(C)=C(SC)C(C)=O Amb25319708 [0,2,0,0,0,0|1,0,0]=3 4268 B8R0.18 CC(C)=C(SC)C(O)=O Amb24656294 [0,2,0,0,0,0|0,0,0]=2 4269 B8R0.18 CC(C)C(=C=C)C(O)=O Amb24446532 [0,2,0,0,0,0|0,0,2]=4 4270 B8R0.18 CC(C)C(=NO)C(O)=O Amb24597663 [0,2,0,0,0,0|1,0,1]=4 4271 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,2,0,0,0,0|0,0,2]=4 4272 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,2,0,0,0,0|1,0,1]=4 4273 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,2,0,0,0,0|0,0,2]=4 4274 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,2,0,0,0,0|0,0,2]=4 4275 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,2,0,0,0,0|0,0,2]=4 4276 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,2,0,0,0,0|0,0,2]=4 4277 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,2,0,0,0,0|0,0,2]=4 4278 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,2,0,0,0,0|0,0,2]=4 4279 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,2,0,0,0,0|0,0,2]=4 4280 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,2,0,0,0,0|0,0,2]=4 4281 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,2,0,0,0,0|0,0,2]=4 4282 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,2,0,0,0,0|0,0,2]=4 4283 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,2,0,0,0,0|0,0,2]=4 4284 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,2,0,0,0,0|0,0,2]=4 4285 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,2,0,0,0,0|0,0,2]=4 4286 B8R0.18 CC(N)=C(C#N)C(=O)Cl Amb24670422 [0,2,0,0,0,0|1,0,1]=4 4287 B8R0.18 CC(N)=C(C#N)C(O)=O Amb25228925 [0,2,0,0,0,0|0,0,1]=3 4288 B8R0.18 CC(N)=C(SC)S(C)=O Amb25102494 [0,2,0,0,0,0|2,0,0]=4 4289 B8R0.18 CC(O)=C(N=O)C(O)=O Amb25727301 [0,2,0,0,0,0|1,0,0]=3 4290 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,2,0,0,0,0|0,0,2]=4 4291 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,2,0,0,0,0|0,0,2]=4 4292 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,2,0,0,0,0|0,0,2]=4 4293 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,2,0,0,0,0|0,0,2]=4 4294 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,2,0,0,0,0|0,0,2]=4 4295 B8R0.18 CC(S)=C(C#N)C(N)=O Amb24385025 [0,2,0,0,0,0|1,0,1]=4 4296 B8R0.18 CCC(C(=O)C)C(=O)C Amb2371444 [0,2,0,0,0,0|1,0,1]=4 4297 B8R0.18 CCC(C(O)=O)=C(Cl)Cl Amb25123840 [0,2,0,0,0,0|1,0,0]=3 4298 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,2,0,0,0,0|0,0,2]=4 4299 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,2,0,0,0,0|0,0,2]=4 4300 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,2,0,0,0,0|0,0,2]=4 4301 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,2,0,0,0,0|0,0,2]=4 4302 B8R0.18 CCN(C(C)=O)C(C)=O Amb25857493 [0,2,0,0,0,0|2,0,0]=4 4303 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,2,0,0,0,0|0,0,2]=4 4304 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,2,0,0,0,0|1,0,1]=4 4305 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,2,0,0,0,0|1,0,1]=4 4306 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,2,0,0,0,0|1,0,1]=4 4307 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,2,0,0,0,0|1,0,1]=4 4308 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,2,0,0,0,0|1,0,1]=4 4309 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,2,0,0,0,0|0,0,2]=4 4310 B8R0.18 CNC(C(O)=O)C(O)=O Amb24477701 [0,2,0,0,0,0|1,0,1]=4 4311 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|0,0,2]=4 4312 B8R0.18 CON(C(C)=O)C(C)=O Amb22231327 [0,2,0,0,0,0|2,0,0]=4 4313 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|0,0,2]=4 4314 B8R0.18 CSC(C(C)=O)C(C)=O Amb25834292 [0,2,0,0,0,0|1,0,1]=4 4315 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,2,0,0,0,0|0,0,2]=4 4316 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,2,0,0,0,0|0,0,2]=4 4317 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,2,0,0,0,0|0,0,2]=4 4318 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,2,0,0,0,0|0,0,2]=4 4319 B8R0.18 C\C(\O)=C(\C#N)/C(O)=O Amb25793575 [0,2,0,0,0,0|0,0,1]=3 4320 B8R0.18 C\C=C(/C(C)C)\C(O)=O Amb18642659 [0,2,0,0,0,0|0,0,0]=2 4321 B8R0.18 C\C=C(/[C@@H](C)O)\C(O)=O Amb25843942 [0,2,0,0,0,0|0,0,0]=2 4322 B8R0.18 C\C=C(\C(C)C)/C(N)=O Amb24666666 [0,2,0,0,0,0|1,0,0]=3 4323 B8R0.18 N#C\C(=C(/N)\C)\C(=O)O Amb13951423 [0,2,0,0,0,0|0,0,1]=3 4324 B8R0.18 N=C=C(C(O)=O)C(O)=O Amb25312535 [0,2,0,0,0,0|1,0,1]=4 4325 B8R0.18 NC(=N)C(=NO)C(O)=O Amb25791658 [0,2,0,0,0,0|2,0,0]=4 4326 B8R0.18 NC(=O)C(=NO)C(O)=O Amb25118376 [0,2,0,0,0,0|2,0,0]=4 4327 B8R0.18 NC=C(C(=O)C)C(=O)C Amb2386494 [0,2,0,0,0,0|1,0,1]=4 4328 B8R0.18 OC(=O)C(=CCl)C(O)=O Amb24634285 [0,2,0,0,0,0|1,0,1]=4 4329 B8R0.18 OC(=O)C(CF)=C(F)F Amb25081967 [0,2,0,0,0,0|1,0,0]=3 4330 B8R0.18 ON=C(C(=O)C)C(=O)C Amb1145803 [0,2,0,0,0,0|2,0,0]=4 4331 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,2,0,0,0,0|0,0,2]=4 4332 B8R0.18 [NH-][NH+]=C(C(O)=O)C(O)=O Amb24557340 [0,2,0,0,0,0|2,0,0]=4 4333 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 4334 B6R1.2 Brc1cc[n]o1 Amb20242149 [1,0,0,1,0,0|2,0,0]=4 4335 B6R1.2 CC1=CCC=C1 Amb22410851 [1,0,0,1,0,0|2,0,0]=4 4336 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 4337 B6R1.2 Cc1ccco1 Amb2447070 [1,0,0,1,0,0|1,0,1]=4 4338 B6R1.2 ClC1=CCC=C1 Amb22584067 [1,0,0,1,0,0|2,0,0]=4 4339 B6R1.2 FC1=CCCO1 Amb24322815 [1,0,0,1,0,0|1,0,1]=4 4340 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 4341 B6R1.2 Ic1cc[n]o1 Amb25793636 [1,0,0,1,0,0|2,0,0]=4 4342 B6R1.2 Ic1ccco1 Amb17672748 [1,0,0,1,0,0|1,0,1]=4 4343 B6R1.2 NC=1C=CCN1 Amb25208790 [1,0,0,1,0,0|2,0,0]=4 4344 B6R1.2 Nc1ccco1 Amb18203215 [1,0,0,1,0,0|1,0,1]=4 4345 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,1,0,0|1,0,0]=3 4346 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,1,0,0|0,1,0]=3 4347 B6R1.2 O=C1C=CN=N1 Amb22230022 [1,0,0,1,0,0|2,0,0]=4 4348 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,1,0,0|2,0,0]=4 4349 B6R1.2 O=C1C=CON1 Amb22055592 [1,0,0,1,0,0|2,0,0]=4 4350 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,1,0,0|2,0,0]=4 4351 B6R1.2 O=C1C=NC=C1 Amb25746212 [1,0,0,1,0,0|2,0,0]=4 4352 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,0]=3 4353 B6R1.2 O=C1CNC=C1 Amb22234991 [1,0,0,1,0,0|2,0,0]=4 4354 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,1,0,0|1,0,1]=4 4355 B6R1.2 O=C1COC=C1 Amb24107591 [1,0,0,1,0,0|2,0,0]=4 4356 B6R1.2 O=C1CSC=C1 Amb22736500 [1,0,0,1,0,0|2,0,0]=4 4357 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,1,0,0|1,0,0]=3 4358 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,1,0,0|1,0,1]=4 4359 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,1,0,0|1,0,1]=4 4360 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,1,0,0|1,0,1]=4 4361 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,1,0,0|1,0,1]=4 4362 B6R1.2 OC1CCC=C1 Amb17593023 [1,0,0,1,0,0|1,0,1]=4 4363 B6R1.2 O[C@H]1CCC=C1 Amb25146308 [1,0,0,1,0,0|1,0,1]=4 4364 B6R1.2 Oc1c[nH]cc1 Amb24317462 [1,0,0,1,0,0|2,0,0]=4 4365 B6R1.2 Oc1cc[n][s]1 Amb24599867 [1,0,0,1,0,0|1,1,0]=4 4366 B6R1.2 Oc1cc[n]o1 Amb25807641 [1,0,0,1,0,0|1,0,1]=4 4367 B6R1.2 Oc1cc[s][n]1 Amb22371253 [1,0,0,1,0,0|2,0,0]=4 4368 B6R1.2 Oc1ccco1 Amb22230736 [1,0,0,1,0,0|0,0,2]=4 4369 B6R1.2 Oc1cccs1 Amb17201836 [1,0,0,1,0,0|0,1,1]=4 4370 B6R1.2 Oc1ccn[nH]1 Amb17621677 [1,0,0,1,0,0|2,0,0]=4 4371 B6R1.2 Oc1cco[n]1 Amb22736007 [1,0,0,1,0,0|2,0,0]=4 4372 B6R1.2 Oc1cscc1 Amb16231253 [1,0,0,1,0,0|2,0,0]=4 4373 B6R1.2 S=C1CCC=C1 Amb25147777 [1,0,0,1,0,0|1,1,0]=4 4374 B6R1.2 [13CH3]c1ccco1 Amb22367321 [1,0,0,1,0,0|1,0,1]=4 4375 B6R1.2 [SiH3]c1ccco1 Amb24511582 [1,0,0,1,0,0|1,0,1]=4 4376 B6R1.3 C\C=C\C1CO1 Amb25146414 [1,0,0,1,0,0|1,0,1]=4 4377 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,2]=4 4378 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [1,0,0,1,0,0|0,0,2]=4 4379 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,2]=4 4380 B6R1.8 CCC1OC1=O Amb24426509 [1,0,0,1,0,0|0,0,2]=4 4381 B6R1.10 O=S1(=O)CC=C1 Amb15693055 [1,0,0,1,0,0|1,0,1]=4 4382 B6R1.11 CC(O)C=1CC1 Amb25847894 [1,0,0,1,0,0|1,0,1]=4 4383 B6R1.11 OC(=O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,1]=4 4384 B6R1.11 OC(=O)C1CS1 Amb24641854 [1,0,0,1,0,0|1,0,1]=4 4385 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,1]=4 4386 B6R1.4 C=C1CCC1=O Amb25747444 [1,0,0,1,0,0|0,0,2]=4 4387 B6R1.4 C=C1OCC1=O Amb24478475 [1,0,0,1,0,0|1,0,1]=4 4388 B6R1.4 CC1=CCC1O Amb25695658 [1,0,0,1,0,0|0,0,1]=3 4389 B6R1.4 CC1OCC1=O Amb23456088 [1,0,0,1,0,0|1,0,1]=4 4390 B6R1.4 CC=1CCC1Br Amb25189799 [1,0,0,1,0,0|1,0,1]=4 4391 B6R1.4 C[C@@H]1CCC1=O Amb24334317 [1,0,0,1,0,0|0,0,2]=4 4392 B6R1.4 C[C@H]1CCC1=O Amb24333446 [1,0,0,1,0,0|0,0,2]=4 4393 B6R1.4 O=C1C=CC1=O Amb22731249 [1,0,0,1,0,0|1,0,1]=4 4394 B6R1.4 O=C1CCC1C Amb17593022 [1,0,0,1,0,0|0,0,2]=4 4395 B6R1.6 BrC=C1CCC1 Amb25189864 [1,0,0,1,0,0|1,0,1]=4 4396 B6R1.6 BrCC=1CCC1 Amb24652455 [1,0,0,1,0,0|1,0,1]=4 4397 B6R1.6 CC=C1CNC1 Amb24729453 [1,0,0,1,0,0|1,0,1]=4 4398 B6R1.6 ClC=C1COC1 Amb24332567 [1,0,0,1,0,0|1,0,1]=4 4399 B6R1.6 IC=C1CCC1 Amb24334135 [1,0,0,1,0,0|1,0,1]=4 4400 B6R1.6 O=C=C1CCC1 Amb25332371 [1,0,0,1,0,0|0,0,2]=4 4401 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,1]=4 4402 B6R1.6 O=CC1CCO1 Amb24565587 [1,0,0,1,0,0|1,0,1]=4 4403 B6R1.6 O=CN1CCC1 Amb24431842 [1,0,0,1,0,0|1,0,1]=4 4404 B6R1.6 OCC=1CCC1 Amb25744805 [1,0,0,1,0,0|0,0,1]=3 4405 B6R1.7 C[C@]1(CO1)C=O Amb25735120 [1,0,0,1,0,0|1,0,1]=4 4406 B6R1.12 CC1C(C)C1=O Amb25807048 [1,0,0,1,0,0|0,0,2]=4 4407 B6R1.12 O=C1C(F)=C1F Amb25262245 [1,0,0,1,0,0|2,0,0]=4 4408 B6R1.12 OC=1C(=O)C1O Amb25142626 [1,0,0,1,0,0|2,0,0]=4 4409 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,0,0,1,0,1|1,0,1]=4 4410 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,0,0,1,0,1|0,0,2]=4 4411 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,0,0,1,0,1|0,0,2]=4 4412 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,0,0,1,0,1|0,0,2]=4 4413 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,0,0,1,0,1|0,0,2]=4 4414 B8R1.1 CCC1=COC(=O)N1 Amb25276478 [0,0,0,1,0,1|0,0,2]=4 4415 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,1|0,0,2]=4 4416 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,0,0,1,0,1|0,0,2]=4 4417 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,0,0,1,0,1|0,0,1]=3 4418 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,0,0,1,0,1|1,0,1]=4 4419 B8R1.1 CNC=1CCC(=O)C1 Amb24377588 [0,0,0,1,0,1|2,0,0]=4 4420 B8R1.1 CNC=1CSC(=O)N1 Amb25350527 [0,0,0,1,0,1|1,1,0]=4 4421 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,0,0,1,0,1|1,0,1]=4 4422 B8R1.1 COC=1CCC(=O)C1 Amb21864758 [0,0,0,1,0,1|2,0,0]=4 4423 B8R1.1 COC=1COC(=S)C1 Amb25745165 [0,0,0,1,0,1|1,1,0]=4 4424 B8R1.1 CSC=1CCC(=O)C1 Amb24626948 [0,0,0,1,0,1|2,0,0]=4 4425 B8R1.1 C\C=C\1/C=CC(=O)O1 Amb24558315 [0,0,0,1,0,1|1,0,1]=4 4426 B8R1.1 C\C=C\1/CCC(=O)O1 Amb24751500 [0,0,0,1,0,1|1,0,0]=3 4427 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,0,0,1,0,1|1,0,1]=4 4428 B8R1.1 NNC=1COC(=O)C1 Amb18641767 [0,0,0,1,0,1|2,0,0]=4 4429 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,0,0,1,0,1|1,0,1]=4 4430 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,0,0,1,0,1|1,0,1]=4 4431 B8R1.1 O=C1C=C(CO1)C=O Amb24417175 [0,0,0,1,0,1|1,0,0]=3 4432 B8R1.1 O=C1CCC(=C1)C=O Amb24483014 [0,0,0,1,0,1|2,0,0]=4 4433 B8R1.1 O=C1CC\C(=C\Br)\O1 Amb24605306 [0,0,0,1,0,1|2,0,0]=4 4434 B8R1.1 O=C1CC\C(=C\Cl)\O1 Amb25024821 [0,0,0,1,0,1|2,0,0]=4 4435 B8R1.1 O=C1O\C(\CO1)=C/Br Amb25074539 [0,0,0,1,0,1|1,0,0]=3 4436 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,0,0,1,0,1|1,0,1]=4 4437 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,1,0,1|1,0,1]=4 4438 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,0,0,1,0,1|2,0,0]=4 4439 B8R1.4 CC1=CC(=O)CCS1 Amb25092957 [0,0,0,1,0,1|2,0,0]=4 4440 B8R1.4 CC1=CC(=O)NC=C1 Amb18034270 [0,0,0,1,0,1|1,0,1]=4 4441 B8R1.4 CC1=CC(=O)NN=C1 Amb19892393 [0,0,0,1,0,1|2,0,0]=4 4442 B8R1.4 CC1=CC=CC(=O)N1 Amb18540672 [0,0,0,1,0,1|1,0,1]=4 4443 B8R1.4 CC1=CC=CC(=O)O1 Amb20247496 [0,0,0,1,0,1|1,0,1]=4 4444 B8R1.4 CC1=CC=NC(=O)N1 Amb20665419 [0,0,0,1,0,1|1,0,1]=4 4445 B8R1.4 CC1=CC=NC(=O)N1 Amb22371457 [0,0,0,1,0,1|1,0,1]=4 4446 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,0,0,1,0,1|1,0,0]=3 4447 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,0,0,1,0,1|1,0,0]=3 4448 B8R1.4 CC1=CN=CC(=O)N1 Amb20240903 [0,0,0,1,0,1|2,0,0]=4 4449 B8R1.4 CC1=CNNC(=O)N1 Amb24482223 [0,0,0,1,0,1|2,0,0]=4 4450 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,0,0,1,0,1|0,0,2]=4 4451 B8R1.4 CC=1C=CNC(=O)N1 Amb19267100 [0,0,0,1,0,1|1,0,1]=4 4452 B8R1.4 CC=1C=CNC(=O)N1 Amb22168002 [0,0,0,1,0,1|1,0,1]=4 4453 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,0,0,1,0,1|1,0,0]=3 4454 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,0,0,1,0,1|0,0,0]=2 4455 B8R1.4 CC=1CC(C)=CCC1 Amb22227756 [0,0,0,1,0,1|2,0,0]=4 4456 B8R1.4 CC=1CC(O)CCC1 Amb25245575 [0,0,0,1,0,1|1,0,1]=4 4457 B8R1.4 CC=1CC(O)OCC1 Amb24524376 [0,0,0,1,0,1|0,0,2]=4 4458 B8R1.4 CC=1C[C@@H](O)CCC1 Amb24619172 [0,0,0,1,0,1|1,0,1]=4 4459 B8R1.4 CC=1NCCC(=O)N1 Amb24382048 [0,0,0,1,0,1|2,0,0]=4 4460 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,0,0,1,0,1|1,0,1]=4 4461 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,0,0,1,0,1|1,0,1]=4 4462 B8R1.4 Cc1cc(O)c[n]c1 Amb24090203 [0,0,0,1,0,1|2,0,0]=4 4463 B8R1.4 Cc1cncc(n1)O Amb10599623 [0,0,0,1,0,1|2,0,0]=4 4464 B8R1.4 Cc1cnnc(c1)O Amb10976059 [0,0,0,1,0,1|2,0,0]=4 4465 B8R1.4 NC1=CCNC(=O)N1 Amb25799600 [0,0,0,1,0,1|2,0,0]=4 4466 B8R1.4 O=C1C=C(Br)C=CO1 Amb20247270 [0,0,0,1,0,1|1,0,1]=4 4467 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,0,0,1,0,1|1,0,1]=4 4468 B8R1.4 O=C1C=C(Cl)C=CO1 Amb22001907 [0,0,0,1,0,1|1,0,1]=4 4469 B8R1.4 O=C1C=C(I)C=CO1 Amb20247267 [0,0,0,1,0,1|1,0,1]=4 4470 B8R1.4 O=C1CC(=O)OC=C1 Amb25358147 [0,0,0,1,0,1|1,0,1]=4 4471 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,0,0,1,0,1|1,0,1]=4 4472 B8R1.4 O=C1CSC=C(N1)C Amb2386684 [0,0,0,1,0,1|2,0,0]=4 4473 B8R1.4 Oc1cc(=O)occ1 Amb24066116 [0,0,0,1,0,1|1,0,1]=4 4474 B8R1.18 Brc1sc(c(c1)C)C Amb10600997 [0,0,0,1,0,1|1,1,0]=4 4475 B8R1.18 CC1=CC(=O)C=C1C Amb25373072 [0,0,0,1,0,1|1,0,0]=3 4476 B8R1.18 CC1=CC(=O)CC1=O Amb24583077 [0,0,0,1,0,1|2,0,0]=4 4477 B8R1.18 CC1=CC(=O)NC1=C Amb24483026 [0,0,0,1,0,1|1,0,1]=4 4478 B8R1.18 CC1=CC(=O)NN1C Amb19149104 [0,0,0,1,0,1|2,0,0]=4 4479 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,0,0,1,0,1|1,0,1]=4 4480 B8R1.18 CC1=CC(=O)OC1Cl Amb24601836 [0,0,0,1,0,1|1,0,1]=4 4481 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,0,0,1,0,1|1,0,1]=4 4482 B8R1.18 CC1=NC(=O)N=C1C Amb25211969 [0,0,0,1,0,1|1,0,0]=3 4483 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,0,0,1,0,1|1,0,1]=4 4484 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,0,0,1,0,1|1,0,1]=4 4485 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,0,0,1,0,1|0,0,2]=4 4486 B8R1.18 CC=1CC(=O)CC1C Amb25318947 [0,0,0,1,0,1|1,0,0]=3 4487 B8R1.18 CC=1CC(O)CC1C Amb25854391 [0,0,0,1,0,1|1,0,1]=4 4488 B8R1.18 CC=1NC(=O)NC1C Amb17933370 [0,0,0,1,0,1|1,0,0]=3 4489 B8R1.18 CC=1NC(=O)SC1Br Amb25096608 [0,0,0,1,0,1|1,1,0]=4 4490 B8R1.18 CC=1NC(=O)SC1S Amb24747429 [0,0,0,1,0,1|1,1,0]=4 4491 B8R1.18 CC=1NC(=S)NC1C Amb19804201 [0,0,0,1,0,1|1,1,0]=4 4492 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,0,0,1,0,1|1,0,0]=3 4493 B8R1.18 CC=1OC(=O)NC1C Amb19516947 [0,0,0,1,0,1|0,0,0]=2 4494 B8R1.18 CC=1OC(=O)OC1C Amb19654027 [0,0,0,1,0,1|0,0,0]=2 4495 B8R1.18 CC=1OC(=S)NC1C Amb19403669 [0,0,0,1,0,1|0,1,0]=3 4496 B8R1.18 CC=1SC(=O)NC1C Amb19281000 [0,0,0,1,0,1|0,1,0]=3 4497 B8R1.18 CC=1SC(=S)NC1C Amb21934308 [0,0,0,1,0,1|0,2,0]=4 4498 B8R1.18 CC=1SC(=S)SC1C Amb20660000 [0,0,0,1,0,1|0,2,0]=4 4499 B8R1.18 CC=1SC(=[Se])SC1C Amb20659985 [0,0,0,1,0,1|0,2,0]=4 4500 B8R1.18 CC=1[Se]C(=[Se])[Se]C1C Amb19883899 [0,0,0,1,0,1|0,2,0]=4 4501 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,0,0,1,0,1|2,0,0]=4 4502 B8R1.18 CN1OC(=O)NC1=O Amb25732949 [0,0,0,1,0,1|2,0,0]=4 4503 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,0,0,1,0,1|1,0,1]=4 4504 B8R1.18 C[C@@H]1OC(=O)C=C1O Amb25087875 [0,0,0,1,0,1|1,0,1]=4 4505 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,0,0,1,0,1|0,0,2]=4 4506 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,0,0,1,0,1|0,0,2]=4 4507 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,0,0,1,0,1|0,0,2]=4 4508 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,0,0,1,0,1|0,0,2]=4 4509 B8R1.18 Cc1[nH]c(=O)[nH]c1C Amb1156520 [0,0,0,1,0,1|1,0,0]=3 4510 B8R1.18 Cc1[nH]c(N)cc1C Amb18203399 [0,0,0,1,0,1|2,0,0]=4 4511 B8R1.18 Cc1[n]c(Br)[nH]c1C Amb22896717 [0,0,0,1,0,1|2,0,0]=4 4512 B8R1.18 Cc1[n]c(C)oc1Br Amb22499281 [0,0,0,1,0,1|2,0,0]=4 4513 B8R1.18 Cc1[n]c(C)oc1I Amb25079157 [0,0,0,1,0,1|2,0,0]=4 4514 B8R1.18 Cc1[n]c(N)[nH]c1C Amb22491036 [0,0,0,1,0,1|2,0,0]=4 4515 B8R1.18 Cc1[n]c(N)oc1Br Amb25262575 [0,0,0,1,0,1|2,0,0]=4 4516 B8R1.18 Cc1[n]c(O)[s]c1N Amb18203198 [0,0,0,1,0,1|1,1,0]=4 4517 B8R1.18 Cc1[s]c(Br)[n]c1C Amb22492292 [0,0,0,1,0,1|1,1,0]=4 4518 B8R1.18 Cc1[s]c(Cl)[n]c1C Amb19314651 [0,0,0,1,0,1|1,1,0]=4 4519 B8R1.18 Cc1[s]c(F)[n]c1C Amb23452580 [0,0,0,1,0,1|1,1,0]=4 4520 B8R1.18 Cc1[s]c(N)[n]c1C Amb22345589 [0,0,0,1,0,1|1,1,0]=4 4521 B8R1.18 Cc1cc(Br)oc1Br Amb21964709 [0,0,0,1,0,1|2,0,0]=4 4522 B8R1.18 Cc1cc(Br)oc1O Amb18190940 [0,0,0,1,0,1|2,0,0]=4 4523 B8R1.18 Cc1cc(C)c(C)[nH]1 Amb17672332 [0,0,0,1,0,1|2,0,0]=4 4524 B8R1.18 Cc1cc(C)oc1Cl Amb25064998 [0,0,0,1,0,1|2,0,0]=4 4525 B8R1.18 Cc1cc([n+](o1)C)C Amb10552697 [0,0,0,1,0,1|2,0,0]=4 4526 B8R1.18 Cc1oc(Br)[n]c1C Amb19516420 [0,0,0,1,0,1|1,0,0]=3 4527 B8R1.18 Cc1oc(C)[n]c1Br Amb25113846 [0,0,0,1,0,1|2,0,0]=4 4528 B8R1.18 Cc1oc(C)cc1I Amb25025524 [0,0,0,1,0,1|2,0,0]=4 4529 B8R1.18 Cc1oc(C)cc1N Amb23538767 [0,0,0,1,0,1|2,0,0]=4 4530 B8R1.18 Cc1oc(Cl)cc1C Amb24437563 [0,0,0,1,0,1|1,0,0]=3 4531 B8R1.18 Cc1oc(N)[n]c1C Amb21961491 [0,0,0,1,0,1|1,0,0]=3 4532 B8R1.18 Cc1oc(c(c1)C)C Amb10606773 [0,0,0,1,0,1|1,0,0]=3 4533 B8R1.18 Nc1[nH]c(c(n1)C)C Amb17108812 [0,0,0,1,0,1|2,0,0]=4 4534 B8R1.18 Nc1oc(c(n1)C)C Amb1107547 [0,0,0,1,0,1|1,0,0]=3 4535 B8R1.18 Nc1sc(c(c1)C)C Amb17096049 [0,0,0,1,0,1|1,1,0]=4 4536 B8R1.18 Nc1sc(c(n1)C)C Amb1017289 [0,0,0,1,0,1|1,1,0]=4 4537 B8R1.18 Nc1sc(c(n1)C)C Amb2227569 [0,0,0,1,0,1|1,1,0]=4 4538 B8R1.18 O=C1C=C(C(=O)O1)Br Amb15693391 [0,0,0,1,0,1|2,0,0]=4 4539 B8R1.18 O=C1C=C(C(=O)O1)Cl Amb10070255 [0,0,0,1,0,1|2,0,0]=4 4540 B8R1.18 O=C1C=C(C(C1)C)C Amb16191977 [0,0,0,1,0,1|1,0,1]=4 4541 B8R1.18 Sc1oc(c(n1)C)C Amb2371783 [0,0,0,1,0,1|0,1,0]=3 4542 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,1|0,0,2]=4 4543 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,1|0,0,2]=4 4544 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,0,0,1,0,1|0,0,1]=3 4545 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,1|0,0,2]=4 4546 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,1|0,0,2]=4 4547 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,1|0,0,2]=4 4548 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,1,0,1|1,0,1]=4 4549 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,1,0,1|1,0,1]=4 4550 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,1,0,1|1,0,1]=4 4551 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,1|0,0,2]=4 4552 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,1|0,0,2]=4 4553 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,1|0,0,2]=4 4554 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,0,0,1,0,1|2,0,0]=4 4555 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,0,0,1,0,1|1,0,1]=4 4556 B8R1.34 CC(=O)C=C1CCC1 Amb21858878 [0,0,0,1,0,1|1,0,1]=4 4557 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,0,0,1,0,1|0,0,1]=3 4558 B8R1.34 OC(=O)C=C1CSC1 Amb24379733 [0,0,0,1,0,1|1,0,1]=4 4559 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,0,0,1,0,1|1,0,1]=4 4560 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,0,0,1,0,1|0,0,0]=2 4561 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,0,0,1,0,1|1,0,1]=4 4562 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,0,0,1,0,1|0,0,2]=4 4563 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,0,0,1,0,1|0,0,2]=4 4564 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,0,0,1,0,1|0,0,2]=4 4565 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,0,0,1,0,1|0,0,2]=4 4566 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,0,0,1,0,1|0,0,2]=4 4567 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,0,0,1,0,1|1,0,1]=4 4568 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,0,0,1,0,1|1,0,1]=4 4569 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,0,0,1,0,1|0,0,0]=2 4570 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,0,0,1,0,1|0,0,0]=2 4571 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,0,0,1,0,1|1,0,1]=4 4572 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,0,0,1,0,1|1,0,1]=4 4573 B8R1.51 CC1=CCS(=O)(=O)C1 Amb1419574 [0,0,0,1,0,1|1,0,1]=4 4574 B8R1.51 CC=1CP(C)(=O)CC1 Amb25127881 [0,0,0,1,0,1|2,0,0]=4 4575 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,0,0,1,0,1|0,0,2]=4 4576 B8R1.67 CC=1C(C(O)=O)C1C Amb25737086 [0,0,0,1,0,1|0,0,0]=2 4577 B8R1.67 CC=1C(C)C1C(O)=O Amb24586301 [0,0,0,1,0,1|0,0,1]=3 4578 B8R1.67 CC=1[C@H](C)C1C(O)=O Amb24445514 [0,0,0,1,0,1|0,0,1]=3 4579 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,0,0,1,0,1|0,0,2]=4 4580 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,0,0,1,0,1|0,0,2]=4 4581 B8R1.5 CC1=CC=CNC1=O Amb18028406 [0,1,0,1,0,0|1,0,1]=4 4582 B8R1.5 CC1=CC=NNC1=O Amb21960917 [0,1,0,1,0,0|1,0,1]=4 4583 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,1,0,0|1,0,1]=4 4584 B8R1.5 CC1=CCCC[C@H]1O Amb25699989 [0,1,0,1,0,0|1,0,1]=4 4585 B8R1.5 CC1=CCCNC1=O Amb25127954 [0,1,0,1,0,0|1,0,0]=3 4586 B8R1.5 CC1=CCNC=C1Br Amb15691077 [0,1,0,1,0,0|2,0,0]=4 4587 B8R1.5 CC1=CN=CNC1=O Amb21937121 [0,1,0,1,0,0|1,0,1]=4 4588 B8R1.5 CC1=NC=CNC1=O Amb22436791 [0,1,0,1,0,0|1,0,1]=4 4589 B8R1.5 CC1=NCCN=C1O Amb25178610 [0,1,0,1,0,0|1,0,1]=4 4590 B8R1.5 CC1C=CCCC1=O Amb25723298 [0,1,0,1,0,0|1,0,1]=4 4591 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|0,0,2]=4 4592 B8R1.5 CC1SCCOC1=O Amb25255546 [0,1,0,1,0,0|0,0,2]=4 4593 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,1,0,0|1,0,1]=4 4594 B8R1.5 Cc1[n]c[n]cc1O Amb18641411 [0,1,0,1,0,0|2,0,0]=4 4595 B8R1.5 Cc1[n]cccc1O Amb24062097 [0,1,0,1,0,0|1,0,1]=4 4596 B8R1.5 Cc1ccccc1O Amb2447562 [0,1,0,1,0,0|1,0,1]=4 4597 B8R1.5 Cc1cccnc1O Amb2389971 [0,1,0,1,0,0|1,0,1]=4 4598 B8R1.5 Cc1ccnnc1O Amb10602316 [0,1,0,1,0,0|1,0,1]=4 4599 B8R1.5 Cc1ncn[nH]c1=O Amb10560464 [0,1,0,1,0,0|2,0,0]=4 4600 B8R1.5 O=C1C=COCC1=O Amb24100791 [0,1,0,1,0,0|1,0,1]=4 4601 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,1,0,0|2,0,0]=4 4602 B8R1.5 O=C1CCCC=C1C Amb15693479 [0,1,0,1,0,0|1,0,0]=3 4603 B8R1.5 O=C1CCCC=C1Cl Amb24524498 [0,1,0,1,0,0|2,0,0]=4 4604 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,1,0,0|2,0,0]=4 4605 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,1,0,0|1,0,1]=4 4606 B8R1.5 O=C1COCCC1=O Amb25712943 [0,1,0,1,0,0|1,0,1]=4 4607 B8R1.5 O=C1NCC=CC1=O Amb25789819 [0,1,0,1,0,0|2,0,0]=4 4608 B8R1.5 O=C1NCCC=C1F Amb24377281 [0,1,0,1,0,0|2,0,0]=4 4609 B8R1.5 O=C1OC=CC=C1Cl Amb20247271 [0,1,0,1,0,0|1,0,1]=4 4610 B8R1.5 O=C1OC=CC=C1I Amb20247272 [0,1,0,1,0,0|1,0,1]=4 4611 B8R1.5 O=C1OC=CCC1=O Amb25373353 [0,1,0,1,0,0|1,0,1]=4 4612 B8R1.5 O=C1OCC=CC1=O Amb25116554 [0,1,0,1,0,0|1,0,0]=3 4613 B8R1.5 O=C1OCCNC1=O Amb24120265 [0,1,0,1,0,0|1,0,1]=4 4614 B8R1.5 OC1=CC=COC1=O Amb17933813 [0,1,0,1,0,0|1,0,1]=4 4615 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,1,0,1,0,0|1,0,0]=3 4616 B8R1.7 CC(=O)C1=CCN=N1 Amb25689687 [0,1,0,1,0,0|2,0,0]=4 4617 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,1,0,1,0,0|2,0,0]=4 4618 B8R1.7 CC(=O)C1CCC=C1 Amb25373909 [0,1,0,1,0,0|1,0,1]=4 4619 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,1,0,1,0,0|1,0,1]=4 4620 B8R1.7 CC(=O)C=1C=CCC1 Amb24334264 [0,1,0,1,0,0|1,0,1]=4 4621 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [0,1,0,1,0,0|1,0,0]=3 4622 B8R1.7 CC(=O)C=1CCCN1 Amb21962890 [0,1,0,1,0,0|1,0,1]=4 4623 B8R1.7 CC(=O)C=1CSCC1 Amb25830074 [0,1,0,1,0,0|1,0,0]=3 4624 B8R1.7 C[C@@H](O)C=1CCCC1 Amb24545891 [0,1,0,1,0,0|1,0,1]=4 4625 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,1,0,1,0,0|2,0,0]=4 4626 B8R1.7 NC(=O)C1CCC=C1 Amb25063981 [0,1,0,1,0,0|1,0,1]=4 4627 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [0,1,0,1,0,0|1,0,0]=3 4628 B8R1.7 NC(=O)C=1CCON1 Amb24481311 [0,1,0,1,0,0|2,0,0]=4 4629 B8R1.7 O=C(Cl)C1=CCC=N1 Amb24518840 [0,1,0,1,0,0|1,0,1]=4 4630 B8R1.7 O=C(Cl)C=1NCCN1 Amb25215918 [0,1,0,1,0,0|2,0,0]=4 4631 B8R1.7 OB(C1=CCCC1)O Amb10068948 [0,1,0,1,0,0|1,0,1]=4 4632 B8R1.7 OB(O)C1=CCCO1 Amb22168857 [0,1,0,1,0,0|1,0,1]=4 4633 B8R1.7 OC(=O)C1=CC=CC1 Amb10574923 [0,1,0,1,0,0|0,0,1]=3 4634 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|0,0,0]=2 4635 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [0,1,0,1,0,0|0,0,0]=2 4636 B8R1.7 OC(=O)C1=CCCS1 Amb18642795 [0,1,0,1,0,0|0,0,0]=2 4637 B8R1.7 OC(=O)C1=CN=S=N1 Amb17798585 [0,1,0,1,0,0|2,0,0]=4 4638 B8R1.7 OC(=O)C1=CSCS1 Amb25330178 [0,1,0,1,0,0|1,0,0]=3 4639 B8R1.7 OC(=O)C1=NCCS1 Amb18642837 [0,1,0,1,0,0|1,0,0]=3 4640 B8R1.7 OC(=O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|0,0,2]=4 4641 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|0,0,2]=4 4642 B8R1.7 OC(=O)C1C=CCS1 Amb18642794 [0,1,0,1,0,0|0,0,2]=4 4643 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [0,1,0,1,0,0|0,0,1]=3 4644 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|0,0,2]=4 4645 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [0,1,0,1,0,0|0,0,2]=4 4646 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|0,0,2]=4 4647 B8R1.7 OC(=O)C1CCNN1 Amb18641878 [0,1,0,1,0,0|1,0,1]=4 4648 B8R1.7 OC(=O)C1CCON1 Amb24351403 [0,1,0,1,0,0|1,0,1]=4 4649 B8R1.7 OC(=O)C1CN=CS1 Amb25829554 [0,1,0,1,0,0|1,0,1]=4 4650 B8R1.7 OC(=O)C1CNC=N1 Amb25247319 [0,1,0,1,0,0|1,0,1]=4 4651 B8R1.7 OC(=O)C1CNCC1 Amb16230724 [0,1,0,1,0,0|0,0,2]=4 4652 B8R1.7 OC(=O)C1CNCC1 Amb16233446 [0,1,0,1,0,0|0,0,2]=4 4653 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [0,1,0,1,0,0|1,0,1]=4 4654 B8R1.7 OC(=O)C1CSC=C1 Amb18642796 [0,1,0,1,0,0|0,0,2]=4 4655 B8R1.7 OC(=O)C1CSCC1 Amb18124360 [0,1,0,1,0,0|0,0,2]=4 4656 B8R1.7 OC(=O)C1CSCN1 Amb2549799 [0,1,0,1,0,0|1,0,1]=4 4657 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [0,1,0,1,0,0|0,0,2]=4 4658 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [0,1,0,1,0,0|1,0,1]=4 4659 B8R1.7 OC(=O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,1]=4 4660 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|1,0,1]=4 4661 B8R1.7 OC(=O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|1,0,1]=4 4662 B8R1.7 OC(=O)C=1C=CCN1 Amb25178644 [0,1,0,1,0,0|0,0,1]=3 4663 B8R1.7 OC(=O)C=1CC=CC1 Amb24553923 [0,1,0,1,0,0|0,0,1]=3 4664 B8R1.7 OC(=O)C=1CC=NN1 Amb22235538 [0,1,0,1,0,0|1,0,1]=4 4665 B8R1.7 OC(=O)C=1CCCN1 Amb18641721 [0,1,0,1,0,0|0,0,1]=3 4666 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [0,1,0,1,0,0|0,0,0]=2 4667 B8R1.7 OC(=O)C=1CCON1 Amb24353499 [0,1,0,1,0,0|1,0,0]=3 4668 B8R1.7 OC(=O)C=1CN=CN1 Amb22229764 [0,1,0,1,0,0|1,0,0]=3 4669 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [0,1,0,1,0,0|0,0,0]=2 4670 B8R1.7 OC(=O)C=1CSCC1 Amb18642797 [0,1,0,1,0,0|0,0,0]=2 4671 B8R1.7 OC(=O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|0,0,2]=4 4672 B8R1.7 OC(=O)[C@@H]1CCC=N1 Amb25075457 [0,1,0,1,0,0|0,0,1]=3 4673 B8R1.7 OC(=O)[C@@H]1COCC1 Amb22226787 [0,1,0,1,0,0|0,0,2]=4 4674 B8R1.7 OC(=O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|1,0,1]=4 4675 B8R1.7 OC(=O)[C@@H]1NCCS1 Amb24383041 [0,1,0,1,0,0|1,0,1]=4 4676 B8R1.7 OC(=O)[C@H]1C=CCN1 Amb19515991 [0,1,0,1,0,0|0,0,2]=4 4677 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [0,1,0,1,0,0|0,0,1]=3 4678 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [0,1,0,1,0,0|0,0,2]=4 4679 B8R1.7 OC(=O)[C@H]1CCSS1 Amb24738509 [0,1,0,1,0,0|1,0,1]=4 4680 B8R1.7 OC(=O)[C@H]1COCC1 Amb10603235 [0,1,0,1,0,0|0,0,2]=4 4681 B8R1.7 OC(=O)[C@H]1COCN1 Amb25733088 [0,1,0,1,0,0|1,0,1]=4 4682 B8R1.7 OC(=O)[C@H]1NCC=C1 Amb16183937 [0,1,0,1,0,0|0,0,2]=4 4683 B8R1.7 OC(=O)c1[n][n]c[s]1 Amb20241053 [0,1,0,1,0,0|2,0,0]=4 4684 B8R1.7 OC(=O)c1[n][n]co1 Amb21964326 [0,1,0,1,0,0|2,0,0]=4 4685 B8R1.7 OC(=O)c1[n]c[n][s]1 Amb18203206 [0,1,0,1,0,0|2,0,0]=4 4686 B8R1.7 OC(=O)c1[n]cco1 Amb22899196 [0,1,0,1,0,0|1,0,1]=4 4687 B8R1.7 OC(=O)c1c[nH]cn1 Amb1969735 [0,1,0,1,0,0|1,0,1]=4 4688 B8R1.7 OC(=O)c1c[nH]nc1 Amb10610070 [0,1,0,1,0,0|1,0,1]=4 4689 B8R1.7 OC(=O)c1c[nH]nc1 Amb1934821 [0,1,0,1,0,0|1,0,1]=4 4690 B8R1.7 OC(=O)c1c[n][n]o1 Amb24651283 [0,1,0,1,0,0|2,0,0]=4 4691 B8R1.7 OC(=O)c1c[s]c[n]1 Amb21953919 [0,1,0,1,0,0|1,0,1]=4 4692 B8R1.7 OC(=O)c1cc[nH]c1 Amb17942956 [0,1,0,1,0,0|0,0,2]=4 4693 B8R1.7 OC(=O)c1cc[s][n]1 Amb19894963 [0,1,0,1,0,0|1,0,1]=4 4694 B8R1.7 OC(=O)c1ccc[nH]1 Amb1154382 [0,1,0,1,0,0|0,0,2]=4 4695 B8R1.7 OC(=O)c1ccc[pH]1 Amb24690352 [0,1,0,1,0,0|0,0,2]=4 4696 B8R1.7 OC(=O)c1ccc[s]1 Amb22730855 [0,1,0,1,0,0|0,0,2]=4 4697 B8R1.7 OC(=O)c1ccn[nH]1 Amb1301347 [0,1,0,1,0,0|1,0,1]=4 4698 B8R1.7 OC(=O)c1ccno1 Amb1152220 [0,1,0,1,0,0|1,0,1]=4 4699 B8R1.7 OC(=O)c1ccns1 Amb1091955 [0,1,0,1,0,0|1,0,1]=4 4700 B8R1.7 OC(=O)c1cn[nH]n1 Amb17622050 [0,1,0,1,0,0|2,0,0]=4 4701 B8R1.7 OC(=O)c1cnco1 Amb1158212 [0,1,0,1,0,0|1,0,1]=4 4702 B8R1.7 OC(=O)c1cncs1 Amb1158214 [0,1,0,1,0,0|1,0,1]=4 4703 B8R1.7 OC(=O)c1cnsn1 Amb1091970 [0,1,0,1,0,0|2,0,0]=4 4704 B8R1.7 OC(=O)c1cocn1 Amb10071584 [0,1,0,1,0,0|1,0,1]=4 4705 B8R1.7 OC(=O)c1cscc1 Amb1156673 [0,1,0,1,0,0|0,0,2]=4 4706 B8R1.7 OC(=O)c1cscn1 Amb17039667 [0,1,0,1,0,0|1,0,1]=4 4707 B8R1.7 OC(=O)c1cscn1 Amb2455731 [0,1,0,1,0,0|1,0,1]=4 4708 B8R1.7 OC(=O)c1n[nH]cn1 Amb1088840 [0,1,0,1,0,0|2,0,0]=4 4709 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [0,1,0,1,0,0|0,0,2]=4 4710 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [0,1,0,1,0,0|0,0,2]=4 4711 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [0,1,0,1,0,0|0,0,2]=4 4712 B8R1.7 [13CH3][13C](=O)C1=NCCC1 Amb17607638 [0,1,0,1,0,0|1,0,1]=4 4713 B8R1.13 C\C=C\C1CCC1=O Amb24513749 [0,1,0,1,0,0|1,0,1]=4 4714 B8R1.13 O=C/1NC\C1=C\CCl Amb25174863 [0,1,0,1,0,0|1,0,0]=3 4715 B8R1.19 CC1(N)CCOC1=O Amb24632713 [0,1,0,1,0,0|0,0,2]=4 4716 B8R1.19 O=C1OCCC1(C)C Amb10603955 [0,1,0,1,0,0|0,0,2]=4 4717 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,1,0,1,0,0|0,0,2]=4 4718 B8R1.23 CC=1CC(C1)C(C)=O Amb24676939 [0,1,0,1,0,0|1,0,1]=4 4719 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,1,0,1,0,0|0,0,2]=4 4720 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,1,0,1,0,0|0,0,2]=4 4721 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,1,0,1,0,0|0,0,2]=4 4722 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,1,0,1,0,0|0,0,2]=4 4723 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,1,0,1,0,0|0,0,2]=4 4724 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,1,0,1,0,0|0,0,2]=4 4725 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,1,0,1,0,0|0,0,2]=4 4726 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,1,0,1,0,0|0,0,2]=4 4727 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,1,0,1,0,0|0,0,2]=4 4728 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,1,0,1,0,0|0,0,2]=4 4729 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,1,0,1,0,0|1,0,1]=4 4730 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,1,0,1,0,0|1,0,1]=4 4731 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|0,0,2]=4 4732 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,1,0,1,0,0|1,0,1]=4 4733 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,1,0,1,0,0|0,0,2]=4 4734 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,1,0,1,0,0|1,0,1]=4 4735 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,1,0,1,0,0|0,0,2]=4 4736 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,1,0,1,0,0|0,0,2]=4 4737 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,1,0,1,0,0|0,0,2]=4 4738 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,1,0,1,0,0|0,0,2]=4 4739 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,1,0,1,0,0|0,0,2]=4 4740 B8R1.30 CC1=NC1(C)C(N)=O Amb25230606 [0,1,0,1,0,0|1,0,1]=4 4741 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,1,0,1,0,0|0,0,2]=4 4742 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,1,0,1,0,0|0,0,2]=4 4743 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,1,0,1,0,0|0,0,2]=4 4744 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,1,0,1,0,0|0,0,2]=4 4745 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,1,0,1,0,0|0,0,2]=4 4746 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,1,0,1,0,0|0,0,2]=4 4747 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,1,0,1,0,0|0,0,2]=4 4748 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,1,0,1,0,0|0,0,2]=4 4749 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,1,0,1,0,0|0,0,2]=4 4750 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,1,0,1,0,0|0,0,2]=4 4751 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,1,0,1,0,0|0,0,2]=4 4752 B8R1.46 CC=1C(=O)CC1OC Amb24389071 [0,1,0,1,0,0|1,0,0]=3 4753 B8R1.46 CC=1C(C)CC1CO Amb24502274 [0,1,0,1,0,0|1,0,1]=4 4754 B8R1.46 CC=1[C@@H](C)CC1CO Amb25316018 [0,1,0,1,0,0|1,0,1]=4 4755 B8R1.46 CCC1=CC(=O)C1=O Amb24691708 [0,1,0,1,0,0|2,0,0]=4 4756 B8R1.46 CNC1=CC(=O)C1=O Amb22171431 [0,1,0,1,0,0|2,0,0]=4 4757 B8R1.46 C[C@@H]1[C@H](CBr)OC1=O Amb24612442 [0,1,0,1,0,0|0,0,2]=4 4758 B8R1.46 C[C@H]1[C@H](CBr)OC1=O Amb24626650 [0,1,0,1,0,0|0,0,2]=4 4759 B8R1.54 C=C(C1CC1)C(O)=O Amb24481397 [0,1,0,1,0,0|0,0,2]=4 4760 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,1,0,1,0,0|0,0,2]=4 4761 B8R1.54 CC(C(O)=O)=C1CC1 Amb24450586 [0,1,0,1,0,0|0,0,0]=2 4762 B8R1.54 O=C(C(=O)O)C1CC1 Amb16233327 [0,1,0,1,0,0|1,0,1]=4 4763 B8R1.54 OC(=O)C(Cl)=C1CC1 Amb24427356 [0,1,0,1,0,0|1,0,0]=3 4764 B8R1.78 CC1(CCN1)C(O)=O Amb24483061 [0,1,0,1,0,0|0,0,2]=4 4765 B8R1.78 CC1(CCO1)C(O)=O Amb22001906 [0,1,0,1,0,0|0,0,2]=4 4766 B8R1.78 CC1(CNC1)C(O)=O Amb24077476 [0,1,0,1,0,0|0,0,2]=4 4767 B8R1.78 CC1(CNC1)C(O)=O Amb24561978 [0,1,0,1,0,0|0,0,2]=4 4768 B8R1.78 CC1(CSC1)C(O)=O Amb21960451 [0,1,0,1,0,0|0,0,2]=4 4769 B8R1.78 C[C@]1(CCN1)C(O)=O Amb25726906 [0,1,0,1,0,0|0,0,2]=4 4770 B8R1.78 OC(=O)C1(C)CCC1 Amb10843968 [0,1,0,1,0,0|0,0,2]=4 4771 B8R1.78 OC(=O)C1(C)COC1 Amb13883560 [0,1,0,1,0,0|0,0,2]=4 4772 B8R1.78 OC(=O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|0,0,2]=4 4773 B8R1.78 OC(=O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|0,0,2]=4 4774 B8R1.11 Brc1occc1CBr Amb24684501 [0,1,0,1,0,0|1,0,1]=4 4775 B8R1.11 C#CC1=CCCC1=O Amb25071560 [0,1,0,1,0,0|1,0,1]=4 4776 B8R1.11 C=C=C1CCOC1=O Amb24461343 [0,1,0,1,0,0|0,0,2]=4 4777 B8R1.11 C=CC1=CCOC1=O Amb25217790 [0,1,0,1,0,0|0,0,1]=3 4778 B8R1.11 C=CN1CCOC1=O Amb24595910 [0,1,0,1,0,0|1,0,1]=4 4779 B8R1.11 CC1=CCCC1C=O Amb24611215 [0,1,0,1,0,0|1,0,1]=4 4780 B8R1.11 CC1=CCCC1CO Amb25804911 [0,1,0,1,0,0|1,0,1]=4 4781 B8R1.11 CC=1CCCC1C=O Amb18641615 [0,1,0,1,0,0|1,0,1]=4 4782 B8R1.11 CC=1CCSC1C=O Amb18642671 [0,1,0,1,0,0|0,1,1]=4 4783 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,1,0,1,0,0|1,0,0]=3 4784 B8R1.11 CCC1=CCNC1=O Amb25180275 [0,1,0,1,0,0|1,0,0]=3 4785 B8R1.11 CCC1=CCOC1=O Amb25189060 [0,1,0,1,0,0|0,0,0]=2 4786 B8R1.11 CCC1CCOC1=O Amb23538353 [0,1,0,1,0,0|0,0,2]=4 4787 B8R1.11 CCc1c[nH][n]c1O Amb23515251 [0,1,0,1,0,0|2,0,0]=4 4788 B8R1.11 CCc1c[n]oc1N Amb18278950 [0,1,0,1,0,0|2,0,0]=4 4789 B8R1.11 CCc1ccoc1Br Amb13884533 [0,1,0,1,0,0|1,0,1]=4 4790 B8R1.11 CNC1=CCOC1=O Amb25678658 [0,1,0,1,0,0|0,0,0]=2 4791 B8R1.11 CNC1=CONC1=O Amb24597924 [0,1,0,1,0,0|1,0,1]=4 4792 B8R1.11 CNC1=CSSC1=O Amb25747219 [0,1,0,1,0,0|1,1,0]=4 4793 B8R1.11 CNC1CONC1=O Amb24120339 [0,1,0,1,0,0|1,0,1]=4 4794 B8R1.11 CNc1c[n][nH]c1O Amb24680079 [0,1,0,1,0,0|2,0,0]=4 4795 B8R1.11 COC1=CCSC1=O Amb24511740 [0,1,0,1,0,0|0,1,0]=3 4796 B8R1.11 COC1=COCC1=O Amb24633592 [0,1,0,1,0,0|1,0,1]=4 4797 B8R1.11 CON1CCOC1=O Amb25769302 [0,1,0,1,0,0|1,0,1]=4 4798 B8R1.11 COc1c[s]cc1O Amb24518802 [0,1,0,1,0,0|2,0,0]=4 4799 B8R1.11 CSC1=CCOC1=O Amb24614865 [0,1,0,1,0,0|0,0,0]=2 4800 B8R1.11 C\C=C/1\CC=CC1=O Amb25044340 [0,1,0,1,0,0|1,0,0]=3 4801 B8R1.11 C\C=C/1\CCCC1=O Amb25205820 [0,1,0,1,0,0|1,0,0]=3 4802 B8R1.11 C\C=C/1\CCC[C@@H]1O Amb25369446 [0,1,0,1,0,0|1,0,1]=4 4803 B8R1.11 C\C=C/1\CCC[C@H]1O Amb24457783 [0,1,0,1,0,0|1,0,1]=4 4804 B8R1.11 C\C=C/1\CCOC1=O Amb24697124 [0,1,0,1,0,0|0,0,0]=2 4805 B8R1.11 C\C=C/1\OC=CC1=O Amb25217811 [0,1,0,1,0,0|1,0,1]=4 4806 B8R1.11 C\C=C\1/CC=CC1=O Amb25189062 [0,1,0,1,0,0|1,0,0]=3 4807 B8R1.11 Cc1c[nH]cc1C=O Amb18203407 [0,1,0,1,0,0|2,0,0]=4 4808 B8R1.11 Cc1c[nH]cc1CO Amb23441156 [0,1,0,1,0,0|2,0,0]=4 4809 B8R1.11 Cc1c[nH]cc1OC Amb25169592 [0,1,0,1,0,0|2,0,0]=4 4810 B8R1.11 Cc1c[n][s]c1CO Amb24482066 [0,1,0,1,0,0|1,1,0]=4 4811 B8R1.11 Cc1c[n]oc1CBr Amb25675743 [0,1,0,1,0,0|2,0,0]=4 4812 B8R1.11 Cc1c[n]oc1CO Amb24467683 [0,1,0,1,0,0|1,0,1]=4 4813 B8R1.11 Cc1c[s]cc1CO Amb24483178 [0,1,0,1,0,0|2,0,0]=4 4814 B8R1.11 Cc1c[s]cc1OC Amb24524146 [0,1,0,1,0,0|2,0,0]=4 4815 B8R1.11 Cc1cc[s]c1OC Amb25064766 [0,1,0,1,0,0|0,1,1]=4 4816 B8R1.11 Cc1ccoc1C#N Amb25352891 [0,1,0,1,0,0|1,0,1]=4 4817 B8R1.11 Cc1ccoc1CBr Amb18183895 [0,1,0,1,0,0|1,0,1]=4 4818 B8R1.11 Cc1cn[nH]c1C=O Amb10789272 [0,1,0,1,0,0|2,0,0]=4 4819 B8R1.11 Cc1co[n]c1CO Amb24593199 [0,1,0,1,0,0|2,0,0]=4 4820 B8R1.11 Cc1cocc1C=O Amb18641606 [0,1,0,1,0,0|2,0,0]=4 4821 B8R1.11 Cc1cscc1C=O Amb2447064 [0,1,0,1,0,0|2,0,0]=4 4822 B8R1.11 Cc1o[n]cc1CCl Amb22754839 [0,1,0,1,0,0|2,0,0]=4 4823 B8R1.11 Cc1o[n]cc1CN Amb18941785 [0,1,0,1,0,0|2,0,0]=4 4824 B8R1.11 Cc1o[n]cc1CO Amb22754687 [0,1,0,1,0,0|2,0,0]=4 4825 B8R1.11 Cc1occc1CBr Amb18183894 [0,1,0,1,0,0|1,0,1]=4 4826 B8R1.11 Cc1occc1CN Amb10609995 [0,1,0,1,0,0|1,0,1]=4 4827 B8R1.11 Cc1occc1CS Amb24538700 [0,1,0,1,0,0|1,0,1]=4 4828 B8R1.11 Clc1occc1CCl Amb25772586 [0,1,0,1,0,0|1,0,1]=4 4829 B8R1.11 N#CC1=CCOC1=O Amb25268705 [0,1,0,1,0,0|0,0,1]=3 4830 B8R1.11 N=CC=1CCNC1O Amb24713922 [0,1,0,1,0,0|2,0,0]=4 4831 B8R1.11 NCC1=CCCC1=O Amb25168851 [0,1,0,1,0,0|1,0,0]=3 4832 B8R1.11 NCN1CCOC1=O Amb25662499 [0,1,0,1,0,0|1,0,1]=4 4833 B8R1.11 NCc1c[nH][n]c1O Amb24570675 [0,1,0,1,0,0|2,0,0]=4 4834 B8R1.11 NCc1c[n]oc1Br Amb24740598 [0,1,0,1,0,0|2,0,0]=4 4835 B8R1.11 NCc1c[n]oc1Cl Amb25268339 [0,1,0,1,0,0|2,0,0]=4 4836 B8R1.11 NCc1c[n]oc1O Amb25851502 [0,1,0,1,0,0|1,0,1]=4 4837 B8R1.11 NCc1c[s]cc1O Amb24387771 [0,1,0,1,0,0|2,0,0]=4 4838 B8R1.11 NCc1ccoc1Cl Amb25128829 [0,1,0,1,0,0|1,0,1]=4 4839 B8R1.11 N\C=C/1\CCCC1=O Amb24417382 [0,1,0,1,0,0|2,0,0]=4 4840 B8R1.11 N\C=C/1\CCOC1=O Amb24575038 [0,1,0,1,0,0|1,0,0]=3 4841 B8R1.11 Nc1ccoc1C=O Amb18203397 [0,1,0,1,0,0|1,0,1]=4 4842 B8R1.11 O=C/1OCC\C1=C/Cl Amb24723140 [0,1,0,1,0,0|1,0,0]=3 4843 B8R1.11 O=C1CCC=C1C=O Amb18641556 [0,1,0,1,0,0|1,0,1]=4 4844 B8R1.11 O=C1OCCC1CCl Amb24649714 [0,1,0,1,0,0|0,0,2]=4 4845 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,1,0,1,0,0|1,0,1]=4 4846 B8R1.11 O=CN1CCOC1=O Amb25246739 [0,1,0,1,0,0|2,0,0]=4 4847 B8R1.11 O=Cc1o[n]cc1Br Amb18191116 [0,1,0,1,0,0|2,0,0]=4 4848 B8R1.11 O=Cc1o[n]cc1Cl Amb18199347 [0,1,0,1,0,0|2,0,0]=4 4849 B8R1.11 O=Cc1occc1Br Amb2447448 [0,1,0,1,0,0|1,0,1]=4 4850 B8R1.11 O=Cc1occc1Cl Amb18202965 [0,1,0,1,0,0|1,0,1]=4 4851 B8R1.11 O=Cc1occc1F Amb18203365 [0,1,0,1,0,0|1,0,1]=4 4852 B8R1.11 O=Cc1occc1I Amb25089234 [0,1,0,1,0,0|1,0,1]=4 4853 B8R1.11 OC1=CCC=C1C=O Amb25770502 [0,1,0,1,0,0|1,0,1]=4 4854 B8R1.11 OCC1=CCCC1=O Amb15693428 [0,1,0,1,0,0|1,0,0]=3 4855 B8R1.11 OCC1=CCCC1O Amb25226276 [0,1,0,1,0,0|1,0,1]=4 4856 B8R1.11 OCC1=CCOC1=O Amb25286254 [0,1,0,1,0,0|0,0,0]=2 4857 B8R1.11 OC[C@@H]1CCOC1=O Amb24423403 [0,1,0,1,0,0|0,0,2]=4 4858 B8R1.11 O\C=C/1\CCOC1=O Amb24705599 [0,1,0,1,0,0|1,0,0]=3 4859 B8R1.11 O\C=C/1\CCSC1=O Amb24534026 [0,1,0,1,0,0|1,1,0]=4 4860 B8R1.11 O\C=C/1\N=COC1=O Amb25850590 [0,1,0,1,0,0|1,0,1]=4 4861 B8R1.11 [N-]=[N+]=C1CCOC1=O Amb25207854 [0,1,0,1,0,0|1,0,1]=4 4862 B8R1.11 [O-]C=C1CCCC1=O Amb19515665 [0,1,0,1,0,0|2,0,0]=4 4863 B8R1.25 C=C1C(=O)C(O)=C1O Amb25032217 [0,1,0,1,0,0|1,0,1]=4 4864 B8R1.25 CC1=C(Br)C(=O)C1=O Amb24689518 [0,1,0,1,0,0|1,0,1]=4 4865 B8R1.25 CC1=C(Cl)C(=O)C1=O Amb25371853 [0,1,0,1,0,0|1,0,1]=4 4866 B8R1.25 CC1=C(N)C(=O)C1=O Amb25303099 [0,1,0,1,0,0|1,0,1]=4 4867 B8R1.25 CC=1C(=O)C(Cl)C1C Amb25351861 [0,1,0,1,0,0|1,0,0]=3 4868 B8R1.25 CC=1C(O)C(O)C1C Amb24529096 [0,1,0,1,0,0|0,0,2]=4 4869 B8R1.25 CC=1[C@@H](O)[C@@H](O)C1C Amb25847883 [0,1,0,1,0,0|0,0,2]=4 4870 B8R1.25 NC1=C(O)C(=O)C1=O Amb24668985 [0,1,0,1,0,0|2,0,0]=4 4871 B8R1.25 OC1=C(O)C(=O)C1=O Amb17743969 [0,1,0,1,0,0|2,0,0]=4 4872 B8R1.38 COC(=O)C1CCN1 Amb20243415 [0,1,0,1,0,0|1,0,1]=4 4873 B8R1.38 COC(=O)C1CCN1 Amb22757529 [0,1,0,1,0,0|1,0,1]=4 4874 B8R1.38 COC(=O)C1CCO1 Amb22736125 [0,1,0,1,0,0|1,0,1]=4 4875 B8R1.38 COC(=O)C=1CCC1 Amb24689222 [0,1,0,1,0,0|0,0,0]=2 4876 B8R1.38 COC(=O)N1CCC1 Amb24354373 [0,1,0,1,0,0|1,0,1]=4 4877 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,1]=4 4878 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,1]=4 4879 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,1]=4 4880 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,1]=4 4881 B8R1.38 OCC(Br)=C1CCC1 Amb25769222 [0,1,0,1,0,0|1,0,1]=4 4882 B8R1.38 ONC(=O)C1CCO1 Amb25295628 [0,1,0,1,0,0|1,0,1]=4 4883 B8R1.39 CC1(CC1)C(=O)NO Amb24541600 [0,1,0,1,0,0|0,0,2]=4 4884 B8R1.39 COC(=O)C1(C)CC1 Amb10604239 [0,1,0,1,0,0|0,0,2]=4 4885 B8R1.39 COC(=O)C1(C)CO1 Amb17672313 [0,1,0,1,0,0|1,0,1]=4 4886 B8R1.39 COC(=O)C1(C)CS1 Amb25187795 [0,1,0,1,0,0|1,0,1]=4 4887 B8R1.50 BrC1=C(Br)C(=O)OC1 Amb10067289 [0,1,0,1,0,0|1,0,0]=3 4888 B8R1.50 BrC1=C(C)CCC1=O Amb10067495 [0,1,0,1,0,0|1,0,1]=4 4889 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,1,0,1,0,0|1,0,1]=4 4890 B8R1.50 Brc1noc(c1C)C Amb2455737 [0,1,0,1,0,0|1,0,0]=3 4891 B8R1.50 C=C1C(=O)CCC1=O Amb25128928 [0,1,0,1,0,0|1,0,1]=4 4892 B8R1.50 C=C1C(N)COC1=O Amb18641720 [0,1,0,1,0,0|0,0,2]=4 4893 B8R1.50 C=C1[C@@H](N)COC1=O Amb24744705 [0,1,0,1,0,0|0,0,2]=4 4894 B8R1.50 C=C1[C@@H](O)COC1=O Amb24435902 [0,1,0,1,0,0|0,0,2]=4 4895 B8R1.50 CC1=C(N)NNC1=O Amb18641725 [0,1,0,1,0,0|2,0,0]=4 4896 B8R1.50 CC1=CCC(=C)C1=O Amb25717748 [0,1,0,1,0,0|1,0,0]=3 4897 B8R1.50 CC1=CCC(=O)C1=O Amb25718940 [0,1,0,1,0,0|0,0,1]=3 4898 B8R1.50 CC1=CCC(O)C1O Amb25107667 [0,1,0,1,0,0|0,0,2]=4 4899 B8R1.50 CC1=CCN(C)C1=O Amb24589648 [0,1,0,1,0,0|1,0,0]=3 4900 B8R1.50 CC1=CNC(=O)C1C Amb25367339 [0,1,0,1,0,0|1,0,1]=4 4901 B8R1.50 CC1=COC(C)C1=O Amb25130613 [0,1,0,1,0,0|2,0,0]=4 4902 B8R1.50 CC1=NNC(=O)C1=O Amb25347429 [0,1,0,1,0,0|2,0,0]=4 4903 B8R1.50 CC1=NNC(=O)N1C Amb22732220 [0,1,0,1,0,0|2,0,0]=4 4904 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,1,0,1,0,0|0,0,1]=3 4905 B8R1.50 CC1=NOC(=O)N1C Amb25031408 [0,1,0,1,0,0|1,0,0]=3 4906 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,1,0,1,0,0|0,0,2]=4 4907 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,1,0,1,0,0|0,0,2]=4 4908 B8R1.50 CC1CC=C(C)C1=O Amb17778666 [0,1,0,1,0,0|1,0,0]=3 4909 B8R1.50 CC=1C(=O)CNC1C Amb24746674 [0,1,0,1,0,0|1,0,0]=3 4910 B8R1.50 CC=1C(=O)OCC1C Amb25859061 [0,1,0,1,0,0|0,0,0]=2 4911 B8R1.50 CC=1C(=O)ONC1C Amb22490660 [0,1,0,1,0,0|0,0,0]=2 4912 B8R1.50 CC=1C(O)CCC1Cl Amb25143573 [0,1,0,1,0,0|1,0,1]=4 4913 B8R1.50 CC=1CCC(=O)C1C Amb22351730 [0,1,0,1,0,0|1,0,0]=3 4914 B8R1.50 CC=1CC[C@@H](O)C1Br Amb25260075 [0,1,0,1,0,0|1,0,1]=4 4915 B8R1.50 CC=1COC(=O)C1N Amb25025754 [0,1,0,1,0,0|1,0,0]=3 4916 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,1,0,1,0,0|1,0,0]=3 4917 B8R1.50 CC=1CSC(=O)C1N Amb25324275 [0,1,0,1,0,0|1,1,0]=4 4918 B8R1.50 CC=1CSC(=O)C1O Amb24638526 [0,1,0,1,0,0|1,0,1]=4 4919 B8R1.50 CC=1NNC(=O)C1Br Amb20667742 [0,1,0,1,0,0|2,0,0]=4 4920 B8R1.50 CC=1NNC(=O)C1C Amb21932497 [0,1,0,1,0,0|1,0,0]=3 4921 B8R1.50 CC=1NNC(=O)C1S Amb24061971 [0,1,0,1,0,0|2,0,0]=4 4922 B8R1.50 CC=1NOC(=N)C1Br Amb19303493 [0,1,0,1,0,0|2,0,0]=4 4923 B8R1.50 CC=1SCC(=O)C1S Amb24472751 [0,1,0,1,0,0|1,1,0]=4 4924 B8R1.50 CN1C(=O)CCC1=S Amb24064848 [0,1,0,1,0,0|2,0,0]=4 4925 B8R1.50 CN1C(=O)CNC1=O Amb22002559 [0,1,0,1,0,0|2,0,0]=4 4926 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,1,0,1,0,0|1,0,0]=3 4927 B8R1.50 CN1C(=O)CSC1=O Amb1883006 [0,1,0,1,0,0|1,1,0]=4 4928 B8R1.50 CN1C(N)=NOC1=O Amb25709943 [0,1,0,1,0,0|2,0,0]=4 4929 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,1,0,1,0,0|1,0,1]=4 4930 B8R1.50 CN1CC[C@H](O)C1=O Amb24400512 [0,1,0,1,0,0|1,0,1]=4 4931 B8R1.50 C[C-]1C(=O)CCC1=O Amb24458437 [0,1,0,1,0,0|1,0,1]=4 4932 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,1,0,1,0,0|0,0,2]=4 4933 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,1,0,1,0,0|0,0,2]=4 4934 B8R1.50 Cc1[n][nH]c(O)c1N Amb24385758 [0,1,0,1,0,0|2,0,0]=4 4935 B8R1.50 Cc1[n]oc(F)c1Cl Amb25228303 [0,1,0,1,0,0|2,0,0]=4 4936 B8R1.50 Cc1[n]oc(N)c1N Amb18203370 [0,1,0,1,0,0|2,0,0]=4 4937 B8R1.50 Cc1[n]oc(O)c1Br Amb25688897 [0,1,0,1,0,0|1,0,1]=4 4938 B8R1.50 Cc1c(Br)[nH][n]c1C Amb24439501 [0,1,0,1,0,0|2,0,0]=4 4939 B8R1.50 Cc1c(Br)c[s]c1C Amb25076813 [0,1,0,1,0,0|1,1,0]=4 4940 B8R1.50 Cc1c(Br)o[n]c1C Amb25142044 [0,1,0,1,0,0|1,0,0]=3 4941 B8R1.50 Cc1c(C)noc1C Amb2447075 [0,1,0,1,0,0|1,0,0]=3 4942 B8R1.50 Cc1c(Cl)[n]oc1C Amb23537388 [0,1,0,1,0,0|1,0,0]=3 4943 B8R1.50 Cc1c(Cl)o[n]c1C Amb24392853 [0,1,0,1,0,0|1,0,0]=3 4944 B8R1.50 Cc1c(N)[n][nH]c1C Amb23399752 [0,1,0,1,0,0|2,0,0]=4 4945 B8R1.50 Cc1c(N)[n][s]c1C Amb18642672 [0,1,0,1,0,0|1,1,0]=4 4946 B8R1.50 Cc1c(N)[s][n]c1C Amb25168725 [0,1,0,1,0,0|1,1,0]=4 4947 B8R1.50 Cc1c(N)o[n]c1O Amb23504024 [0,1,0,1,0,0|1,0,1]=4 4948 B8R1.50 Cc1c(O)o[n]c1C Amb22490661 [0,1,0,1,0,0|0,0,1]=3 4949 B8R1.50 Cc1c[nH]c(C)c1C Amb17938704 [0,1,0,1,0,0|2,0,0]=4 4950 B8R1.50 Cc1noc(c1Br)N Amb10602829 [0,1,0,1,0,0|2,0,0]=4 4951 B8R1.50 Cc1o[n]c(C)c1O Amb25353521 [0,1,0,1,0,0|2,0,0]=4 4952 B8R1.50 Cc1o[n]c(O)c1Br Amb21896415 [0,1,0,1,0,0|1,0,1]=4 4953 B8R1.50 Clc1c(C)noc1C Amb15701448 [0,1,0,1,0,0|2,0,0]=4 4954 B8R1.50 Cn1c(C)csc1=O Amb10552498 [0,1,0,1,0,0|1,1,0]=4 4955 B8R1.50 Ic1c(C)noc1C Amb1210680 [0,1,0,1,0,0|2,0,0]=4 4956 B8R1.50 N=C1OCC(O)=C1Br Amb25698527 [0,1,0,1,0,0|2,0,0]=4 4957 B8R1.50 NC=1C(=O)OCC1Br Amb24553799 [0,1,0,1,0,0|1,0,0]=3 4958 B8R1.50 NC=1C(=O)OCC1Cl Amb25378846 [0,1,0,1,0,0|1,0,0]=3 4959 B8R1.50 Nc1c(C)noc1C Amb1945407 [0,1,0,1,0,0|2,0,0]=4 4960 B8R1.50 Nc1n[nH]c(c1C)C Amb15694771 [0,1,0,1,0,0|2,0,0]=4 4961 B8R1.50 Nc1noc(c1Cl)C Amb17621525 [0,1,0,1,0,0|2,0,0]=4 4962 B8R1.50 Nc1noc(c1I)C Amb10068335 [0,1,0,1,0,0|2,0,0]=4 4963 B8R1.50 O=C1C(=O)COC1=O Amb24364125 [0,1,0,1,0,0|1,0,0]=3 4964 B8R1.50 O=C1C(Br)COC1=O Amb25760646 [0,1,0,1,0,0|1,0,1]=4 4965 B8R1.50 O=C1C(Cl)=CCC1=O Amb25745802 [0,1,0,1,0,0|1,0,1]=4 4966 B8R1.50 O=C1NCC(Cl)=C1Cl Amb24707568 [0,1,0,1,0,0|2,0,0]=4 4967 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,1,0,1,0,0|1,0,0]=3 4968 B8R1.50 OC1=C(O)CCC1=O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 4969 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,1,0,1,0,0|1,0,1]=4 4970 B8R1.50 OC1CCC(=O)C1=O Amb24432188 [0,1,0,1,0,0|1,0,1]=4 4971 B8R1.50 OC=1C(=O)CCC1Br Amb24677469 [0,1,0,1,0,0|1,0,1]=4 4972 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,1,0,1,0,0|1,0,0]=3 4973 B8R1.50 OC=1C=CC(=O)C1O Amb25254879 [0,1,0,1,0,0|1,0,1]=4 4974 B8R1.50 OC=1CCC(=O)C1Br Amb25205766 [0,1,0,1,0,0|2,0,0]=4 4975 B8R1.50 OC=1CCC(=O)C1Cl Amb24378334 [0,1,0,1,0,0|2,0,0]=4 4976 B8R1.50 OC=1COC(=O)C1Cl Amb22360617 [0,1,0,1,0,0|1,0,0]=3 4977 B8R1.50 ON1C=CC(=O)C1=O Amb25093662 [0,1,0,1,0,0|1,0,1]=4 4978 B8R1.50 Oc1n[nH]c(c1C)C Amb17622007 [0,1,0,1,0,0|1,0,0]=3 4979 B8R1.50 Oc1n[nH]c(c1F)C Amb10067863 [0,1,0,1,0,0|2,0,0]=4 4980 B8R1.50 Oc1noc(c1C)C Amb10552497 [0,1,0,1,0,0|0,0,1]=3 4981 B8R1.50 Oc1nsc(c1Br)C Amb2420513 [0,1,0,1,0,0|1,1,0]=4 4982 B8R1.63 CCC1(CC1)C(O)=O Amb18560530 [0,1,0,1,0,0|0,0,2]=4 4983 B8R1.63 CNC1(CC1)C(O)=O Amb22757078 [0,1,0,1,0,0|0,0,2]=4 4984 B8R1.63 COC1(CC1)C(O)=O Amb24358755 [0,1,0,1,0,0|0,0,2]=4 4985 B8R1.63 CSC1(CC1)C(O)=O Amb24481335 [0,1,0,1,0,0|0,0,2]=4 4986 B8R1.63 NCC1(CC1)C(=O)O Amb10607863 [0,1,0,1,0,0|0,0,2]=4 4987 B8R1.63 NCC1(CC1)C(O)=O Amb21959700 [0,1,0,1,0,0|0,0,2]=4 4988 B8R1.63 OC(=O)C1(CCl)CO1 Amb25702443 [0,1,0,1,0,0|1,0,1]=4 4989 B8R1.63 OC(=O)C1(CF)CC1 Amb24054902 [0,1,0,1,0,0|0,0,2]=4 4990 B8R1.63 OC(=O)[C@@]1(CCl)CO1 Amb25113608 [0,1,0,1,0,0|1,0,1]=4 4991 B8R1.63 OCC1(CC1)C(=O)O Amb15701269 [0,1,0,1,0,0|0,0,2]=4 4992 B8R1.16 CCC=1C(=O)CC1O Amb25718425 [0,1,0,1,0,0|2,0,0]=4 4993 B8R1.33 CC\C(=C\C)\C1CO1 Amb24482185 [0,1,0,1,0,0|1,0,1]=4 4994 B8R1.77 CC1(C)C=C1C(O)=O Amb24746031 [0,1,0,1,0,0|0,0,2]=4 4995 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,1,0,1,0,0|0,0,2]=4 4996 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|0,0,2]=4 4997 B8R2.5 O=C1OC2C=CC12 Amb24751511 [0,0,0,2,0,0|0,0,2]=4 4998 B8R2.66 OC(=O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|0,0,2]=4 4999 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [0,0,0,0,0,2|0,0,2]=4 5000 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [0,0,0,0,0,2|1,0,1]=4 5001 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,0,0,0,0,2|1,0,1]=4 5002 B8R0.9 CC(=CCl)N=NC(N)=O Amb24670505 [0,0,0,0,0,2|2,0,0]=4 5003 B8R0.9 CC(=CCl)OCC(C)=O Amb25233389 [0,0,0,0,0,2|2,0,0]=4 5004 B8R0.9 CC(=CCl)\C=C\C(O)=O Amb24397298 [0,0,0,0,0,2|1,0,0]=3 5005 B8R0.9 CC(=CCl)\N=N\C(N)=O Amb24550462 [0,0,0,0,0,2|2,0,0]=4 5006 B8R0.9 CC(=NOC(N)=O)SC Amb25743978 [0,0,0,0,0,2|2,0,0]=4 5007 B8R0.9 CC(=O)C\C=C(/C)\C=C Amb25198446 [0,0,0,0,0,2|1,0,1]=4 5008 B8R0.9 CC(=O)C\C=C(\C)/C=C Amb24686521 [0,0,0,0,0,2|1,0,1]=4 5009 B8R0.9 CC(=O)N\C=C(\C)/C=O Amb18642508 [0,0,0,0,0,2|2,0,0]=4 5010 B8R0.9 CC(=O)O\C=C(/C)\C=O Amb24426274 [0,0,0,0,0,2|2,0,0]=4 5011 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,0,0,0,0,2|0,0,2]=4 5012 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,0,0,0,0,2|0,0,2]=4 5013 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,0,0,0,0,2|0,0,2]=4 5014 B8R0.9 CC(CC)=C=CC(N)=O Amb25146087 [0,0,0,0,0,2|1,0,1]=4 5015 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,0,0,0,0,2|0,0,1]=3 5016 B8R0.9 CC(CC)=NNC(C)=O Amb24732912 [0,0,0,0,0,2|1,0,1]=4 5017 B8R0.9 CC(CC)=NNC(N)=O Amb25855979 [0,0,0,0,0,2|1,0,1]=4 5018 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [0,0,0,0,0,2|2,0,0]=4 5019 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,0,0,0,0,2|2,0,0]=4 5020 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,0,0,0,0,2|2,0,0]=4 5021 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,0,0,0,0,2|0,0,2]=4 5022 B8R0.9 CC(CSC(C)=O)=CCl Amb24634070 [0,0,0,0,0,2|2,0,0]=4 5023 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,0,0,0,2|1,0,1]=4 5024 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,0,0,0,0,2|1,0,1]=4 5025 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,0,0,0,0,2|1,0,1]=4 5026 B8R0.9 CCC(=O)\C=C\C(O)=O Amb18642585 [0,0,0,0,0,2|1,0,1]=4 5027 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,0,0,0,0,2|1,0,1]=4 5028 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,0,0,0,0,2|1,0,1]=4 5029 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,0,0,0,0,2|0,0,2]=4 5030 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,0,0,0,0,2|0,0,2]=4 5031 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,0,0,0,0,2|0,0,2]=4 5032 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,0,0,0,0,2|1,0,1]=4 5033 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,0,0,0,0,2|0,0,2]=4 5034 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,0,0,0,0,2|0,0,2]=4 5035 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,0,0,0,0,2|0,0,2]=4 5036 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,0,0,0,0,2|1,0,1]=4 5037 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,0,0,0,0,2|1,0,1]=4 5038 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,0,0,0,0,2|1,0,1]=4 5039 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,0,0,0,0,2|2,0,0]=4 5040 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,0,0,0,0,2|2,0,0]=4 5041 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,0,0,0,0,2|2,0,0]=4 5042 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,0,0,0,0,2|2,0,0]=4 5043 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,0,0,0,0,2|2,0,0]=4 5044 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,0,0,0,0,2|2,0,0]=4 5045 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,0,0,0,0,2|2,0,0]=4 5046 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,0,0,0,0,2|1,0,1]=4 5047 B8R0.9 COC(=O)C#CC(O)=O Amb22492669 [0,0,0,0,0,2|2,0,0]=4 5048 B8R0.9 COC(=O)\C=C\C(=O)O Amb10071357 [0,0,0,0,0,2|2,0,0]=4 5049 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,0,0,0,0,2|2,0,0]=4 5050 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,0,0,0,0,2|1,0,1]=4 5051 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,0,0,0,0,2|1,0,1]=4 5052 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,0,0,0,0,2|1,0,1]=4 5053 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,0,0,0,0,2|2,0,0]=4 5054 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,0,0,0,0,2|2,0,0]=4 5055 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,0,0,0,0,2|1,0,1]=4 5056 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,0,0,0,0,2|0,0,2]=4 5057 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,0,0,0,0,2|0,0,2]=4 5058 B8R0.9 C\C(=C\Cl)\OCC(C)=O Amb25061238 [0,0,0,0,0,2|2,0,0]=4 5059 B8R0.9 C\C(=C\Cl)\SSC(C)=O Amb25139393 [0,0,0,0,0,2|2,0,0]=4 5060 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,0,0,0,0,2|0,0,1]=3 5061 B8R0.9 C\C(\C=C)=N\NC(N)=O Amb25055146 [0,0,0,0,0,2|1,0,1]=4 5062 B8R0.9 C\C(\C=CC(O)=O)=N\O Amb24640839 [0,0,0,0,0,2|2,0,0]=4 5063 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [0,0,0,0,0,2|0,0,0]=2 5064 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,0,0,0,0,2|0,0,1]=3 5065 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,0,0,0,0,2|1,0,0]=3 5066 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,0,0,0,0,2|1,0,0]=3 5067 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,0,0,0,0,2|0,0,0]=2 5068 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,0,0,0,0,2|2,0,0]=4 5069 B8R0.9 C\C(\COC(=O)Cl)=C\Cl Amb24480147 [0,0,0,0,0,2|2,0,0]=4 5070 B8R0.9 C\C(\COC(C)=O)=C/Br Amb25200999 [0,0,0,0,0,2|2,0,0]=4 5071 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,0,0,0,0,2|1,0,0]=3 5072 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,0,0,0,0,2|1,0,0]=3 5073 B8R0.9 C\C=C(\C)/CCC(C)O Amb24646058 [0,0,0,0,0,2|1,0,1]=4 5074 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,0,0,0,0,2|1,0,0]=3 5075 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [0,0,0,0,0,2|2,0,0]=4 5076 B8R0.9 OC(=O)CNC(=O)C=O Amb25328169 [0,0,0,0,0,2|2,0,0]=4