0 B6R0.3 C#CC(=O)C(O)=O Amb25252554 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.3 C#CC(O)C(O)=O Amb22731622 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.3 C#C[C@H](N)C(N)=O Amb25200269 [0,0,0,0,0,0|2,0,1]=3 3 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [0,0,0,0,0,0|1,0,1]=2 4 B6R0.3 C=C(C#N)C(O)=O Amb18638894 [0,0,0,0,0,0|2,0,2]=4 5 B6R0.3 C=C(C=C)C(O)=O Amb24394371 [0,0,0,0,0,0|2,0,2]=4 6 B6R0.3 C=C(CBr)C(N)=O Amb24709965 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.3 C=C(CF)C(O)=O Amb25215375 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.3 C=C(CI)C(O)=O Amb24419641 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.3 C=C(CN)C(O)=O Amb25200864 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.3 C=C(CO)C(=O)Cl Amb25169545 [0,0,0,0,0,0|2,0,1]=3 11 B6R0.3 C=C(CO)C(O)=O Amb18121817 [0,0,0,0,0,0|1,0,1]=2 12 B6R0.3 C=CC(=O)C(O)=O Amb22011796 [0,0,0,0,0,0|2,0,2]=4 13 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [0,0,0,0,0,0|2,0,1]=3 14 B6R0.3 C=CC(Cl)C(N)=O Amb24479818 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.3 C=CC(N)C(N)=O Amb24689093 [0,0,0,0,0,0|2,0,1]=3 16 B6R0.3 C=CC(N)C(O)=O Amb20240543 [0,0,0,0,0,0|1,0,1]=2 17 B6R0.3 C=CC(O)C(O)=O Amb24061247 [0,0,0,0,0,0|2,0,1]=3 18 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [0,0,0,0,0,0|1,0,1]=2 19 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [0,0,0,0,0,0|1,0,1]=2 20 B6R0.3 C=C[C@@H](O)C(N)=O Amb25791152 [0,0,0,0,0,0|3,0,1]=4 21 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [0,0,0,0,0,0|2,0,1]=3 22 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [0,0,0,0,0,0|2,0,1]=3 23 B6R0.3 CC(=C)C(=O)CO Amb25041907 [0,0,0,0,0,0|3,0,1]=4 24 B6R0.3 CC(=C)C(Br)CO Amb25707965 [0,0,0,0,0,0|3,0,0]=3 25 B6R0.3 CC(=C)C(Cl)CCl Amb24460854 [0,0,0,0,0,0|4,0,0]=4 26 B6R0.3 CC(=C)C(N)=NO Amb24386102 [0,0,0,0,0,0|3,0,1]=4 27 B6R0.3 CC(=C)C(N)CS Amb18641941 [0,0,0,0,0,0|2,1,0]=3 28 B6R0.3 CC(=C)C(O)CBr Amb24739517 [0,0,0,0,0,0|4,0,0]=4 29 B6R0.3 CC(=C)C(O)CCl Amb24332083 [0,0,0,0,0,0|4,0,0]=4 30 B6R0.3 CC(=C)C(O)CO Amb23570510 [0,0,0,0,0,0|3,0,0]=3 31 B6R0.3 CC(=C)[C@@H](N)CO Amb25693320 [0,0,0,0,0,0|2,0,0]=2 32 B6R0.3 CC(=C)[C@@H](O)CO Amb25747414 [0,0,0,0,0,0|3,0,0]=3 33 B6R0.3 CC(=C)[C@H](O)CO Amb24439174 [0,0,0,0,0,0|3,0,0]=3 34 B6R0.3 CC(=C=C)C(=O)O Amb17593066 [0,0,0,0,0,0|2,0,2]=4 35 B6R0.3 CC(=CCl)C(O)=O Amb25692582 [0,0,0,0,0,0|2,0,2]=4 36 B6R0.3 CC(=CN)C(O)=O Amb25375168 [0,0,0,0,0,0|2,0,2]=4 37 B6R0.3 CC(=CO)C(C)=O Amb25377802 [0,0,0,0,0,0|2,0,2]=4 38 B6R0.3 CC(=CO)C(O)=O Amb25745269 [0,0,0,0,0,0|1,0,2]=3 39 B6R0.3 CC(=NBr)C(O)=O Amb24518467 [0,0,0,0,0,0|3,0,1]=4 40 B6R0.3 CC(=O)C(=C)CBr Amb24478554 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.3 CC(=O)C(=C)CCl Amb25141482 [0,0,0,0,0,0|3,0,1]=4 42 B6R0.3 CC(=O)C(=C)CO Amb24571845 [0,0,0,0,0,0|2,0,1]=3 43 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,0,0,0,0,0|3,0,1]=4 45 B6R0.3 CC(=O)C(Br)=CO Amb25233141 [0,0,0,0,0,0|2,0,2]=4 46 B6R0.3 CC(=O)C(Br)=NO Amb25811082 [0,0,0,0,0,0|3,0,1]=4 47 B6R0.3 CC(=O)C(Br)C#N Amb23453422 [0,0,0,0,0,0|3,0,1]=4 48 B6R0.3 CC(=O)C(Br)CO Amb24649743 [0,0,0,0,0,0|2,0,0]=2 49 B6R0.3 CC(=O)C(Br)N=O Amb24332992 [0,0,0,0,0,0|3,0,1]=4 50 B6R0.3 CC(=O)C(Cl)=NO Amb25790855 [0,0,0,0,0,0|3,0,1]=4 51 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [0,0,0,0,0,0|3,0,0]=3 52 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [0,0,0,0,0,0|2,0,0]=2 53 B6R0.3 CC(=O)C(F)CO Amb24725289 [0,0,0,0,0,0|2,0,0]=2 54 B6R0.3 CC(=O)C(N)=CO Amb25264865 [0,0,0,0,0,0|1,0,2]=3 55 B6R0.3 CC(=O)C(N)C#N Amb25304788 [0,0,0,0,0,0|2,0,1]=3 56 B6R0.3 CC(=O)C(N)CN Amb24479898 [0,0,0,0,0,0|2,0,0]=2 57 B6R0.3 CC(=O)C(N)CO Amb18640011 [0,0,0,0,0,0|1,0,0]=1 58 B6R0.3 CC(=O)C(N)CS Amb24479874 [0,0,0,0,0,0|1,1,0]=2 59 B6R0.3 CC(=O)C(O)=CO Amb25302267 [0,0,0,0,0,0|2,0,2]=4 60 B6R0.3 CC(=O)C(O)C#N Amb25094307 [0,0,0,0,0,0|3,0,1]=4 61 B6R0.3 CC(=O)C(O)C=O Amb24715304 [0,0,0,0,0,0|2,0,2]=4 62 B6R0.3 CC(=O)C(O)CN Amb24636554 [0,0,0,0,0,0|3,0,0]=3 63 B6R0.3 CC(=O)C([Na])C#N Amb25662498 [0,0,0,0,0,0|3,0,1]=4 64 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [0,0,0,0,0,0|2,0,2]=4 65 B6R0.3 CC(=O)N(C#N)N Amb10604135 [0,0,0,0,0,0|3,0,1]=4 66 B6R0.3 CC(=O)N(C)CCl Amb24428489 [0,0,0,0,0,0|4,0,0]=4 67 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [0,0,0,0,0,0|1,0,0]=1 68 B6R0.3 CC(=O)[C@@H](O)C=C Amb25662172 [0,0,0,0,0,0|3,0,1]=4 69 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [0,0,0,0,0,0|3,0,0]=3 70 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,0,0,0,0,0|2,0,0]=2 71 B6R0.3 CC(=O)[C@H](O)C=C Amb24480657 [0,0,0,0,0,0|3,0,1]=4 72 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [0,0,0,0,0,0|3,0,0]=3 73 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [0,0,0,0,0,0|2,0,0]=2 74 B6R0.3 CC(=O)\C(=C\O)\Br Amb17232510 [0,0,0,0,0,0|2,0,2]=4 75 B6R0.3 CC(=O)\C(\Br)=N\O Amb25233762 [0,0,0,0,0,0|3,0,1]=4 76 B6R0.3 CC(=O)\C(\Cl)=N/O Amb24436488 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.3 CC(=O)\C(\O)=C\O Amb24621662 [0,0,0,0,0,0|2,0,2]=4 78 B6R0.3 CC(Br)C(N)CC Amb24544717 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.3 CC(Br)C(S)CO Amb24479553 [0,0,0,0,0,0|3,0,1]=4 80 B6R0.3 CC(C#C)C(O)=O Amb25085390 [0,0,0,0,0,0|2,0,1]=3 81 B6R0.3 CC(C#N)C(N)=O Amb25336872 [0,0,0,0,0,0|3,0,1]=4 82 B6R0.3 CC(C#N)C([O-])=O Amb22057371 [0,0,0,0,0,0|2,0,2]=4 83 B6R0.3 CC(C#N)S(O)=O Amb25745526 [0,0,0,0,0,0|3,0,1]=4 84 B6R0.3 CC(C(=C)C)CN Amb17593078 [0,0,0,0,0,0|4,0,0]=4 85 B6R0.3 CC(C(=O)C)CO Amb10844844 [0,0,0,0,0,0|2,0,0]=2 86 B6R0.3 CC(C(=O)O)C#N Amb17210512 [0,0,0,0,0,0|2,0,1]=3 87 B6R0.3 CC(C(O)C)CN Amb10068614 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.3 CC(C)=C(Br)CO Amb24370439 [0,0,0,0,0,0|3,0,1]=4 89 B6R0.3 CC(C)=C(C)CO Amb25107300 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.3 CC(C)=C(F)CO Amb22546803 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.3 CC(C)C(N)CF Amb24620348 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.3 CC(C)C(N)CN Amb19283589 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.3 CC(C)C(S)CO Amb25809908 [0,0,0,0,0,0|3,0,1]=4 94 B6R0.3 CC(C)[C@@H](Br)CO Amb25109146 [0,0,0,0,0,0|3,0,1]=4 95 B6R0.3 CC(C)[C@@H](N)CBr Amb24739073 [0,0,0,0,0,0|3,0,1]=4 96 B6R0.3 CC(C)[C@@H](N)CO Amb22745159 [0,0,0,0,0,0|2,0,1]=3 97 B6R0.3 CC(C)[C@@H](O)CO Amb25662102 [0,0,0,0,0,0|3,0,1]=4 98 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [0,0,0,0,0,0|3,0,1]=4 99 B6R0.3 CC(C)[C@H](N)CC Amb24480517 [0,0,0,0,0,0|3,0,1]=4 100 B6R0.3 CC(C)[C@H](N)CCl Amb24502642 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.3 CC(C)[C@H](O)CO Amb25320597 [0,0,0,0,0,0|3,0,1]=4 102 B6R0.3 CC(C=C)C(O)=O Amb21618706 [0,0,0,0,0,0|2,0,1]=3 103 B6R0.3 CC(C=O)C(C)=O Amb18639572 [0,0,0,0,0,0|2,0,2]=4 104 B6R0.3 CC(C=O)C(N)=O Amb24479831 [0,0,0,0,0,0|2,0,2]=4 105 B6R0.3 CC(CBr)C(C)=O Amb25296678 [0,0,0,0,0,0|3,0,0]=3 106 B6R0.3 CC(CBr)C(O)=O Amb22002601 [0,0,0,0,0,0|2,0,0]=2 107 B6R0.3 CC(CBr)C(O)Cl Amb24724792 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.3 CC(CC)C(O)Br Amb24635628 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [0,0,0,0,0,0|3,0,0]=3 110 B6R0.3 CC(CCl)C(=O)S Amb24410197 [0,0,0,0,0,0|2,1,0]=3 111 B6R0.3 CC(CCl)C(C)=C Amb25147594 [0,0,0,0,0,0|4,0,0]=4 112 B6R0.3 CC(CCl)C(C)O Amb25662521 [0,0,0,0,0,0|3,0,1]=4 113 B6R0.3 CC(CCl)C(N)=O Amb25061744 [0,0,0,0,0,0|3,0,0]=3 114 B6R0.3 CC(CCl)C(O)=O Amb18522181 [0,0,0,0,0,0|2,0,0]=2 115 B6R0.3 CC(CF)C(C)=O Amb25253758 [0,0,0,0,0,0|3,0,0]=3 116 B6R0.3 CC(CF)C(O)=O Amb24432331 [0,0,0,0,0,0|2,0,0]=2 117 B6R0.3 CC(CI)C(C)=C Amb25701888 [0,0,0,0,0,0|4,0,0]=4 118 B6R0.3 CC(CI)C(O)=O Amb25695307 [0,0,0,0,0,0|2,0,0]=2 119 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [0,0,0,0,0,0|3,0,0]=3 120 B6R0.3 CC(CN)C(C)=O Amb18639690 [0,0,0,0,0,0|3,0,0]=3 121 B6R0.3 CC(CN)C(N)=S Amb24479604 [0,0,0,0,0,0|3,1,0]=4 122 B6R0.3 CC(CN)S(C)=O Amb22157251 [0,0,0,0,0,0|4,0,0]=4 123 B6R0.3 CC(CN)[N+]([O-])=O Amb24738614 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.3 CC(CO)C(C)=C Amb24539367 [0,0,0,0,0,0|3,0,0]=3 125 B6R0.3 CC(CO)C(C)Cl Amb24479460 [0,0,0,0,0,0|3,0,1]=4 126 B6R0.3 CC(CO)C(C)I Amb24410940 [0,0,0,0,0,0|3,0,1]=4 127 B6R0.3 CC(CO)C(C)N Amb18122199 [0,0,0,0,0,0|3,0,1]=4 128 B6R0.3 CC(CO)C(C)S Amb22641872 [0,0,0,0,0,0|2,1,1]=4 129 B6R0.3 CC(CO)C([O-])=O Amb24123145 [0,0,0,0,0,0|1,0,1]=2 130 B6R0.3 CC(CO)S(C)=O Amb25173825 [0,0,0,0,0,0|3,0,0]=3 131 B6R0.3 CC(CS)C(C)=O Amb25830693 [0,0,0,0,0,0|2,1,0]=3 132 B6R0.3 CC(CS)C(C)O Amb24334206 [0,0,0,0,0,0|2,1,1]=4 133 B6R0.3 CC(CS)C(N)=O Amb25759660 [0,0,0,0,0,0|2,1,0]=3 134 B6R0.3 CC(Cl)=C(Cl)CO Amb25220899 [0,0,0,0,0,0|3,0,1]=4 135 B6R0.3 CC(Cl)C(S)CO Amb25102279 [0,0,0,0,0,0|3,0,1]=4 136 B6R0.3 CC(F)=C(F)CO Amb25099370 [0,0,0,0,0,0|3,0,1]=4 137 B6R0.3 CC(F)C(Br)CO Amb25109242 [0,0,0,0,0,0|3,0,1]=4 138 B6R0.3 CC(F)C(I)CO Amb25293778 [0,0,0,0,0,0|3,0,1]=4 139 B6R0.3 CC(F)C(N)CC Amb25024885 [0,0,0,0,0,0|3,0,1]=4 140 B6R0.3 CC(I)C(F)CO Amb25325094 [0,0,0,0,0,0|3,0,1]=4 141 B6R0.3 CC(N)C(N)CC Amb25186066 [0,0,0,0,0,0|3,0,1]=4 142 B6R0.3 CC(N)C(O)CO Amb24583121 [0,0,0,0,0,0|3,0,1]=4 143 B6R0.3 CC(N=C)C(O)=O Amb24591339 [0,0,0,0,0,0|3,0,0]=3 144 B6R0.3 CC(NBr)C(O)=O Amb24677636 [0,0,0,0,0,0|3,0,0]=3 145 B6R0.3 CC(NCl)C(O)=O Amb25267473 [0,0,0,0,0,0|3,0,0]=3 146 B6R0.3 CC(NN)C(O)=O Amb18640367 [0,0,0,0,0,0|3,0,0]=3 147 B6R0.3 CC(O)C(=O)CO Amb25333809 [0,0,0,0,0,0|2,0,2]=4 148 B6R0.3 CC(O)C(Cl)CO Amb24633291 [0,0,0,0,0,0|2,0,1]=3 149 B6R0.3 CC(O)C(N)C=C Amb25076566 [0,0,0,0,0,0|2,0,2]=4 150 B6R0.3 CC(O)C(N)C=O Amb24480424 [0,0,0,0,0,0|1,0,3]=4 151 B6R0.3 CC(O)C(N)CN Amb19328774 [0,0,0,0,0,0|2,0,1]=3 152 B6R0.3 CC(O)C(N)CN Amb22059292 [0,0,0,0,0,0|2,0,1]=3 153 B6R0.3 CC(O)C(O)CBr Amb24478957 [0,0,0,0,0,0|3,0,1]=4 154 B6R0.3 CC(O)C(O)CCl Amb24622417 [0,0,0,0,0,0|3,0,1]=4 155 B6R0.3 CC(O)C(O)CO Amb22227692 [0,0,0,0,0,0|2,0,1]=3 156 B6R0.3 CC(O)C(S)CBr Amb24440821 [0,0,0,0,0,0|3,0,1]=4 157 B6R0.3 CC(O)C(S)CS Amb25043650 [0,0,0,0,0,0|2,1,1]=4 158 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [0,0,0,0,0,0|2,0,1]=3 159 B6R0.3 CC(O)[C@@H](N)CO Amb22800884 [0,0,0,0,0,0|1,0,1]=2 160 B6R0.3 CC(ON)C(O)=O Amb24479235 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [0,0,0,0,0,0|3,0,1]=4 162 B6R0.3 CCC(=C)C(N)=O Amb24480748 [0,0,0,0,0,0|3,0,1]=4 163 B6R0.3 CCC(=C)C(O)=O Amb18639591 [0,0,0,0,0,0|2,0,1]=3 164 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,0,0|3,0,1]=4 165 B6R0.3 CCC(=O)C(O)=O Amb22274199 [0,0,0,0,0,0|2,0,1]=3 166 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [0,0,0,0,0,0|2,0,2]=4 167 B6R0.3 CCC(B(O)O)C Amb10071974 [0,0,0,0,0,0|3,0,1]=4 168 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,0,0,0,0|3,0,0]=3 169 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,0,0,0,0|3,0,0]=3 170 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [0,0,0,0,0,0|3,0,0]=3 171 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [0,0,0,0,0,0|3,0,1]=4 172 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [0,0,0,0,0,0|2,0,0]=2 173 B6R0.3 CCC(C(=O)N)Br Amb13952819 [0,0,0,0,0,0|3,0,0]=3 174 B6R0.3 CCC(C(=O)N)N Amb1914080 [0,0,0,0,0,0|2,0,0]=2 175 B6R0.3 CCC(C(=O)O)S Amb17501370 [0,0,0,0,0,0|2,0,0]=2 176 B6R0.3 CCC(C(C)C)N Amb10610298 [0,0,0,0,0,0|3,0,1]=4 177 B6R0.3 CCC(C(O)C)O Amb2227553 [0,0,0,0,0,0|3,0,1]=4 178 B6R0.3 CCC(C)C(=C)Br Amb22583745 [0,0,0,0,0,0|4,0,0]=4 179 B6R0.3 CCC(C)S([O-])=O Amb19893328 [0,0,0,0,0,0|3,0,1]=4 180 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [0,0,0,0,0,0|4,0,0]=4 181 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,0,0,0,0|3,0,0]=3 182 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,0,0,0,0|3,0,0]=3 183 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,0,0,0,0|3,0,0]=3 184 B6R0.3 CCC(F)C(C)=O Amb24736393 [0,0,0,0,0,0|3,0,0]=3 185 B6R0.3 CCC(F)C(N)=O Amb25811426 [0,0,0,0,0,0|3,0,0]=3 186 B6R0.3 CCC(F)C(O)=O Amb25716167 [0,0,0,0,0,0|2,0,0]=2 187 B6R0.3 CCC(I)C(N)=O Amb25131171 [0,0,0,0,0,0|3,0,0]=3 188 B6R0.3 CCC(N)C(=O)S Amb24479075 [0,0,0,0,0,0|1,1,0]=2 189 B6R0.3 CCC(N)C(C)=O Amb18202785 [0,0,0,0,0,0|2,0,0]=2 190 B6R0.3 CCC(N)C(N)=S Amb24573684 [0,0,0,0,0,0|2,1,0]=3 191 B6R0.3 CCC(N)N(C)C Amb24480382 [0,0,0,0,0,0|4,0,0]=4 192 B6R0.3 CCC(N)P(O)=O Amb25269903 [0,0,0,0,0,0|2,0,0]=2 193 B6R0.3 CCC(O)C(=C)Br Amb25236591 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,0,0,0,0|3,0,0]=3 195 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,0,0,0,0|3,0,0]=3 196 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,0,0,0,0,0|3,1,0]=4 197 B6R0.3 CCC(O)C(O)=O Amb22352315 [0,0,0,0,0,0|2,0,0]=2 198 B6R0.3 CCC(O)C(O)=O Amb22360643 [0,0,0,0,0,0|2,0,0]=2 199 B6R0.3 CCC(O)C([O-])=O Amb17943026 [0,0,0,0,0,0|2,0,1]=3 200 B6R0.3 CCC(O)C([O-])=O Amb24325325 [0,0,0,0,0,0|2,0,1]=3 201 B6R0.3 CCC(O)P(O)=O Amb25169578 [0,0,0,0,0,0|3,0,0]=3 202 B6R0.3 CCC(S)C(N)=O Amb24479879 [0,0,0,0,0,0|3,0,0]=3 203 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,0,0,0,0,0|4,0,0]=4 204 B6R0.3 CCN(N)C(N)=S Amb25187761 [0,0,0,0,0,0|3,1,0]=4 205 B6R0.3 CCN(O)C(N)=O Amb24669876 [0,0,0,0,0,0|4,0,0]=4 206 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [0,0,0,0,0,0|3,0,0]=3 207 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [0,0,0,0,0,0|3,0,0]=3 208 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [0,0,0,0,0,0|3,0,0]=3 209 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [0,0,0,0,0,0|3,0,0]=3 210 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,0,0,0,0|3,0,0]=3 211 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [0,0,0,0,0,0|2,0,0]=2 212 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [0,0,0,0,0,0|2,0,0]=2 213 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,0,0,0,0|2,0,0]=2 214 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,0,0,0,0|2,0,0]=2 215 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [0,0,0,0,0,0|3,0,0]=3 216 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [0,0,0,0,0,0|2,0,0]=2 217 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [0,0,0,0,0,0|3,0,0]=3 218 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [0,0,0,0,0,0|2,0,0]=2 219 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [0,0,0,0,0,0|1,0,0]=1 220 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [0,0,0,0,0,0|3,0,0]=3 222 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [0,0,0,0,0,0|3,1,0]=4 223 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [0,0,0,0,0,0|3,0,0]=3 224 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [0,0,0,0,0,0|2,0,0]=2 225 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [0,0,0,0,0,0|2,0,0]=2 226 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [0,0,0,0,0,0|3,0,0]=3 227 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [0,0,0,0,0,0|3,0,0]=3 228 B6R0.3 CC[N+](N)=C(C)N Amb25107724 [0,0,0,0,0,0|4,0,0]=4 229 B6R0.3 CN(CCl)C(=O)Cl Amb25076174 [0,0,0,0,0,0|4,0,0]=4 230 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [0,0,0,0,0,0|3,0,1]=4 231 B6R0.3 CNC(=C)C(O)=O Amb25743212 [0,0,0,0,0,0|3,0,1]=4 232 B6R0.3 CNC(=N)C(O)=O Amb18639921 [0,0,0,0,0,0|2,0,2]=4 233 B6R0.3 CNC(=S)C(O)=O Amb24479905 [0,0,0,0,0,0|3,0,1]=4 234 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,0,0,0,0,0|4,0,0]=4 235 B6R0.3 CNC(C)C(O)=O Amb19373699 [0,0,0,0,0,0|3,0,0]=3 236 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,0,0,0,0|4,0,0]=4 237 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,0,0,0,0|4,0,0]=4 238 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,0,0,0,0|4,0,0]=4 239 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,0,0,0,0|4,0,0]=4 240 B6R0.3 COC(=C)C(O)=O Amb18639906 [0,0,0,0,0,0|3,0,1]=4 241 B6R0.3 COC(=O)C(O)=O Amb22011503 [0,0,0,0,0,0|3,0,1]=4 242 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,0,0,0,0,0|4,0,0]=4 243 B6R0.3 COC(N)C(N)=O Amb25178891 [0,0,0,0,0,0|3,0,0]=3 244 B6R0.3 COC(N)C(O)=O Amb24621851 [0,0,0,0,0,0|2,0,0]=2 245 B6R0.3 COC(O)C(O)=O Amb24479754 [0,0,0,0,0,0|3,0,0]=3 246 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [0,0,0,0,0,0|4,0,0]=4 247 B6R0.3 CSC(=O)C(O)=O Amb24731100 [0,0,0,0,0,0|3,0,1]=4 248 B6R0.3 CSC(=S)C(O)=O Amb25702678 [0,0,0,0,0,0|3,0,1]=4 249 B6R0.3 CSC(Br)C(O)=O Amb25169549 [0,0,0,0,0,0|3,0,0]=3 250 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [0,0,0,0,0,0|4,0,0]=4 251 B6R0.3 CSC(F)C(O)=O Amb25043740 [0,0,0,0,0,0|3,0,0]=3 252 B6R0.3 CSC(O)C(C)=O Amb24479166 [0,0,0,0,0,0|4,0,0]=4 253 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [0,0,0,0,0,0|3,0,0]=3 254 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [0,0,0,0,0,0|2,0,0]=2 255 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [0,0,0,0,0,0|3,0,0]=3 256 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [0,0,0,0,0,0|3,0,0]=3 257 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [0,0,0,0,0,0|2,0,2]=4 258 B6R0.3 C[C@@H](CBr)C(C)=C Amb25772655 [0,0,0,0,0,0|4,0,0]=4 259 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [0,0,0,0,0,0|2,0,0]=2 260 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.3 C[C@@H](CCl)[C@@H](C)O Amb25137880 [0,0,0,0,0,0|3,0,1]=4 262 B6R0.3 C[C@@H](CCl)[N+]([O-])=O Amb24407369 [0,0,0,0,0,0|3,0,1]=4 263 B6R0.3 C[C@@H](CI)C(C)=C Amb25025023 [0,0,0,0,0,0|4,0,0]=4 264 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [0,0,0,0,0,0|2,0,0]=2 265 B6R0.3 C[C@@H](CO)C(C)=C Amb25025795 [0,0,0,0,0,0|3,0,0]=3 266 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [0,0,0,0,0,0|2,0,0]=2 267 B6R0.3 C[C@@H](CO)C(Cl)Cl Amb24332145 [0,0,0,0,0,0|3,0,1]=4 268 B6R0.3 C[C@@H](CO)C(F)F Amb25747098 [0,0,0,0,0,0|3,0,1]=4 269 B6R0.3 C[C@@H](CO)N(C)C Amb25373937 [0,0,0,0,0,0|4,0,0]=4 270 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [0,0,0,0,0,0|1,1,0]=2 271 B6R0.3 C[C@@H](N)[C@@H](O)CO Amb19944286 [0,0,0,0,0,0|3,0,1]=4 272 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [0,0,0,0,0,0|3,0,0]=3 273 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [0,0,0,0,0,0|2,0,0]=2 274 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [0,0,0,0,0,0|2,0,1]=3 275 B6R0.3 C[C@@H](O)[C@@H](O)CCl Amb24737856 [0,0,0,0,0,0|3,0,1]=4 276 B6R0.3 C[C@@H](O)[C@H](C)CO Amb25810619 [0,0,0,0,0,0|2,0,1]=3 277 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [0,0,0,0,0,0|2,0,1]=3 278 B6R0.3 C[C@@H](O)[C@H](N)CN Amb19374892 [0,0,0,0,0,0|2,0,1]=3 279 B6R0.3 C[C@@H](O)[C@H](O)CO Amb25084430 [0,0,0,0,0,0|2,0,1]=3 280 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [0,0,0,0,0,0|4,0,0]=4 281 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [0,0,0,0,0,0|2,0,0]=2 282 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [0,0,0,0,0,0|3,0,0]=3 283 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [0,0,0,0,0,0|2,0,2]=4 284 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [0,0,0,0,0,0|3,0,1]=4 285 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,0,0,0,0|3,0,0]=3 286 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [0,0,0,0,0,0|2,0,0]=2 287 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [0,0,0,0,0,0|2,0,0]=2 288 B6R0.3 C[C@H](CN)[C@@H](C)O Amb24479790 [0,0,0,0,0,0|3,0,1]=4 289 B6R0.3 C[C@H](CO)S(C)=O Amb24334035 [0,0,0,0,0,0|3,0,0]=3 290 B6R0.3 C[C@H](CO)[C@H](C)Cl Amb24479757 [0,0,0,0,0,0|3,0,1]=4 291 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [0,0,0,0,0,0|1,1,0]=2 292 B6R0.3 C[C@H](N)[C@@H](O)CO Amb25327107 [0,0,0,0,0,0|3,0,1]=4 293 B6R0.3 C[C@H](N)[C@H](O)CO Amb24479808 [0,0,0,0,0,0|3,0,1]=4 294 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [0,0,0,0,0,0|3,0,0]=3 295 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [0,0,0,0,0,0|3,0,0]=3 296 B6R0.3 C[C@H](O)C(N)C#N Amb25824653 [0,0,0,0,0,0|2,0,2]=4 297 B6R0.3 C[C@H](O)C(O)CN Amb24365506 [0,0,0,0,0,0|3,0,1]=4 298 B6R0.3 C[C@H](O)[C@@H](C)CO Amb24480821 [0,0,0,0,0,0|2,0,1]=3 299 B6R0.3 C[C@H](O)[C@@H](O)CCl Amb24479499 [0,0,0,0,0,0|3,0,1]=4 300 B6R0.3 C[C@H](O)[C@H](C)CO Amb25127201 [0,0,0,0,0,0|2,0,1]=3 301 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [0,0,0,0,0,0|1,0,1]=2 302 B6R0.3 C[C@H](O)[C@H](O)CO Amb25185955 [0,0,0,0,0,0|2,0,1]=3 303 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [0,0,0,0,0,0|3,0,0]=3 304 B6R0.3 C\C(=C/N)\C(O)=O Amb24507602 [0,0,0,0,0,0|2,0,2]=4 305 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [0,0,0,0,0,0|1,0,2]=3 306 B6R0.3 C\C(=C\O)\C(C)=O Amb24361303 [0,0,0,0,0,0|2,0,2]=4 307 B6R0.3 C\C(=C\O)\C(N)=O Amb24479832 [0,0,0,0,0,0|2,0,2]=4 308 B6R0.3 C\C(=N/O)\C(N)=O Amb24680733 [0,0,0,0,0,0|3,0,1]=4 309 B6R0.3 C\C(=N\Br)\C(O)=O Amb25745370 [0,0,0,0,0,0|3,0,1]=4 310 B6R0.3 C\C(=N\O)\C(O)=O Amb23523075 [0,0,0,0,0,0|2,0,1]=3 311 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [0,0,0,0,0,0|2,0,2]=4 312 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [0,0,0,0,0,0|2,0,2]=4 313 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [0,0,0,0,0,0|2,0,2]=4 314 B6R0.3 C\C=C(\N)/C(N)=O Amb24681313 [0,0,0,0,0,0|2,0,2]=4 315 B6R0.3 NC(=O)C(=O)CBr Amb24085874 [0,0,0,0,0,0|3,0,1]=4 316 B6R0.3 NC(=O)C(=O)NO Amb24453454 [0,0,0,0,0,0|3,0,1]=4 317 B6R0.3 NC(=O)C(Cl)C#N Amb24479825 [0,0,0,0,0,0|3,0,1]=4 318 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,0,0,0,0,0|3,0,0]=3 319 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [0,0,0,0,0,0|2,0,0]=2 320 B6R0.3 NC(=O)C(F)CF Amb25128008 [0,0,0,0,0,0|3,0,0]=3 321 B6R0.3 NC(=O)C(F)CO Amb24507432 [0,0,0,0,0,0|2,0,0]=2 322 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [0,0,0,0,0,0|2,0,0]=2 323 B6R0.3 NC(=O)\C(\I)=N\O Amb25132216 [0,0,0,0,0,0|3,0,1]=4 324 B6R0.3 NC(C#N)C(O)=O Amb25328320 [0,0,0,0,0,0|1,0,1]=2 325 B6R0.3 NC(C(=O)N)C#N Amb1039452 [0,0,0,0,0,0|2,0,1]=3 326 B6R0.3 NC(C(=O)N)CO Amb17593097 [0,0,0,0,0,0|1,0,0]=1 327 B6R0.3 NC(C(=O)O)CF Amb10839589 [0,0,0,0,0,0|1,0,0]=1 328 B6R0.3 NC(C(=O)O)CS Amb13961966 [0,0,0,0,0,0|0,1,0]=1 329 B6R0.3 NC(C(=S)N)C#N Amb1980773 [0,0,0,0,0,0|2,1,1]=4 330 B6R0.3 NC(C=O)C(O)=O Amb24349579 [0,0,0,0,0,0|0,0,2]=2 331 B6R0.3 NC(C=S)C(O)=O Amb25227802 [0,0,0,0,0,0|0,1,1]=2 332 B6R0.3 NC(CCl)C(O)=O Amb19651457 [0,0,0,0,0,0|1,0,0]=1 333 B6R0.3 NC(CCl)C(O)=O Amb21961077 [0,0,0,0,0,0|1,0,0]=1 334 B6R0.3 NC(CI)C(O)=O Amb25177412 [0,0,0,0,0,0|1,0,0]=1 335 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [0,0,0,0,0,0|0,0,0]=0 336 B6R0.3 NC(CS)C(N)=O Amb18641990 [0,0,0,0,0,0|1,1,0]=2 337 B6R0.3 NC(CS)C(O)=O Amb22489523 [0,0,0,0,0,0|0,1,0]=1 338 B6R0.3 NC(CS)P(O)=O Amb25772157 [0,0,0,0,0,0|1,1,0]=2 339 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [0,0,0,0,0,0|0,1,0]=1 340 B6R0.3 NCC(=O)C(O)=O Amb24361938 [0,0,0,0,0,0|2,0,1]=3 341 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [0,0,0,0,0,0|2,0,0]=2 342 B6R0.3 NCC(C(=O)O)S Amb17593238 [0,0,0,0,0,0|2,0,0]=2 343 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [0,0,0,0,0,0|3,0,0]=3 344 B6R0.3 NCC(F)C(O)=O Amb22733051 [0,0,0,0,0,0|2,0,0]=2 345 B6R0.3 NCC(N)C(N)=O Amb18122079 [0,0,0,0,0,0|2,0,0]=2 346 B6R0.3 NCC(N)C(O)=O Amb22899095 [0,0,0,0,0,0|1,0,0]=1 347 B6R0.3 NCC(O)C(O)O Amb24597415 [0,0,0,0,0,0|2,0,2]=4 348 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [0,0,0,0,0,0|2,0,0]=2 349 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [0,0,0,0,0,0|1,0,0]=1 350 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [0,0,0,0,0,0|2,0,0]=2 351 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [0,0,0,0,0,0|3,0,0]=3 352 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [0,0,0,0,0,0|2,0,0]=2 353 B6R0.3 NOC(F)C(O)=O Amb24446310 [0,0,0,0,0,0|3,0,0]=3 354 B6R0.3 NOC(O)C(O)=O Amb24735537 [0,0,0,0,0,0|3,0,0]=3 355 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [0,0,0,0,0,0|2,0,0]=2 356 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [0,0,0,0,0,0|2,0,0]=2 357 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [0,0,0,0,0,0|0,0,0]=0 358 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [0,0,0,0,0,0|1,0,0]=1 359 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [0,0,0,0,0,0|1,0,0]=1 360 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [0,0,0,0,0,0|0,0,0]=0 361 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [0,0,0,0,0,0|1,1,0]=2 362 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [0,0,0,0,0,0|1,1,0]=2 363 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [0,0,0,0,0,0|0,1,0]=1 364 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [0,0,0,0,0,0|1,0,0]=1 365 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [0,0,0,0,0,0|1,0,0]=1 366 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [0,0,0,0,0,0|1,0,0]=1 367 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [0,0,0,0,0,0|0,1,0]=1 368 B6R0.3 N\C(=N/O)\C(=O)N Amb16186552 [0,0,0,0,0,0|2,0,1]=3 369 B6R0.3 N\C(=N/O)\C(O)=O Amb24670890 [0,0,0,0,0,0|1,0,1]=2 370 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [0,0,0,0,0,0|3,0,0]=3 371 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [0,0,0,0,0,0|2,1,0]=3 372 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [0,0,0,0,0,0|2,0,2]=4 373 B6R0.3 OC(=CBr)C(O)=O Amb24479759 [0,0,0,0,0,0|2,0,2]=4 374 B6R0.3 OC(=CS)C(O)=O Amb25340519 [0,0,0,0,0,0|1,1,2]=4 375 B6R0.3 OC(=O)C(=O)C=O Amb25836179 [0,0,0,0,0,0|1,0,3]=4 376 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [0,0,0,0,0,0|2,0,1]=3 377 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [0,0,0,0,0,0|2,0,1]=3 378 B6R0.3 OC(=O)C(=O)CF Amb22008247 [0,0,0,0,0,0|2,0,1]=3 379 B6R0.3 OC(=O)C(=O)CF Amb22274202 [0,0,0,0,0,0|2,0,1]=3 380 B6R0.3 OC(=O)C(=O)CS Amb22360785 [0,0,0,0,0,0|1,1,1]=3 381 B6R0.3 OC(=O)C(=O)OCl Amb24684116 [0,0,0,0,0,0|3,0,1]=4 382 B6R0.3 OC(=O)C(Br)=CCl Amb24429120 [0,0,0,0,0,0|2,0,2]=4 383 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [0,0,0,0,0,0|2,0,0]=2 384 B6R0.3 OC(=O)C(CF)Br Amb10605519 [0,0,0,0,0,0|2,0,0]=2 385 B6R0.3 OC(=O)C(Cl)=CBr Amb24478967 [0,0,0,0,0,0|2,0,2]=4 386 B6R0.3 OC(=O)C(Cl)=NO Amb25839923 [0,0,0,0,0,0|2,0,1]=3 387 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [0,0,0,0,0,0|1,0,2]=3 388 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [0,0,0,0,0,0|2,0,0]=2 389 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [0,0,0,0,0,0|2,0,0]=2 390 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [0,0,0,0,0,0|2,0,0]=2 391 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [0,0,0,0,0,0|1,1,0]=2 392 B6R0.3 OC(=O)C(F)=CBr Amb24651069 [0,0,0,0,0,0|2,0,2]=4 393 B6R0.3 OC(=O)C(F)=CCl Amb25805817 [0,0,0,0,0,0|2,0,2]=4 394 B6R0.3 OC(=O)C(F)C=O Amb22055301 [0,0,0,0,0,0|1,0,2]=3 395 B6R0.3 OC(=O)C(F)CF Amb24746801 [0,0,0,0,0,0|2,0,0]=2 396 B6R0.3 OC(=O)C(S)=CS Amb24480963 [0,0,0,0,0,0|1,1,2]=4 397 B6R0.3 OC(=O)C(S)=NO Amb24479775 [0,0,0,0,0,0|2,0,1]=3 398 B6R0.3 OC(=O)C(S)CS Amb18643295 [0,0,0,0,0,0|1,1,0]=2 399 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [0,0,0,0,0,0|2,0,0]=2 400 B6R0.3 OC(=O)\C(=C/Cl)\Cl Amb17593560 [0,0,0,0,0,0|2,0,2]=4 401 B6R0.3 OC(=O)\C(\Br)=C/Br Amb22469643 [0,0,0,0,0,0|2,0,2]=4 402 B6R0.3 OC(=O)\C(\Cl)=C/O Amb24479774 [0,0,0,0,0,0|1,0,2]=3 403 B6R0.3 OC(=O)\C(\F)=C\F Amb24393011 [0,0,0,0,0,0|2,0,2]=4 404 B6R0.3 OC(C=O)C(O)=O Amb18640325 [0,0,0,0,0,0|1,0,2]=3 405 B6R0.3 OC(CBr)C(O)=O Amb24061932 [0,0,0,0,0,0|2,0,0]=2 406 B6R0.3 OC(CCl)P(O)=O Amb25069434 [0,0,0,0,0,0|3,0,0]=3 407 B6R0.3 OC(CO)C(Cl)Cl Amb25362059 [0,0,0,0,0,0|3,0,1]=4 408 B6R0.3 OC(CO)C(F)F Amb25831242 [0,0,0,0,0,0|3,0,1]=4 409 B6R0.3 OC(CO)C(O)Cl Amb25210424 [0,0,0,0,0,0|2,0,1]=3 410 B6R0.3 OC(CS)C(O)=O Amb18642053 [0,0,0,0,0,0|1,1,0]=2 411 B6R0.3 OC(O)[C@@H](O)CO Amb24480839 [0,0,0,0,0,0|1,0,2]=3 412 B6R0.3 OC(O)[C@H](O)CO Amb25317667 [0,0,0,0,0,0|1,0,2]=3 413 B6R0.3 OC(S)C(O)CS Amb24643418 [0,0,0,0,0,0|1,2,1]=4 414 B6R0.3 OCC(=C(Cl)Cl)C Amb17593562 [0,0,0,0,0,0|3,0,1]=4 415 B6R0.3 OCC(Br)C(O)=O Amb18126327 [0,0,0,0,0,0|1,0,0]=1 416 B6R0.3 OCC(C(=O)O)F Amb17593117 [0,0,0,0,0,0|1,0,0]=1 417 B6R0.3 OCC(C(=O)O)O Amb17593103 [0,0,0,0,0,0|1,0,0]=1 418 B6R0.3 OCC(C(O)C)N Amb17593100 [0,0,0,0,0,0|1,0,1]=2 419 B6R0.3 OCC(Cl)C(Cl)Cl Amb25684484 [0,0,0,0,0,0|3,0,1]=4 420 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [0,0,0,0,0,0|1,0,0]=1 421 B6R0.3 OCC(F)=C(F)F Amb24507487 [0,0,0,0,0,0|3,0,1]=4 422 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [0,0,0,0,0,0|1,0,0]=1 423 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [0,0,0,0,0,0|1,0,0]=1 424 B6R0.3 OC[C@@H](C(C)C)C Amb17613247 [0,0,0,0,0,0|3,0,1]=4 425 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [0,0,0,0,0,0|1,0,0]=1 426 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [0,0,0,0,0,0|1,0,0]=1 427 B6R0.3 ONC(O)C(O)=O Amb25832155 [0,0,0,0,0,0|2,0,0]=2 428 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [0,0,0,0,0,0|2,0,1]=3 429 B6R0.3 O[13C](=O)[13C](=O)O[Na] Amb22336731 [0,0,0,0,0,0|3,0,1]=4 430 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [0,0,0,0,0,0|2,0,0]=2 431 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [0,0,0,0,0,0|2,0,0]=2 432 B6R0.3 O[C@@H](CO)C(Cl)Cl Amb25061246 [0,0,0,0,0,0|3,0,1]=4 433 B6R0.3 O[C@@H](CO)C(F)F Amb24480471 [0,0,0,0,0,0|3,0,1]=4 434 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [0,0,0,0,0,0|1,1,0]=2 435 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [0,0,0,0,0,0|2,0,0]=2 436 B6R0.3 O\C(=N\O)\C(O)=O Amb24462565 [0,0,0,0,0,0|2,0,1]=3 437 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [0,0,0,0,0,0|2,0,2]=4 438 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [0,0,0,0,0,0|2,0,0]=2 439 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [0,0,0,0,0,0|0,1,0]=1 440 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [0,0,0,0,0,0|0,0,0]=0 441 B6R0.3 [O-]C(=O)C(=O)CF Amb10839900 [0,0,0,0,0,0|2,0,2]=4 442 B6R0.3 [O-]C(=O)C(=O)CF Amb24074078 [0,0,0,0,0,0|2,0,2]=4 443 B6R0.3 [O-]C(=O)C(=O)CO Amb22360656 [0,0,0,0,0,0|1,0,2]=3 444 B6R0.3 [O-]C(=O)C(=O)CS Amb22547761 [0,0,0,0,0,0|1,1,2]=4 445 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [0,0,0,0,0,0|1,0,1]=2 446 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [0,0,0,0,0,0|1,0,1]=2 447 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [0,0,0,0,0,0|0,1,1]=2 448 B6R0.3 [O-][N+](=O)C(Br)CO Amb24479795 [0,0,0,0,0,0|2,0,1]=3 449 B6R0.3 [O-][N+](=O)C(CO)C Amb17600148 [0,0,0,0,0,0|2,0,1]=3 450 B6R0.3 [O-][N+](=O)N(CO)C Amb17618398 [0,0,0,0,0,0|3,0,1]=4 451 B5R0.1 BC(=O)NCC Amb22343194 [1,0,0,0,0,0|3,0,0]=4 452 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 453 B5R0.1 C=C(Br)CCN Amb23512022 [1,0,0,0,0,0|3,0,0]=4 454 B5R0.1 C=C(Cl)CCCl Amb24636781 [1,0,0,0,0,0|3,0,0]=4 455 B5R0.1 C=C(F)CCO Amb25747437 [1,0,0,0,0,0|2,0,0]=3 456 B5R0.1 C=C(I)CCCl Amb24349789 [1,0,0,0,0,0|3,0,0]=4 457 B5R0.1 C=C(I)CCN Amb24756665 [1,0,0,0,0,0|3,0,0]=4 458 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,0,0,0,0|1,0,2]=4 459 B5R0.1 CC(=C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 460 B5R0.1 CC(=C)CCN Amb17673481 [1,0,0,0,0,0|3,0,0]=4 461 B5R0.1 CC(=N)NCO Amb24751321 [1,0,0,0,0,0|3,0,0]=4 462 B5R0.1 CC(=O)CC#C Amb17673302 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|2,0,1]=4 464 B5R0.1 CC(=O)CC#N Amb22274239 [1,0,0,0,0,0|2,0,1]=4 465 B5R0.1 CC(=O)CC=O Amb17666764 [1,0,0,0,0,0|1,0,2]=4 466 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 467 B5R0.1 CC(=O)CCN Amb10067110 [1,0,0,0,0,0|2,0,0]=3 468 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|2,0,0]=3 469 B5R0.1 CC(=O)CN=O Amb24645582 [1,0,0,0,0,0|2,0,1]=4 470 B5R0.1 CC(=O)CON Amb25128844 [1,0,0,0,0,0|3,0,0]=4 471 B5R0.1 CC(=O)CSCl Amb24631131 [1,0,0,0,0,0|3,0,0]=4 472 B5R0.1 CC(=O)NCCl Amb25790034 [1,0,0,0,0,0|3,0,0]=4 473 B5R0.1 CC(=O)NCS Amb25124326 [1,0,0,0,0,0|2,1,0]=4 474 B5R0.1 CC(=O)OCCl Amb17673336 [1,0,0,0,0,0|3,0,0]=4 475 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 476 B5R0.1 CC(=O)OCN Amb24359000 [1,0,0,0,0,0|3,0,0]=4 477 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 478 B5R0.1 CC(=S)NCO Amb25739054 [1,0,0,0,0,0|2,1,0]=4 479 B5R0.1 CC(Br)=CCO Amb25719036 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.1 CC(Cl)=CCO Amb24061938 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 CC(F)CCO Amb21951900 [1,0,0,0,0,0|2,0,1]=4 482 B5R0.1 CC(I)=CCO Amb24652791 [1,0,0,0,0,0|2,0,1]=4 483 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 484 B5R0.1 CC(O)CCO Amb22227721 [1,0,0,0,0,0|1,0,1]=3 485 B5R0.1 CC(O)CCO Amb22232248 [1,0,0,0,0,0|1,0,1]=3 486 B5R0.1 CC(O)CCS Amb22359316 [1,0,0,0,0,0|1,1,1]=4 487 B5R0.1 CC(O)CNO Amb24333693 [1,0,0,0,0,0|2,0,1]=4 488 B5R0.1 CC(S)CCO Amb19148316 [1,0,0,0,0,0|1,1,1]=4 489 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 CCCC(=C)Br Amb22583743 [1,0,0,0,0,0|3,0,0]=4 491 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|3,0,0]=4 492 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|2,0,0]=3 493 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|2,1,0]=4 494 B5R0.1 CCCC(N)O Amb25147414 [1,0,0,0,0,0|2,0,1]=4 495 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|1,1,0]=3 496 B5R0.1 CCCC(O)Br Amb25106743 [1,0,0,0,0,0|2,0,1]=4 497 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|2,0,1]=4 498 B5R0.1 CCCC([O-])=O Amb17772223 [1,0,0,0,0,0|1,0,1]=3 499 B5R0.1 CCCC([O-])=O Amb22732283 [1,0,0,0,0,0|1,0,1]=3 500 B5R0.1 CCCC([O-])=O Amb22732651 [1,0,0,0,0,0|1,0,1]=3 501 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|3,0,0]=4 502 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|3,0,0]=4 503 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|3,0,0]=4 504 B5R0.1 CCCS(O)=O Amb24615072 [1,0,0,0,0,0|2,0,0]=3 505 B5R0.1 CCCS([O-])=O Amb19929119 [1,0,0,0,0,0|2,0,1]=4 506 B5R0.1 CCC[13C](O)=O Amb22337992 [1,0,0,0,0,0|1,0,0]=2 507 B5R0.1 CCC[13C](O)=O Amb22338339 [1,0,0,0,0,0|1,0,0]=2 508 B5R0.1 CCNC(=O)Br Amb24563760 [1,0,0,0,0,0|3,0,0]=4 509 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|3,0,0]=4 510 B5R0.1 CCNC(O)=S Amb24612743 [1,0,0,0,0,0|2,1,0]=4 511 B5R0.1 CCOC([13CH3])=O Amb22363103 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 CCOP(O)=O Amb22360741 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 CCO[13C](C)=O Amb22363160 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 CCO[14C](N)=O Amb22732757 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 CCSC(N)=O Amb24394612 [1,0,0,0,0,0|3,0,0]=4 517 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [1,0,0,0,0,0|1,0,0]=2 518 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [1,0,0,0,0,0|1,0,1]=3 519 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [1,0,0,0,0,0|1,0,0]=2 520 B5R0.1 CN(O)CCO Amb25234570 [1,0,0,0,0,0|2,0,0]=3 521 B5R0.1 CNCC(=O)C Amb17621974 [1,0,0,0,0,0|3,0,0]=4 522 B5R0.1 CNCC(=O)N Amb10610205 [1,0,0,0,0,0|3,0,0]=4 523 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|3,0,0]=4 524 B5R0.1 CNCC([O-])=O Amb20246714 [1,0,0,0,0,0|2,0,1]=4 525 B5R0.1 CNCP(O)=O Amb24478116 [1,0,0,0,0,0|3,0,0]=4 526 B5R0.1 COCC(=O)Br Amb25282928 [1,0,0,0,0,0|3,0,0]=4 527 B5R0.1 COCC(=O)N Amb1153776 [1,0,0,0,0,0|3,0,0]=4 528 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 529 B5R0.1 CS(=O)CCN Amb19889121 [1,0,0,0,0,0|3,0,0]=4 530 B5R0.1 CS(=O)CCN Amb20248083 [1,0,0,0,0,0|3,0,0]=4 531 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|3,0,0]=4 532 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|2,0,0]=3 533 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|3,0,0]=4 534 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|3,0,0]=4 535 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [1,0,0,0,0,0|1,0,1]=3 536 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [1,0,0,0,0,0|2,0,1]=4 537 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,0,0,0,0,0|2,0,1]=4 538 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,0,0,0,0,0|2,0,1]=4 539 B5R0.1 C[C@@H](O)CCCl Amb24565032 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|2,0,1]=4 541 B5R0.1 C[C@H](N)CCO Amb19515998 [1,0,0,0,0,0|2,0,1]=4 542 B5R0.1 C[C@H](N)CCO Amb24055217 [1,0,0,0,0,0|2,0,1]=4 543 B5R0.1 C[C@H](O)CCI Amb24675161 [1,0,0,0,0,0|2,0,1]=4 544 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|2,0,1]=4 545 B5R0.1 C[NH+](C)CCO Amb22493791 [1,0,0,0,0,0|3,0,0]=4 546 B5R0.1 C[S+](C)CCO Amb24420852 [1,0,0,0,0,0|3,0,0]=4 547 B5R0.1 C[SiH](C)CCO Amb25184701 [1,0,0,0,0,0|2,1,0]=4 548 B5R0.1 C\C(=C/CO)\I Amb17616110 [1,0,0,0,0,0|2,0,1]=4 549 B5R0.1 C\C(\Cl)=C\CO Amb25663061 [1,0,0,0,0,0|2,0,1]=4 550 B5R0.1 ClC(=O)CC#N Amb17593096 [1,0,0,0,0,0|2,0,1]=4 551 B5R0.1 N#CCC(O)=O Amb20247050 [1,0,0,0,0,0|1,0,1]=3 552 B5R0.1 N#CCS(O)=O Amb25232047 [1,0,0,0,0,0|2,0,1]=4 553 B5R0.1 N#C[13CH2][13C]([O-])=O Amb22054790 [1,0,0,0,0,0|1,0,2]=4 554 B5R0.1 NC(=N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 555 B5R0.1 NC(=N)CCS Amb25126101 [1,0,0,0,0,0|2,1,0]=4 556 B5R0.1 NC(=O)C=NO Amb25147466 [1,0,0,0,0,0|2,0,1]=4 557 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,0,0,0,0|2,0,1]=4 558 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|1,0,2]=4 559 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 560 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 561 B5R0.1 NC(=O)CNO Amb25199017 [1,0,0,0,0,0|2,0,0]=3 562 B5R0.1 NC(=O)NCCl Amb25130799 [1,0,0,0,0,0|3,0,0]=4 563 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|2,0,0]=3 564 B5R0.1 NC(=O)OCCl Amb24681219 [1,0,0,0,0,0|3,0,0]=4 565 B5R0.1 NC(=O)OCI Amb25146422 [1,0,0,0,0,0|3,0,0]=4 566 B5R0.1 NC(=O)OCO Amb25662384 [1,0,0,0,0,0|2,0,0]=3 567 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|1,2,0]=4 568 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,0]=3 569 B5R0.1 NCCC(=O)N Amb1137251 [1,0,0,0,0,0|2,0,0]=3 570 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,0]=2 571 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|2,1,0]=4 572 B5R0.1 NCCC(N)O Amb24657290 [1,0,0,0,0,0|2,0,1]=4 573 B5R0.1 NCCP(O)=O Amb22168066 [1,0,0,0,0,0|2,0,0]=3 574 B5R0.1 NCCS(=O)=O Amb25744074 [1,0,0,0,0,0|2,0,1]=4 575 B5R0.1 NCC[N+]([O-])=O Amb18203119 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 NCOP(O)=O Amb24333271 [1,0,0,0,0,0|3,0,0]=4 577 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 578 B5R0.1 NOCC(N)=O Amb22059481 [1,0,0,0,0,0|3,0,0]=4 579 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 580 B5R0.1 N[C@H](O)CCO Amb24421109 [1,0,0,0,0,0|1,0,1]=3 581 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,0,0,0,0|2,0,1]=4 582 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 583 B5R0.1 O=C(Br)CCCl Amb24474527 [1,0,0,0,0,0|2,0,0]=3 584 B5R0.1 O=C(F)NCF Amb24478456 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 O=C(I)CCCl Amb25146462 [1,0,0,0,0,0|2,0,0]=3 586 B5R0.1 O=S(Cl)CCBr Amb24563387 [1,0,0,0,0,0|3,0,0]=4 587 B5R0.1 OC(=O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 588 B5R0.1 OC(=O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 589 B5R0.1 OC(=O)C#CI Amb25274128 [1,0,0,0,0,0|1,0,2]=4 590 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,0,0,0,0|0,0,3]=4 591 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,0,0,0,0|0,0,2]=3 592 B5R0.1 OC(=O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 593 B5R0.1 OC(=O)CI=O Amb25146428 [1,0,0,0,0,0|1,0,1]=3 594 B5R0.1 OC(=O)CNBr Amb25053433 [1,0,0,0,0,0|2,0,0]=3 595 B5R0.1 OC(=O)CNCl Amb24653229 [1,0,0,0,0,0|2,0,0]=3 596 B5R0.1 OC(=O)CNI Amb25216175 [1,0,0,0,0,0|2,0,0]=3 597 B5R0.1 OC(=O)CSCl Amb24597301 [1,0,0,0,0,0|2,0,0]=3 598 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [1,0,0,0,0,0|2,0,0]=3 599 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 600 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,0,0,0,0|1,0,2]=4 601 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,0,0,0,0|1,0,2]=4 602 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|0,1,2]=4 603 B5R0.1 OCC=C(Br)Br Amb25026226 [1,0,0,0,0,0|2,0,1]=4 604 B5R0.1 OCC=C(Cl)Cl Amb17593330 [1,0,0,0,0,0|2,0,1]=4 605 B5R0.1 OCCC(Cl)Cl Amb24563836 [1,0,0,0,0,0|2,0,1]=4 606 B5R0.1 OCCN(Cl)Cl Amb25700386 [1,0,0,0,0,0|3,0,0]=4 607 B5R0.1 OCCS(=O)=O Amb24474283 [1,0,0,0,0,0|1,0,1]=3 608 B5R0.1 OCNC([S-])=S Amb24443022 [1,0,0,0,0,0|1,2,0]=4 609 B5R0.1 OCOP(O)=O Amb24333194 [1,0,0,0,0,0|2,0,0]=3 610 B5R0.1 OCOS(=O)[Na] Amb22339041 [1,0,0,0,0,0|3,0,0]=4 611 B5R0.1 OCOS(O)=O Amb25106091 [1,0,0,0,0,0|2,0,0]=3 612 B5R0.1 OC\C=C(\Cl)/Br Amb24752244 [1,0,0,0,0,0|2,0,1]=4 613 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,0,0,0,0|1,0,1]=3 614 B5R0.1 ONCC(O)=O Amb24120360 [1,0,0,0,0,0|1,0,0]=2 615 B5R0.1 OP(=O)CC=O Amb25706451 [1,0,0,0,0,0|1,0,2]=4 616 B5R0.1 OP(=O)CCBr Amb24634095 [1,0,0,0,0,0|2,0,0]=3 617 B5R0.1 OP(=O)CCCl Amb24465178 [1,0,0,0,0,0|2,0,0]=3 618 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,0,0,0,0|1,0,1]=3 619 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,0,0,0,0|1,0,1]=3 620 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [1,0,0,0,0,0|1,0,1]=3 621 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [1,0,0,0,0,0|1,0,1]=3 622 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [1,0,0,0,0,0|1,0,1]=3 623 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [1,0,0,0,0,0|1,0,0]=2 624 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [1,0,0,0,0,0|1,0,0]=2 625 B5R0.1 [2H]C(=O)OCC Amb22336312 [1,0,0,0,0,0|3,0,0]=4 626 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.1 [O-]C(=O)CCBr Amb22229633 [1,0,0,0,0,0|1,0,1]=3 628 B5R0.1 [O-]C(=O)CCCl Amb10604124 [1,0,0,0,0,0|1,0,1]=3 629 B5R0.1 [O-]C(=O)CCCl Amb22051669 [1,0,0,0,0,0|1,0,1]=3 630 B5R0.1 [O-]C(=O)CCO Amb22055495 [1,0,0,0,0,0|0,0,1]=2 631 B5R0.1 [O-]S(=O)CCBr Amb24442971 [1,0,0,0,0,0|2,0,1]=4 632 B5R0.1 [O-][N+](=O)CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 633 B5R0.3 BrCC(Br)C=O Amb17670591 [1,0,0,0,0,0|2,0,0]=3 634 B5R0.3 C#CC(O)C=O Amb25759835 [1,0,0,0,0,0|2,0,1]=4 635 B5R0.3 C#CC(O)CO Amb24647380 [1,0,0,0,0,0|2,0,1]=4 636 B5R0.3 C#C[C@@H](N)CO Amb24435241 [1,0,0,0,0,0|1,0,1]=3 637 B5R0.3 C#C[C@@H](O)CO Amb25145538 [1,0,0,0,0,0|2,0,1]=4 638 B5R0.3 C#C[C@H](O)CO Amb25146330 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.3 C=C(CCl)C=O Amb25173687 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.3 C=CC(=C)CO Amb25146300 [1,0,0,0,0,0|2,0,1]=4 641 B5R0.3 C=CC(Br)CCl Amb24698077 [1,0,0,0,0,0|3,0,0]=4 642 B5R0.3 C=CC(F)C=O Amb24552239 [1,0,0,0,0,0|2,0,1]=4 643 B5R0.3 C=CC(F)CBr Amb24530251 [1,0,0,0,0,0|3,0,0]=4 644 B5R0.3 C=CC(N)C=C Amb25184861 [1,0,0,0,0,0|2,0,1]=4 645 B5R0.3 C=CC(N)CO Amb19374935 [1,0,0,0,0,0|1,0,0]=2 646 B5R0.3 C=CC(N)CS Amb18120558 [1,0,0,0,0,0|1,1,0]=3 647 B5R0.3 C=CC(O)C=O Amb25066575 [1,0,0,0,0,0|2,0,1]=4 648 B5R0.3 C=CC(O)CS Amb25234516 [1,0,0,0,0,0|2,1,0]=4 649 B5R0.3 C=C[C@@H](F)CO Amb24475877 [1,0,0,0,0,0|2,0,0]=3 650 B5R0.3 C=C[C@@H](N)CN Amb24393077 [1,0,0,0,0,0|2,0,0]=3 651 B5R0.3 C=C[C@@H](N)CO Amb19886656 [1,0,0,0,0,0|1,0,0]=2 652 B5R0.3 C=C[C@@H](O)CO Amb22225315 [1,0,0,0,0,0|2,0,0]=3 653 B5R0.3 C=C[C@H](F)CO Amb25043797 [1,0,0,0,0,0|2,0,0]=3 654 B5R0.3 C=C[C@H](N)CN Amb25262259 [1,0,0,0,0,0|2,0,0]=3 655 B5R0.3 C=C[C@H](N)CO Amb25147462 [1,0,0,0,0,0|1,0,0]=2 656 B5R0.3 C=C[C@H](O)C=O Amb24677118 [1,0,0,0,0,0|2,0,1]=4 657 B5R0.3 C=C[C@H](O)CO Amb19888350 [1,0,0,0,0,0|2,0,0]=3 658 B5R0.3 CC(=CBr)CO Amb17610042 [1,0,0,0,0,0|2,0,1]=4 659 B5R0.3 CC(C=C)C=O Amb25737956 [1,0,0,0,0,0|2,0,1]=4 660 B5R0.3 CC(C=O)=NO Amb25746939 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.3 CC(C=O)C#C Amb24557170 [1,0,0,0,0,0|2,0,1]=4 662 B5R0.3 CC(CBr)C=C Amb25310976 [1,0,0,0,0,0|3,0,0]=4 663 B5R0.3 CC(CBr)C=O Amb24478503 [1,0,0,0,0,0|2,0,0]=3 664 B5R0.3 CC(CCl)C=O Amb24691518 [1,0,0,0,0,0|2,0,0]=3 665 B5R0.3 CC(CF)C=O Amb24638421 [1,0,0,0,0,0|2,0,0]=3 666 B5R0.3 CC(CN)C=C Amb18286499 [1,0,0,0,0,0|3,0,0]=4 667 B5R0.3 CC(CO)=CI Amb24545825 [1,0,0,0,0,0|2,0,1]=4 668 B5R0.3 CC(CO)=NO Amb24443579 [1,0,0,0,0,0|2,0,1]=4 669 B5R0.3 CC(CO)C=C Amb22347861 [1,0,0,0,0,0|2,0,0]=3 670 B5R0.3 CC(CO)C=O Amb25745800 [1,0,0,0,0,0|1,0,0]=2 671 B5R0.3 CC(CO)CBr Amb24061911 [1,0,0,0,0,0|2,0,1]=4 672 B5R0.3 CC(CO)CP Amb24619153 [1,0,0,0,0,0|2,0,1]=4 673 B5R0.3 CC(CO)CS Amb19375381 [1,0,0,0,0,0|1,1,1]=4 674 B5R0.3 CC(CO)NN Amb20622512 [1,0,0,0,0,0|3,0,0]=4 675 B5R0.3 CC(CO)NN Amb22231763 [1,0,0,0,0,0|3,0,0]=4 676 B5R0.3 CC(CS)C=O Amb25758635 [1,0,0,0,0,0|1,1,0]=3 677 B5R0.3 CCC(=C)C=O Amb17940102 [1,0,0,0,0,0|2,0,1]=4 678 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,0,0,0,0|2,0,1]=4 679 B5R0.3 CCC(Br)C=C Amb25703129 [1,0,0,0,0,0|3,0,0]=4 680 B5R0.3 CCC(Br)C=O Amb18124003 [1,0,0,0,0,0|2,0,0]=3 681 B5R0.3 CCC(C#N)N Amb10203825 [1,0,0,0,0,0|2,0,1]=4 682 B5R0.3 CCC(C#N)N Amb1136995 [1,0,0,0,0,0|2,0,1]=4 683 B5R0.3 CCC(CC)N Amb1154143 [1,0,0,0,0,0|2,0,1]=4 684 B5R0.3 CCC(Cl)C=O Amb18122610 [1,0,0,0,0,0|2,0,0]=3 685 B5R0.3 CCC(Cl)CO Amb22011826 [1,0,0,0,0,0|2,0,1]=4 686 B5R0.3 CCC(F)C=O Amb24606916 [1,0,0,0,0,0|2,0,0]=3 687 B5R0.3 CCC(I)C=O Amb25365077 [1,0,0,0,0,0|2,0,0]=3 688 B5R0.3 CCC(I)CO Amb24444860 [1,0,0,0,0,0|2,0,1]=4 689 B5R0.3 CCC(N)CN Amb19338113 [1,0,0,0,0,0|2,0,1]=4 690 B5R0.3 CCC(N)CS Amb18122513 [1,0,0,0,0,0|1,1,1]=4 691 B5R0.3 CCC(O)C=O Amb25347970 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.3 CCC(O)C=S Amb25115922 [1,0,0,0,0,0|2,1,0]=4 693 B5R0.3 CCC(O)CO Amb22367049 [1,0,0,0,0,0|2,0,1]=4 694 B5R0.3 CCC(S)C=O Amb18122377 [1,0,0,0,0,0|2,0,0]=3 695 B5R0.3 CCN(C)C=O Amb20627285 [1,0,0,0,0,0|3,0,0]=4 696 B5R0.3 CCN(N)C=O Amb24428031 [1,0,0,0,0,0|2,0,0]=3 697 B5R0.3 CC[C@@H](C)CO Amb22799907 [1,0,0,0,0,0|2,0,1]=4 698 B5R0.3 CC[C@@H](CO)C Amb10844611 [1,0,0,0,0,0|2,0,1]=4 699 B5R0.3 CC[C@@H](Cl)C=O Amb24645873 [1,0,0,0,0,0|2,0,0]=3 700 B5R0.3 CC[C@@H](N)C#C Amb24460811 [1,0,0,0,0,0|2,0,1]=4 701 B5R0.3 CC[C@@H](N)C#N Amb25024729 [1,0,0,0,0,0|2,0,1]=4 702 B5R0.3 CC[C@@H](N)CCl Amb24562851 [1,0,0,0,0,0|2,0,1]=4 703 B5R0.3 CC[C@@H](N)CN Amb24120352 [1,0,0,0,0,0|2,0,1]=4 704 B5R0.3 CC[C@@H](N)CS Amb24617754 [1,0,0,0,0,0|1,1,1]=4 705 B5R0.3 CC[C@@H](O)C=C Amb24529645 [1,0,0,0,0,0|3,0,0]=4 706 B5R0.3 CC[C@@H](O)CO Amb20241381 [1,0,0,0,0,0|2,0,1]=4 707 B5R0.3 CC[C@H](Br)CO Amb25147674 [1,0,0,0,0,0|2,0,1]=4 708 B5R0.3 CC[C@H](Cl)C=O Amb24478146 [1,0,0,0,0,0|2,0,0]=3 709 B5R0.3 CC[C@H](N)C=C Amb24615622 [1,0,0,0,0,0|2,0,0]=3 710 B5R0.3 CC[C@H](N)CCl Amb24461621 [1,0,0,0,0,0|2,0,1]=4 711 B5R0.3 CC[C@H](O)C=O Amb24333959 [1,0,0,0,0,0|2,0,0]=3 712 B5R0.3 CC[C@H](O)CO Amb20241380 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.3 CC\C(=N/O)\N Amb10609125 [1,0,0,0,0,0|2,0,1]=4 714 B5R0.3 CC\C(=N\O)\N Amb1125701 [1,0,0,0,0,0|2,0,1]=4 715 B5R0.3 CC\C(\N)=N\O Amb19883708 [1,0,0,0,0,0|2,0,1]=4 716 B5R0.3 CN(CCl)C=O Amb24478418 [1,0,0,0,0,0|3,0,0]=4 717 B5R0.3 CN(CO)CO Amb25847061 [1,0,0,0,0,0|2,0,1]=4 718 B5R0.3 COC(C)CO Amb19517078 [1,0,0,0,0,0|3,0,0]=4 719 B5R0.3 COC(N)CO Amb24615890 [1,0,0,0,0,0|2,0,0]=3 720 B5R0.3 COC(O)CO Amb25747170 [1,0,0,0,0,0|3,0,0]=4 721 B5R0.3 CSC(C)CO Amb24438636 [1,0,0,0,0,0|3,0,0]=4 722 B5R0.3 CS[C@@H](C)CO Amb25255982 [1,0,0,0,0,0|3,0,0]=4 723 B5R0.3 CS[C@H](C)CO Amb25376268 [1,0,0,0,0,0|3,0,0]=4 724 B5R0.3 C[C@@H](CBr)C=C Amb24334134 [1,0,0,0,0,0|3,0,0]=4 725 B5R0.3 C[C@@H](CBr)C=O Amb25024867 [1,0,0,0,0,0|2,0,0]=3 726 B5R0.3 C[C@@H](CN)CO Amb24181882 [1,0,0,0,0,0|2,0,1]=4 727 B5R0.3 C[C@@H](CO)C=C Amb25145603 [1,0,0,0,0,0|2,0,0]=3 728 B5R0.3 C[C@@H](CO)C=O Amb24750144 [1,0,0,0,0,0|1,0,0]=2 729 B5R0.3 C[C@@H](CO)CCl Amb25129442 [1,0,0,0,0,0|2,0,1]=4 730 B5R0.3 C[C@@H](CO)CI Amb25107296 [1,0,0,0,0,0|2,0,1]=4 731 B5R0.3 C[C@@H](OC)CO Amb10603218 [1,0,0,0,0,0|3,0,0]=4 732 B5R0.3 C[C@H](CI)C=C Amb25147661 [1,0,0,0,0,0|3,0,0]=4 733 B5R0.3 C[C@H](CO)CCl Amb24333846 [1,0,0,0,0,0|2,0,1]=4 734 B5R0.3 C[C@H](CO)CS Amb24719511 [1,0,0,0,0,0|1,1,1]=4 735 B5R0.3 C\C(=C/O)\C=O Amb25276378 [1,0,0,0,0,0|1,0,2]=4 736 B5R0.3 C\C(\C=O)=N/O Amb24478401 [1,0,0,0,0,0|2,0,1]=4 737 B5R0.3 C\C=C(/F)\CO Amb22546797 [1,0,0,0,0,0|2,0,1]=4 738 B5R0.3 C\C=C(\Br)/CO Amb25809972 [1,0,0,0,0,0|2,0,1]=4 739 B5R0.3 C\C=C(\I)/CO Amb25046626 [1,0,0,0,0,0|2,0,1]=4 740 B5R0.3 N#CC(Br)C=O Amb21963546 [1,0,0,0,0,0|2,0,1]=4 741 B5R0.3 N#CC(Cl)C=O Amb21963537 [1,0,0,0,0,0|2,0,1]=4 742 B5R0.3 N#CC(O)CO Amb24719768 [1,0,0,0,0,0|2,0,1]=4 743 B5R0.3 N=C(CO)CO Amb24456790 [1,0,0,0,0,0|0,0,3]=4 744 B5R0.3 N=C(CO)NO Amb21520323 [1,0,0,0,0,0|1,0,2]=4 745 B5R0.3 NC(C=O)C=O Amb22751007 [1,0,0,0,0,0|0,0,2]=3 746 B5R0.3 NC(CBr)CBr Amb22357396 [1,0,0,0,0,0|2,0,1]=4 747 B5R0.3 NC(CBr)CBr Amb25025308 [1,0,0,0,0,0|2,0,1]=4 748 B5R0.3 NC(CCl)C#N Amb25777610 [1,0,0,0,0,0|2,0,1]=4 749 B5R0.3 NC(CCl)CCl Amb24700050 [1,0,0,0,0,0|2,0,1]=4 750 B5R0.3 NC(CF)CF Amb21962647 [1,0,0,0,0,0|2,0,1]=4 751 B5R0.3 NC(CF)CF Amb24053296 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.3 NC(CN)CN Amb19149260 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.3 NC(CN)CN Amb22346723 [1,0,0,0,0,0|2,0,1]=4 754 B5R0.3 NC(CO)C#N Amb19372799 [1,0,0,0,0,0|1,0,1]=3 755 B5R0.3 NC(CO)CCl Amb24680312 [1,0,0,0,0,0|1,0,1]=3 756 B5R0.3 NC(CO)CF Amb20622637 [1,0,0,0,0,0|1,0,1]=3 757 B5R0.3 NC(CO)CF Amb25734803 [1,0,0,0,0,0|1,0,1]=3 758 B5R0.3 NC(CO)CO Amb22730767 [1,0,0,0,0,0|0,0,1]=2 759 B5R0.3 NC(CO)CS Amb18640677 [1,0,0,0,0,0|0,1,1]=3 760 B5R0.3 NC(CS)CS Amb24120335 [1,0,0,0,0,0|0,2,1]=4 761 B5R0.3 NCC(Br)CO Amb25147258 [1,0,0,0,0,0|2,0,1]=4 762 B5R0.3 NCC(N)C#N Amb25250533 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.3 NCC(N)CCl Amb24117148 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.3 NCC(N)CF Amb24569078 [1,0,0,0,0,0|2,0,1]=4 765 B5R0.3 NCC(N)CO Amb24117147 [1,0,0,0,0,0|1,0,1]=3 766 B5R0.3 NCC(O)C=O Amb24419762 [1,0,0,0,0,0|2,0,0]=3 767 B5R0.3 NC[C@@H](N)CO Amb19374894 [1,0,0,0,0,0|1,0,1]=3 768 B5R0.3 NC[C@H](O)CO Amb20670545 [1,0,0,0,0,0|2,0,1]=4 769 B5R0.3 N[C@@H](CO)C#N Amb24417764 [1,0,0,0,0,0|1,0,1]=3 770 B5R0.3 N[C@H](CO)CS Amb24560326 [1,0,0,0,0,0|0,1,1]=3 771 B5R0.3 N\C(=N/O)\CCl Amb1153811 [1,0,0,0,0,0|2,0,1]=4 772 B5R0.3 O=CC(=O)CBr Amb18644452 [1,0,0,0,0,0|2,0,1]=4 773 B5R0.3 O=CC(=O)CCl Amb18122597 [1,0,0,0,0,0|2,0,1]=4 774 B5R0.3 O=CC(=O)CF Amb25145488 [1,0,0,0,0,0|2,0,1]=4 775 B5R0.3 O=CC(Br)CCl Amb18647566 [1,0,0,0,0,0|2,0,0]=3 776 B5R0.3 O=CC(C=O)Br Amb2455922 [1,0,0,0,0,0|1,0,2]=4 777 B5R0.3 O=CC(C=O)C Amb17593026 [1,0,0,0,0,0|1,0,2]=4 778 B5R0.3 O=CC(C=O)O Amb17615780 [1,0,0,0,0,0|1,0,2]=4 779 B5R0.3 O=CC(Cl)CCl Amb18124314 [1,0,0,0,0,0|2,0,0]=3 780 B5R0.3 O=CC(F)C=O Amb22230729 [1,0,0,0,0,0|1,0,2]=4 781 B5R0.3 O=CC(I)C=O Amb24548139 [1,0,0,0,0,0|1,0,2]=4 782 B5R0.3 OC(C=C)CBr Amb10808128 [1,0,0,0,0,0|3,0,0]=4 783 B5R0.3 OC(C=C)CCl Amb17593108 [1,0,0,0,0,0|3,0,0]=4 784 B5R0.3 OC(C=C)CO Amb17610151 [1,0,0,0,0,0|2,0,0]=3 785 B5R0.3 OC(CCl)CO Amb22338175 [1,0,0,0,0,0|2,0,1]=4 786 B5R0.3 OC(CF)C=O Amb25210931 [1,0,0,0,0,0|2,0,0]=3 787 B5R0.3 OC(CI)C=O Amb25694739 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.3 OC(CO)C=O Amb21618959 [1,0,0,0,0,0|1,0,0]=2 789 B5R0.3 OC(CO)CO Amb22052560 [1,0,0,0,0,0|1,0,1]=3 790 B5R0.3 OC(CO)CO Amb22167864 [1,0,0,0,0,0|1,0,1]=3 791 B5R0.3 OC(CO)CO Amb22349321 [1,0,0,0,0,0|1,0,1]=3 792 B5R0.3 OC(CO)CO Amb22351872 [1,0,0,0,0,0|1,0,1]=3 793 B5R0.3 OC(CO)CO Amb22353313 [1,0,0,0,0,0|1,0,1]=3 794 B5R0.3 OC(CO)CO Amb22367100 [1,0,0,0,0,0|1,0,1]=3 795 B5R0.3 OC(CO)CO Amb22730938 [1,0,0,0,0,0|1,0,1]=3 796 B5R0.3 OC(CO)CO Amb22731173 [1,0,0,0,0,0|1,0,1]=3 797 B5R0.3 OC([13CH2]O)[13CH2]O Amb22336314 [1,0,0,0,0,0|1,0,1]=3 798 B5R0.3 OCC(=O)C=O Amb17593031 [1,0,0,0,0,0|1,0,1]=3 799 B5R0.3 OCC(=O)CO Amb22732522 [1,0,0,0,0,0|1,0,2]=4 800 B5R0.3 OCC(Br)C=O Amb18644196 [1,0,0,0,0,0|1,0,0]=2 801 B5R0.3 OCC(Br)CCl Amb24736275 [1,0,0,0,0,0|2,0,1]=4 802 B5R0.3 OCC(Br)CF Amb24635772 [1,0,0,0,0,0|2,0,1]=4 803 B5R0.3 OCC(Br)CO Amb22054566 [1,0,0,0,0,0|1,0,1]=3 804 B5R0.3 OCC(C=O)Cl Amb17593122 [1,0,0,0,0,0|1,0,0]=2 805 B5R0.3 OCC(CBr)Br Amb10070836 [1,0,0,0,0,0|2,0,1]=4 806 B5R0.3 OCC(CO)Cl Amb17611073 [1,0,0,0,0,0|1,0,1]=3 807 B5R0.3 OCC(CS)Cl Amb17593329 [1,0,0,0,0,0|1,1,1]=4 808 B5R0.3 OCC(Cl)=CCl Amb24567043 [1,0,0,0,0,0|2,0,1]=4 809 B5R0.3 OCC(Cl)CF Amb21951908 [1,0,0,0,0,0|2,0,1]=4 810 B5R0.3 OCC(F)CBr Amb24061909 [1,0,0,0,0,0|2,0,1]=4 811 B5R0.3 OCC(F)CF Amb25344040 [1,0,0,0,0,0|2,0,1]=4 812 B5R0.3 OCC(I)CO Amb25146352 [1,0,0,0,0,0|1,0,1]=3 813 B5R0.3 OCC(O)CF Amb21961974 [1,0,0,0,0,0|2,0,1]=4 814 B5R0.3 OCC(O)CI Amb22055356 [1,0,0,0,0,0|2,0,1]=4 815 B5R0.3 OCC(S)CBr Amb25101077 [1,0,0,0,0,0|2,0,1]=4 816 B5R0.3 OCN(Cl)CO Amb25731004 [1,0,0,0,0,0|2,0,1]=4 817 B5R0.3 OC[C@@H](Br)CBr Amb25051836 [1,0,0,0,0,0|2,0,1]=4 818 B5R0.3 OC[C@@H](Cl)CCl Amb25204068 [1,0,0,0,0,0|2,0,1]=4 819 B5R0.3 OC[C@@H](O)C=O Amb20242417 [1,0,0,0,0,0|1,0,0]=2 820 B5R0.3 OC[C@@H](O)CBr Amb22225154 [1,0,0,0,0,0|2,0,1]=4 821 B5R0.3 OC[C@@H](O)CF Amb23401456 [1,0,0,0,0,0|2,0,1]=4 822 B5R0.3 OC[C@@H](O)CI Amb24352881 [1,0,0,0,0,0|2,0,1]=4 823 B5R0.3 OC[C@H](Br)CBr Amb25688292 [1,0,0,0,0,0|2,0,1]=4 824 B5R0.3 OC[C@H](O)CBr Amb22226653 [1,0,0,0,0,0|2,0,1]=4 825 B5R0.3 OC[C@H](O)CCl Amb22226649 [1,0,0,0,0,0|2,0,1]=4 826 B5R0.3 OC[C@H](O)CI Amb24420532 [1,0,0,0,0,0|2,0,1]=4 827 B5R0.3 OC\C(\Br)=C\Br Amb22348400 [1,0,0,0,0,0|2,0,1]=4 828 B5R0.3 OC\C(\F)=C/Cl Amb24423861 [1,0,0,0,0,0|2,0,1]=4 829 B5R0.3 O[13CH2][13CH](O)[13CH2]Cl Amb22054729 [1,0,0,0,0,0|2,0,1]=4 830 B5R0.3 O[13CH](CO)CO Amb22337993 [1,0,0,0,0,0|1,0,1]=3 831 B5R0.3 O[13CH]([13CH2]O)[13CH2]O Amb22338082 [1,0,0,0,0,0|1,0,1]=3 832 B5R0.3 O[14CH]([14CH2]O)[14CH2]O Amb22362924 [1,0,0,0,0,0|1,0,1]=3 833 B5R0.3 O[C@@H](CBr)C=O Amb24626840 [1,0,0,0,0,0|2,0,0]=3 834 B5R0.3 O[C@@H](CS)C=O Amb25709640 [1,0,0,0,0,0|1,1,0]=3 835 B5R0.3 O[C@H](C=O)CO Amb16232009 [1,0,0,0,0,0|1,0,0]=2 836 B5R0.3 O[C@H](CCl)C=O Amb25662443 [1,0,0,0,0,0|2,0,0]=3 837 B5R0.3 O\C=C(/Br)\C=O Amb24478132 [1,0,0,0,0,0|1,0,2]=4 838 B5R0.3 O\C=C(/I)\C=O Amb25226806 [1,0,0,0,0,0|1,0,2]=4 839 B5R0.3 O\C=C(\Br)/C=O Amb24333812 [1,0,0,0,0,0|1,0,2]=4 840 B5R0.3 O\C=C(\O)/C=O Amb22731841 [1,0,0,0,0,0|1,0,2]=4 841 B5R0.3 O\C=C(\S)/C=O Amb24573083 [1,0,0,0,0,0|1,0,2]=4 842 B5R0.3 O\N=C(/Cl)\C=O Amb25275135 [1,0,0,0,0,0|2,0,1]=4 843 B5R0.5 BrC(C(=O)C)Br Amb16234148 [1,0,0,0,0,0|3,0,0]=4 844 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [1,0,0,0,0,0|3,0,0]=4 845 B5R0.5 C=C(Br)C(O)=O Amb20620403 [1,0,0,0,0,0|1,0,2]=4 846 B5R0.5 C=C(Cl)C(O)=O Amb17933971 [1,0,0,0,0,0|1,0,2]=4 847 B5R0.5 CC(=C)C(=O)F Amb22230833 [1,0,0,0,0,0|2,0,1]=4 848 B5R0.5 CC(=C)C(O)=O Amb22230681 [1,0,0,0,0,0|1,0,1]=3 849 B5R0.5 CC(=C)C(O)=O Amb22337777 [1,0,0,0,0,0|1,0,1]=3 850 B5R0.5 CC(=C)C(O)=O Amb22351305 [1,0,0,0,0,0|1,0,1]=3 851 B5R0.5 CC(=C)C(O)=O Amb22351871 [1,0,0,0,0,0|1,0,1]=3 852 B5R0.5 CC(=C)C(O)=O Amb22351927 [1,0,0,0,0,0|1,0,1]=3 853 B5R0.5 CC(=C)C(O)O Amb22228890 [1,0,0,0,0,0|3,0,0]=4 854 B5R0.5 CC(=C)C([O-])=O Amb17943044 [1,0,0,0,0,0|1,0,2]=4 855 B5R0.5 CC(=C)C([O-])=O Amb20240542 [1,0,0,0,0,0|1,0,2]=4 856 B5R0.5 CC(=C)C([O-])=O Amb20240585 [1,0,0,0,0,0|1,0,2]=4 857 B5R0.5 CC(=C)C([O-])=O Amb22045782 [1,0,0,0,0,0|1,0,2]=4 858 B5R0.5 CC(=C)C([O-])=O Amb22045789 [1,0,0,0,0,0|1,0,2]=4 859 B5R0.5 CC(=C)C([O-])=O Amb22229881 [1,0,0,0,0,0|1,0,2]=4 860 B5R0.5 CC(=C)C([O-])=O Amb22230829 [1,0,0,0,0,0|1,0,2]=4 861 B5R0.5 CC(=C)C([O-])=O Amb22231309 [1,0,0,0,0,0|1,0,2]=4 862 B5R0.5 CC(=C)C([O-])=O Amb22730162 [1,0,0,0,0,0|1,0,2]=4 863 B5R0.5 CC(=C)C([O-])=O Amb22730173 [1,0,0,0,0,0|1,0,2]=4 864 B5R0.5 CC(=C)C([O-])=O Amb22730220 [1,0,0,0,0,0|1,0,2]=4 865 B5R0.5 CC(=C)C([O-])=O Amb22730616 [1,0,0,0,0,0|1,0,2]=4 866 B5R0.5 CC(=C)C([O-])=O Amb22732008 [1,0,0,0,0,0|1,0,2]=4 867 B5R0.5 CC(=C)C([O-])=O Amb22732130 [1,0,0,0,0,0|1,0,2]=4 868 B5R0.5 CC(=C)C([O-])=O Amb22732965 [1,0,0,0,0,0|1,0,2]=4 869 B5R0.5 CC(=C)C([O-])=O Amb22733010 [1,0,0,0,0,0|1,0,2]=4 870 B5R0.5 CC(=C)C([O-])=O Amb22733228 [1,0,0,0,0,0|1,0,2]=4 871 B5R0.5 CC(=C)C([O-])=O Amb22733283 [1,0,0,0,0,0|1,0,2]=4 872 B5R0.5 CC(=C)C([O-])=O Amb22733711 [1,0,0,0,0,0|1,0,2]=4 873 B5R0.5 CC(=C)C([O-])=O Amb22734514 [1,0,0,0,0,0|1,0,2]=4 874 B5R0.5 CC(=O)C(=C)C Amb17593021 [1,0,0,0,0,0|2,0,1]=4 875 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [1,0,0,0,0,0|2,0,1]=4 876 B5R0.5 CC(=O)C(Cl)Br Amb25784019 [1,0,0,0,0,0|3,0,0]=4 877 B5R0.5 CC(=O)C(F)C Amb10841897 [1,0,0,0,0,0|2,0,0]=3 878 B5R0.5 CC(=O)C(N)=N Amb24409561 [1,0,0,0,0,0|2,0,1]=4 879 B5R0.5 CC(=O)C(N)=S Amb24581132 [1,0,0,0,0,0|1,1,1]=4 880 B5R0.5 CC(=O)C(N)C Amb17593029 [1,0,0,0,0,0|1,0,0]=2 881 B5R0.5 CC(=O)C(N)N Amb25810479 [1,0,0,0,0,0|2,0,0]=3 882 B5R0.5 CC(=O)C(O)O Amb22436762 [1,0,0,0,0,0|2,0,0]=3 883 B5R0.5 CC(=O)C([O-])=O Amb22043412 [1,0,0,0,0,0|1,0,2]=4 884 B5R0.5 CC(=O)C([O-])=O Amb22053857 [1,0,0,0,0,0|1,0,2]=4 885 B5R0.5 CC(=O)C([O-])=O Amb22167358 [1,0,0,0,0,0|1,0,2]=4 886 B5R0.5 CC(=O)C([O-])=O Amb22733838 [1,0,0,0,0,0|1,0,2]=4 887 B5R0.5 CC(=O)N(C)O Amb24066817 [1,0,0,0,0,0|3,0,0]=4 888 B5R0.5 CC(=O)N(N)C Amb17593037 [1,0,0,0,0,0|2,0,0]=3 889 B5R0.5 CC(=O)P(O)=O Amb25368211 [1,0,0,0,0,0|2,0,1]=4 890 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [1,0,0,0,0,0|1,0,2]=4 891 B5R0.5 CC(Br)C(=C)Br Amb25255854 [1,0,0,0,0,0|3,0,0]=4 892 B5R0.5 CC(Br)C(C)N Amb24474359 [1,0,0,0,0,0|2,0,1]=4 893 B5R0.5 CC(Br)C(N)=O Amb22491874 [1,0,0,0,0,0|2,0,0]=3 894 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [1,0,0,0,0,0|1,0,0]=2 895 B5R0.5 CC(Br)[N+]([O-])=O Amb24078354 [1,0,0,0,0,0|2,0,1]=4 896 B5R0.5 CC(C(=O)N)C Amb1153145 [1,0,0,0,0,0|2,0,0]=3 897 B5R0.5 CC(C(=O)N)Cl Amb1151918 [1,0,0,0,0,0|2,0,0]=3 898 B5R0.5 CC(C(=O)O)F Amb10605770 [1,0,0,0,0,0|1,0,0]=2 899 B5R0.5 CC(C(N)C)Cl Amb17593116 [1,0,0,0,0,0|2,0,1]=4 900 B5R0.5 CC(C(O)C)Br Amb17593818 [1,0,0,0,0,0|2,0,1]=4 901 B5R0.5 CC(C)C(=C)Br Amb22583736 [1,0,0,0,0,0|3,0,0]=4 902 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,0,0|2,0,0]=3 903 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,0,0|2,0,0]=3 904 B5R0.5 CC(C)C(O)O Amb25662421 [1,0,0,0,0,0|1,0,2]=4 905 B5R0.5 CC(C)C(S)=S Amb25200225 [1,0,0,0,0,0|1,2,0]=4 906 B5R0.5 CC(C)C([O-])=O Amb22045473 [1,0,0,0,0,0|1,0,1]=3 907 B5R0.5 CC(C)C([O-])=O Amb22730398 [1,0,0,0,0,0|1,0,1]=3 908 B5R0.5 CC(C)C([O-])=O Amb22734686 [1,0,0,0,0,0|1,0,1]=3 909 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,0,0|3,0,0]=4 910 B5R0.5 CC(C)S([O-])=O Amb19929129 [1,0,0,0,0,0|2,0,1]=4 911 B5R0.5 CC(Cl)C(=C)Br Amb25189813 [1,0,0,0,0,0|3,0,0]=4 912 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [1,0,0,0,0,0|2,0,0]=3 913 B5R0.5 CC(Cl)C(C)=C Amb24407204 [1,0,0,0,0,0|3,0,0]=4 914 B5R0.5 CC(Cl)C(N)=N Amb20622290 [1,0,0,0,0,0|3,0,0]=4 915 B5R0.5 CC(Cl)S(=O)Cl Amb24442859 [1,0,0,0,0,0|3,0,0]=4 916 B5R0.5 CC(Cl)S(C)=O Amb24478540 [1,0,0,0,0,0|3,0,0]=4 917 B5R0.5 CC(Cl)[C@H](C)O Amb24442994 [1,0,0,0,0,0|2,0,1]=4 918 B5R0.5 CC(Cl)[N+]([O-])=O Amb22732426 [1,0,0,0,0,0|2,0,1]=4 919 B5R0.5 CC(F)C(=O)Cl Amb24472500 [1,0,0,0,0,0|2,0,0]=3 920 B5R0.5 CC(F)C(C)O Amb25278462 [1,0,0,0,0,0|2,0,1]=4 921 B5R0.5 CC(F)[C@H](C)N Amb25810015 [1,0,0,0,0,0|2,0,1]=4 922 B5R0.5 CC(I)C(=O)Cl Amb24559615 [1,0,0,0,0,0|2,0,0]=3 923 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,0,0,0,0|2,0,0]=3 924 B5R0.5 CC(N)=S(=O)=O Amb25142009 [1,0,0,0,0,0|1,0,2]=4 925 B5R0.5 CC(N)B(O)O Amb25844423 [1,0,0,0,0,0|1,0,1]=3 926 B5R0.5 CC(N)C(=O)Br Amb25184851 [1,0,0,0,0,0|1,0,0]=2 927 B5R0.5 CC(N)C(C)=C Amb23536625 [1,0,0,0,0,0|2,0,0]=3 928 B5R0.5 CC(N)C(C)=O Amb19148817 [1,0,0,0,0,0|1,0,0]=2 929 B5R0.5 CC(N)C(C)N Amb22330596 [1,0,0,0,0,0|2,0,1]=4 930 B5R0.5 CC(N)C(F)F Amb19148014 [1,0,0,0,0,0|2,0,1]=4 931 B5R0.5 CC(N)C(F)F Amb20622283 [1,0,0,0,0,0|2,0,1]=4 932 B5R0.5 CC(N)C(N)=N Amb25771576 [1,0,0,0,0,0|2,0,0]=3 933 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,0,0,0,0|1,0,0]=2 934 B5R0.5 CC(N)C(N)=S Amb19374914 [1,0,0,0,0,0|1,1,0]=3 935 B5R0.5 CC(N)C(O)O Amb24369611 [1,0,0,0,0,0|0,0,2]=3 936 B5R0.5 CC(N)P(O)=O Amb25147710 [1,0,0,0,0,0|1,0,0]=2 937 B5R0.5 CC(N)S([O-])=O Amb25825173 [1,0,0,0,0,0|1,0,1]=3 938 B5R0.5 CC(N)[13C](O)=O Amb22336671 [1,0,0,0,0,0|0,0,0]=1 939 B5R0.5 CC(O)C(=C)F Amb25695653 [1,0,0,0,0,0|3,0,0]=4 940 B5R0.5 CC(O)C(=C)I Amb24736518 [1,0,0,0,0,0|3,0,0]=4 941 B5R0.5 CC(O)C(=O)Cl Amb25045690 [1,0,0,0,0,0|2,0,0]=3 942 B5R0.5 CC(O)C(N)=N Amb22587521 [1,0,0,0,0,0|3,0,0]=4 943 B5R0.5 CC(O)C(N)=S Amb23449309 [1,0,0,0,0,0|2,1,0]=4 944 B5R0.5 CC(O)C(O)=O Amb22350027 [1,0,0,0,0,0|1,0,0]=2 945 B5R0.5 CC(O)C(O)Br Amb25274110 [1,0,0,0,0,0|2,0,1]=4 946 B5R0.5 CC(O)C(O)Cl Amb25147284 [1,0,0,0,0,0|2,0,1]=4 947 B5R0.5 CC(O)C(O)O Amb24531370 [1,0,0,0,0,0|1,0,2]=4 948 B5R0.5 CC(O)C([O-])=O Amb17942960 [1,0,0,0,0,0|1,0,1]=3 949 B5R0.5 CC(O)C([O-])=O Amb17943079 [1,0,0,0,0,0|1,0,1]=3 950 B5R0.5 CC(O)C([O-])=O Amb20246816 [1,0,0,0,0,0|1,0,1]=3 951 B5R0.5 CC(O)C([O-])=O Amb21936112 [1,0,0,0,0,0|1,0,1]=3 952 B5R0.5 CC(O)C([O-])=O Amb22002445 [1,0,0,0,0,0|1,0,1]=3 953 B5R0.5 CC(O)C([O-])=O Amb22054134 [1,0,0,0,0,0|1,0,1]=3 954 B5R0.5 CC(O)C([O-])=O Amb22055552 [1,0,0,0,0,0|1,0,1]=3 955 B5R0.5 CC(O)C([O-])=O Amb22167842 [1,0,0,0,0,0|1,0,1]=3 956 B5R0.5 CC(O)C([O-])=O Amb22350448 [1,0,0,0,0,0|1,0,1]=3 957 B5R0.5 CC(O)C([O-])=O Amb22730128 [1,0,0,0,0,0|1,0,1]=3 958 B5R0.5 CC(O)C([O-])=O Amb22730326 [1,0,0,0,0,0|1,0,1]=3 959 B5R0.5 CC(O)C([O-])=O Amb22731947 [1,0,0,0,0,0|1,0,1]=3 960 B5R0.5 CC(O)C([O-])=O Amb22732237 [1,0,0,0,0,0|1,0,1]=3 961 B5R0.5 CC(O)C([O-])=O Amb22732420 [1,0,0,0,0,0|1,0,1]=3 962 B5R0.5 CC(O)C([O-])=O Amb22732487 [1,0,0,0,0,0|1,0,1]=3 963 B5R0.5 CC(O)C([O-])=O Amb22732889 [1,0,0,0,0,0|1,0,1]=3 964 B5R0.5 CC(O)C([O-])=O Amb22733874 [1,0,0,0,0,0|1,0,1]=3 965 B5R0.5 CC(O)C([O-])=O Amb22733995 [1,0,0,0,0,0|1,0,1]=3 966 B5R0.5 CC(O)P(O)=O Amb24333635 [1,0,0,0,0,0|2,0,0]=3 967 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [1,0,0,0,0,0|1,0,1]=3 968 B5R0.5 CC(P)C(N)=O Amb24715877 [1,0,0,0,0,0|1,1,0]=3 969 B5R0.5 CC(S)C(C)=S Amb24478514 [1,0,0,0,0,0|2,1,0]=4 970 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [1,0,0,0,0,0|0,0,0]=1 971 B5R0.5 CC([C@@H](O)C)O Amb10068424 [1,0,0,0,0,0|2,0,1]=4 972 B5R0.5 CC([C@H](O)C)O Amb10068423 [1,0,0,0,0,0|2,0,1]=4 973 B5R0.5 CC([O-])C([O-])=O Amb22045882 [1,0,0,0,0,0|1,0,1]=3 974 B5R0.5 CN(C)C(=O)F Amb24660451 [1,0,0,0,0,0|3,0,0]=4 975 B5R0.5 CN(C)C(C)=O Amb24323347 [1,0,0,0,0,0|3,0,0]=4 976 B5R0.5 CN(C)C(N)=O Amb22739731 [1,0,0,0,0,0|3,0,0]=4 977 B5R0.5 CN(C)C(O)=O Amb22348477 [1,0,0,0,0,0|2,0,0]=3 978 B5R0.5 CN(C)C(O)=S Amb24477978 [1,0,0,0,0,0|2,1,0]=4 979 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [1,0,0,0,0,0|3,0,0]=4 980 B5R0.5 CN(O)C(N)=O Amb22055740 [1,0,0,0,0,0|3,0,0]=4 981 B5R0.5 CN([No])C(N)=O Amb20621701 [1,0,0,0,0,0|3,0,0]=4 982 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [1,0,0,0,0,0|0,0,0]=1 983 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [1,0,0,0,0,0|0,0,0]=1 984 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [1,0,0,0,0,0|1,0,2]=4 985 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [1,0,0,0,0,0|2,0,1]=4 986 B5R0.5 C[C@@H](Cl)B(O)O Amb25662385 [1,0,0,0,0,0|2,0,1]=4 987 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [1,0,0,0,0,0|2,0,0]=3 988 B5R0.5 C[C@@H](Cl)[C@@H](C)O Amb24478541 [1,0,0,0,0,0|2,0,1]=4 989 B5R0.5 C[C@@H](Cl)[C@H](C)O Amb25295417 [1,0,0,0,0,0|2,0,1]=4 990 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [1,0,0,0,0,0|1,0,0]=2 991 B5R0.5 C[C@@H](F)[C@@H](C)O Amb25221029 [1,0,0,0,0,0|2,0,1]=4 992 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [1,0,0,0,0,0|1,0,0]=2 993 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [1,0,0,0,0,0|1,0,0]=2 994 B5R0.5 C[C@@H](N)C(F)F Amb25198521 [1,0,0,0,0,0|2,0,1]=4 995 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [1,0,0,0,0,0|1,0,0]=2 996 B5R0.5 C[C@@H](N)C(N)=S Amb24680806 [1,0,0,0,0,0|1,1,0]=3 997 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [1,0,0,0,0,0|1,0,0]=2 998 B5R0.5 C[C@@H](N)[C@@H](C)N Amb22800310 [1,0,0,0,0,0|2,0,1]=4 999 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [1,0,0,0,0,0|3,0,0]=4 1000 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [1,0,0,0,0,0|2,0,0]=3 1001 B5R0.5 C[C@@H](O)C(N)=N Amb22587056 [1,0,0,0,0,0|3,0,0]=4 1002 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [1,0,0,0,0,0|1,0,0]=2 1003 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [1,0,0,0,0,0|1,0,1]=3 1004 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [1,0,0,0,0,0|1,0,1]=3 1005 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [1,0,0,0,0,0|2,0,0]=3 1006 B5R0.5 C[C@@H](O)[C@H](C)N Amb25234072 [1,0,0,0,0,0|1,0,1]=3 1007 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [1,0,0,0,0,0|2,0,0]=3 1008 B5R0.5 C[C@@H](S)[C@H](C)O Amb22757247 [1,0,0,0,0,0|2,0,1]=4 1009 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [1,0,0,0,0,0|0,0,0]=1 1010 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [1,0,0,0,0,0|2,0,0]=3 1011 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [1,0,0,0,0,0|2,0,0]=3 1012 B5R0.5 C[C@H](Br)[C@H](C)O Amb25772841 [1,0,0,0,0,0|2,0,1]=4 1013 B5R0.5 C[C@H](C(C)C)N Amb10844612 [1,0,0,0,0,0|2,0,1]=4 1014 B5R0.5 C[C@H](C(C)C)O Amb13952942 [1,0,0,0,0,0|2,0,1]=4 1015 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,0,0,0,0|2,0,0]=3 1016 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [1,0,0,0,0,0|1,0,0]=2 1017 B5R0.5 C[C@H](Cl)S(=O)Cl Amb25025573 [1,0,0,0,0,0|3,0,0]=4 1018 B5R0.5 C[C@H](Cl)[C@@H](C)O Amb24332606 [1,0,0,0,0,0|2,0,1]=4 1019 B5R0.5 C[C@H](Cl)[C@H](C)N Amb24409511 [1,0,0,0,0,0|2,0,1]=4 1020 B5R0.5 C[C@H](F)[C@@H](C)N Amb25062008 [1,0,0,0,0,0|2,0,1]=4 1021 B5R0.5 C[C@H](F)[C@H](C)N Amb25791579 [1,0,0,0,0,0|2,0,1]=4 1022 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [1,0,0,0,0,0|1,0,0]=2 1023 B5R0.5 C[C@H](I)[C@H](C)O Amb24390416 [1,0,0,0,0,0|2,0,1]=4 1024 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [1,0,0,0,0,0|1,0,0]=2 1025 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,0,0,0,0|1,0,0]=2 1026 B5R0.5 C[C@H](N)C(N)=S Amb24746259 [1,0,0,0,0,0|1,1,0]=3 1027 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [1,0,0,0,0,0|1,0,0]=2 1028 B5R0.5 C[C@H](N)[C@@H](C)N Amb24460370 [1,0,0,0,0,0|2,0,1]=4 1029 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [1,0,0,0,0,0|3,0,0]=4 1030 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [1,0,0,0,0,0|2,0,0]=3 1031 B5R0.5 C[C@H](O)C(N)=N Amb22587541 [1,0,0,0,0,0|3,0,0]=4 1032 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [1,0,0,0,0,0|1,0,1]=3 1033 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [1,0,0,0,0,0|1,0,1]=3 1034 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [1,0,0,0,0,0|1,0,1]=3 1035 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [1,0,0,0,0,0|1,0,1]=3 1036 B5R0.5 C[C@H](O)[C@@H](C)N Amb24683375 [1,0,0,0,0,0|1,0,1]=3 1037 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [1,0,0,0,0,0|1,0,0]=2 1038 B5R0.5 C[C@H](S)[C@H](C)O Amb25145514 [1,0,0,0,0,0|2,0,1]=4 1039 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [1,0,0,0,0,0|0,0,0]=1 1040 B5R0.5 ClC(=O)C(=O)C Amb17593107 [1,0,0,0,0,0|2,0,1]=4 1041 B5R0.5 ClC(=O)C(Cl)F Amb10839908 [1,0,0,0,0,0|3,0,0]=4 1042 B5R0.5 FC(=O)C(Cl)F Amb10839909 [1,0,0,0,0,0|3,0,0]=4 1043 B5R0.5 FC(=O)C(F)F Amb10845766 [1,0,0,0,0,0|3,0,0]=4 1044 B5R0.5 FC(C(=O)Cl)F Amb10841735 [1,0,0,0,0,0|3,0,0]=4 1045 B5R0.5 FC(C(=O)N)F Amb2222272 [1,0,0,0,0,0|3,0,0]=4 1046 B5R0.5 FC(C(=O)O)F Amb1953492 [1,0,0,0,0,0|2,0,0]=3 1047 B5R0.5 IC(C(=O)O)I Amb17612865 [1,0,0,0,0,0|2,0,0]=3 1048 B5R0.5 N=C(S)C(O)=O Amb18640468 [1,0,0,0,0,0|0,1,2]=4 1049 B5R0.5 NC(=N)C(=O)O Amb10549353 [1,0,0,0,0,0|1,0,1]=3 1050 B5R0.5 NC(=N)N(N)C Amb10552372 [1,0,0,0,0,0|3,0,0]=4 1051 B5R0.5 NC(=O)C(=O)C Amb17593028 [1,0,0,0,0,0|1,0,2]=4 1052 B5R0.5 NC(=O)C(=O)Cl Amb24377962 [1,0,0,0,0,0|1,0,2]=4 1053 B5R0.5 NC(=O)C(Br)F Amb10841902 [1,0,0,0,0,0|3,0,0]=4 1054 B5R0.5 NC(=O)C(Br)I Amb24592920 [1,0,0,0,0,0|3,0,0]=4 1055 B5R0.5 NC(=O)C(Cl)Br Amb25288934 [1,0,0,0,0,0|3,0,0]=4 1056 B5R0.5 NC(=O)C(Cl)F Amb10839936 [1,0,0,0,0,0|3,0,0]=4 1057 B5R0.5 NC(=O)C(Cl)I Amb24640391 [1,0,0,0,0,0|3,0,0]=4 1058 B5R0.5 NC(=O)C(I)F Amb10840454 [1,0,0,0,0,0|3,0,0]=4 1059 B5R0.5 NC(=O)C(I)I Amb25744737 [1,0,0,0,0,0|3,0,0]=4 1060 B5R0.5 NC(=O)C(N)C Amb1156937 [1,0,0,0,0,0|1,0,0]=2 1061 B5R0.5 NC(=O)C(O)O Amb24680574 [1,0,0,0,0,0|2,0,0]=3 1062 B5R0.5 NC(=O)C([O-])=O Amb22053860 [1,0,0,0,0,0|0,0,3]=4 1063 B5R0.5 NC(=O)C([O-])=O Amb22351608 [1,0,0,0,0,0|0,0,3]=4 1064 B5R0.5 NC(=O)C([O-])=O Amb22730546 [1,0,0,0,0,0|0,0,3]=4 1065 B5R0.5 NC(=O)C([SiH3])[SiH3] Amb25811724 [1,0,0,0,0,0|2,1,0]=4 1066 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [1,0,0,0,0,0|1,0,0]=2 1067 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [1,0,0,0,0,0|1,0,0]=2 1068 B5R0.5 NC(Br)C(O)=O Amb25724348 [1,0,0,0,0,0|1,0,0]=2 1069 B5R0.5 NC(O)C(Cl)Cl Amb25230609 [1,0,0,0,0,0|2,0,1]=4 1070 B5R0.5 NC(O)C(N)=O Amb24478450 [1,0,0,0,0,0|1,0,0]=2 1071 B5R0.5 NC(O)C(N)O Amb24680994 [1,0,0,0,0,0|1,0,1]=3 1072 B5R0.5 NC(O)C(O)=O Amb24663706 [1,0,0,0,0,0|0,0,0]=1 1073 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [1,0,0,0,0,0|1,0,0]=2 1074 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [1,0,0,0,0,0|0,1,0]=2 1075 B5R0.5 O=C(Cl)[13CH](Cl)Cl Amb22353479 [1,0,0,0,0,0|3,0,0]=4 1076 B5R0.5 O=C(F)C(F)Br Amb24558399 [1,0,0,0,0,0|3,0,0]=4 1077 B5R0.5 O=C(P)C(Cl)Cl Amb25288016 [1,0,0,0,0,0|3,0,0]=4 1078 B5R0.5 OB(C(C)C)O Amb2447044 [1,0,0,0,0,0|2,0,1]=4 1079 B5R0.5 OC(=O)C(=O)O Amb10608980 [1,0,0,0,0,0|1,0,1]=3 1080 B5R0.5 OC(=O)C(=O)O Amb19134307 [1,0,0,0,0,0|1,0,1]=3 1081 B5R0.5 OC(=O)C(=O)S Amb25375340 [1,0,0,0,0,0|1,0,2]=4 1082 B5R0.5 OC(=O)C(Br)F Amb10841090 [1,0,0,0,0,0|2,0,0]=3 1083 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [1,0,0,0,0,0|2,0,0]=3 1084 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [1,0,0,0,0,0|2,0,0]=3 1085 B5R0.5 OC(=O)C(Cl)F Amb10838714 [1,0,0,0,0,0|2,0,0]=3 1086 B5R0.5 OC(=O)C(F)S Amb25272480 [1,0,0,0,0,0|1,1,0]=3 1087 B5R0.5 OC(=O)C(I)Br Amb17610018 [1,0,0,0,0,0|2,0,0]=3 1088 B5R0.5 OC(=O)C(I)Cl Amb17610937 [1,0,0,0,0,0|2,0,0]=3 1089 B5R0.5 OC(=O)C(I)F Amb10838458 [1,0,0,0,0,0|2,0,0]=3 1090 B5R0.5 OC(=O)C(O)=O Amb19374136 [1,0,0,0,0,0|1,0,1]=3 1091 B5R0.5 OC(=O)C(O)=O Amb22002537 [1,0,0,0,0,0|1,0,1]=3 1092 B5R0.5 OC(=O)C(O)=O Amb22231343 [1,0,0,0,0,0|1,0,1]=3 1093 B5R0.5 OC(=O)C(O)=O Amb22352057 [1,0,0,0,0,0|1,0,1]=3 1094 B5R0.5 OC(=O)C(O)=O Amb22353291 [1,0,0,0,0,0|1,0,1]=3 1095 B5R0.5 OC(=O)C(O)=O Amb22360650 [1,0,0,0,0,0|1,0,1]=3 1096 B5R0.5 OC(=O)C(O)=O Amb22360667 [1,0,0,0,0,0|1,0,1]=3 1097 B5R0.5 OC(=O)C(O)=O Amb22363275 [1,0,0,0,0,0|1,0,1]=3 1098 B5R0.5 OC(=O)C(O)=O Amb22363302 [1,0,0,0,0,0|1,0,1]=3 1099 B5R0.5 OC(=O)C(O)=O Amb22394874 [1,0,0,0,0,0|1,0,1]=3 1100 B5R0.5 OC(=O)C(O)=O Amb22436461 [1,0,0,0,0,0|1,0,1]=3 1101 B5R0.5 OC(=O)C(O)=O Amb22731645 [1,0,0,0,0,0|1,0,1]=3 1102 B5R0.5 OC(=O)C(O)=O Amb22731888 [1,0,0,0,0,0|1,0,1]=3 1103 B5R0.5 OC(=O)C(O)=O Amb22897045 [1,0,0,0,0,0|1,0,1]=3 1104 B5R0.5 OC(=O)C(O)=O Amb23412252 [1,0,0,0,0,0|1,0,1]=3 1105 B5R0.5 OC(=O)C(S)=S Amb25695615 [1,0,0,0,0,0|1,1,1]=4 1106 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [1,0,0,0,0,0|2,0,0]=3 1107 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [1,0,0,0,0,0|2,0,0]=3 1108 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [1,0,0,0,0,0|2,0,0]=3 1109 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [1,0,0,0,0,0|2,0,0]=3 1110 B5R0.5 OC(Cl)C(=O)Cl Amb24470096 [1,0,0,0,0,0|2,0,0]=3 1111 B5R0.5 OC(O)C(O)O Amb25741488 [1,0,0,0,0,0|1,0,2]=4 1112 B5R0.5 OC(S)C(O)S Amb25792447 [1,0,0,0,0,0|1,1,1]=4 1113 B5R0.5 OS(=O)C(Cl)Cl Amb24355376 [1,0,0,0,0,0|3,0,0]=4 1114 B5R0.5 OS(=O)C(F)F Amb25756691 [1,0,0,0,0,0|3,0,0]=4 1115 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [1,0,0,0,0,0|2,0,0]=3 1116 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [1,0,0,0,0,0|2,0,0]=3 1117 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [1,0,0,0,0,0|1,0,1]=3 1118 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [1,0,0,0,0,0|1,0,1]=3 1119 B5R0.5 O[C@H](S)[C@H](O)S Amb25792469 [1,0,0,0,0,0|1,1,1]=4 1120 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [1,0,0,0,0,0|0,0,0]=1 1121 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [1,0,0,0,0,0|1,0,2]=4 1122 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [1,0,0,0,0,0|0,0,0]=1 1123 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [1,0,0,0,0,0|0,0,0]=1 1124 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [1,0,0,0,0,0|0,0,0]=1 1125 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [1,0,0,0,0,0|1,0,1]=3 1126 B5R0.5 [O-]C(=O)C(Br)F Amb10839585 [1,0,0,0,0,0|2,0,1]=4 1127 B5R0.5 [O-]C(=O)C(Cl)F Amb10839586 [1,0,0,0,0,0|2,0,1]=4 1128 B5R0.5 [O-]C(=O)C(F)F Amb22008196 [1,0,0,0,0,0|2,0,1]=4 1129 B5R0.5 [O-]C(=O)C(F)F Amb22357599 [1,0,0,0,0,0|2,0,1]=4 1130 B5R0.5 [O-]C(=O)C(I)F Amb10839587 [1,0,0,0,0,0|2,0,1]=4 1131 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [1,0,0,0,0,0|1,0,2]=4 1132 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [1,0,0,0,0,0|1,0,2]=4 1133 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [1,0,0,0,0,0|1,0,2]=4 1134 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [1,0,0,0,0,0|1,0,2]=4 1135 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,0,0,0,0|2,0,0]=3 1136 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [0,1,0,0,0,0|1,0,0]=2 1137 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [0,1,0,0,0,0|1,0,0]=2 1138 B7R0.5 C#CC[C@@H](O)C(O)=O Amb25189884 [0,1,0,0,0,0|2,0,0]=3 1139 B7R0.5 C#CC[C@H](N)B(O)O Amb24734992 [0,1,0,0,0,0|2,0,1]=4 1140 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [0,1,0,0,0,0|2,0,1]=4 1141 B7R0.5 C=C(CCO)C(N)=O Amb24548208 [0,1,0,0,0,0|2,0,1]=4 1142 B7R0.5 C=C(CON)C(O)=O Amb25778441 [0,1,0,0,0,0|1,0,1]=3 1143 B7R0.5 C=C(Cl)C(Cl)CCO Amb24710236 [0,1,0,0,0,0|3,0,0]=4 1144 B7R0.5 C=CCC(Br)C(=O)Cl Amb25690180 [0,1,0,0,0,0|3,0,0]=4 1145 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [0,1,0,0,0,0|2,0,0]=3 1146 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [0,1,0,0,0,0|2,0,0]=3 1147 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [0,1,0,0,0,0|1,0,0]=2 1148 B7R0.5 C=CCC(N)P(O)=O Amb24377187 [0,1,0,0,0,0|2,0,0]=3 1149 B7R0.5 C=CCC(O)C(=C)O Amb25072081 [0,1,0,0,0,0|3,0,0]=4 1150 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [0,1,0,0,0,0|2,0,0]=3 1151 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [0,1,0,0,0,0|1,0,0]=2 1152 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [0,1,0,0,0,0|2,0,0]=3 1153 B7R0.5 C=C\C=C(\N)/C(O)=O Amb25306109 [0,1,0,0,0,0|1,0,2]=4 1154 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [0,1,0,0,0,0|2,0,1]=4 1155 B7R0.5 CC(=C)C(F)CCO Amb25189994 [0,1,0,0,0,0|3,0,0]=4 1156 B7R0.5 CC(=C)C(O)CCO Amb25781203 [0,1,0,0,0,0|3,0,0]=4 1157 B7R0.5 CC(=CCBr)C(O)=O Amb24551921 [0,1,0,0,0,0|2,0,1]=4 1158 B7R0.5 CC(=CCCl)C(O)=O Amb25114258 [0,1,0,0,0,0|2,0,1]=4 1159 B7R0.5 CC(=CCN)C(O)=O Amb25845292 [0,1,0,0,0,0|2,0,1]=4 1160 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [0,1,0,0,0,0|1,0,1]=3 1161 B7R0.5 CC(=O)C(=C)CCO Amb25831249 [0,1,0,0,0,0|2,0,1]=4 1162 B7R0.5 CC(=O)C(=C)COC Amb25796652 [0,1,0,0,0,0|2,0,1]=4 1163 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 1164 B7R0.5 CC(=O)C(=O)COC Amb24694271 [0,1,0,0,0,0|2,0,1]=4 1165 B7R0.5 CC(=O)C(Cl)CC#N Amb18124339 [0,1,0,0,0,0|3,0,0]=4 1166 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,1,0,0,0,0|2,0,1]=4 1167 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,1,0,0,0,0|3,0,0]=4 1168 B7R0.5 CC(=O)C(F)CC=C Amb19889753 [0,1,0,0,0,0|3,0,0]=4 1169 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,0,0,0,0|1,0,0]=2 1170 B7R0.5 CC(=O)C(O)CC#N Amb24463934 [0,1,0,0,0,0|3,0,0]=4 1171 B7R0.5 CC(=O)C(O)CCS Amb24516694 [0,1,0,0,0,0|2,1,0]=4 1172 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,1,0,0,0,0|2,0,0]=3 1173 B7R0.5 CC(=O)N(N)CCO Amb18641953 [0,1,0,0,0,0|2,0,0]=3 1174 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [0,1,0,0,0,0|2,0,1]=4 1175 B7R0.5 CC(=O)[C@H](O)CC=C Amb24662420 [0,1,0,0,0,0|3,0,0]=4 1176 B7R0.5 CC(C(=O)C)CCO Amb13881368 [0,1,0,0,0,0|2,0,0]=3 1177 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [0,1,0,0,0,0|2,0,0]=3 1178 B7R0.5 CC(C(=O)O)CNC Amb13952364 [0,1,0,0,0,0|2,0,0]=3 1179 B7R0.5 CC(C)C(N)COC Amb18202679 [0,1,0,0,0,0|2,0,1]=4 1180 B7R0.5 CC(C)C(N)COC Amb21954041 [0,1,0,0,0,0|2,0,1]=4 1181 B7R0.5 CC(C)[C@@H](N)COC Amb18016631 [0,1,0,0,0,0|2,0,1]=4 1182 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [0,1,0,0,0,0|1,0,1]=3 1183 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [0,1,0,0,0,0|2,0,0]=3 1184 B7R0.5 CC(CC=C)C(=O)Cl Amb25702960 [0,1,0,0,0,0|3,0,0]=4 1185 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [0,1,0,0,0,0|3,0,0]=4 1186 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [0,1,0,0,0,0|2,0,1]=4 1187 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [0,1,0,0,0,0|3,0,0]=4 1188 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|3,0,0]=4 1189 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [0,1,0,0,0,0|3,0,0]=4 1190 B7R0.5 CC(CCF)C(O)=O Amb24678386 [0,1,0,0,0,0|2,0,0]=3 1191 B7R0.5 CC(CCN)C(C)=O Amb18251071 [0,1,0,0,0,0|3,0,0]=4 1192 B7R0.5 CC(CCN)C(N)=O Amb18641900 [0,1,0,0,0,0|3,0,0]=4 1193 B7R0.5 CC(CCN)C(O)=O Amb20667970 [0,1,0,0,0,0|2,0,0]=3 1194 B7R0.5 CC(CCO)C(N)=N Amb24615954 [0,1,0,0,0,0|3,0,0]=4 1195 B7R0.5 CC(CCO)C(O)=O Amb18641949 [0,1,0,0,0,0|1,0,0]=2 1196 B7R0.5 CC(CCS)C(O)=O Amb25133689 [0,1,0,0,0,0|1,1,0]=3 1197 B7R0.5 CC(COC)C(C)O Amb24746662 [0,1,0,0,0,0|2,0,1]=4 1198 B7R0.5 CC(O)C(N)CCC Amb24656798 [0,1,0,0,0,0|2,0,1]=4 1199 B7R0.5 CC(O)C(N)COC Amb18124266 [0,1,0,0,0,0|1,0,1]=3 1200 B7R0.5 CC(O)C(O)CCO Amb25851421 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.5 CC(O)C(O)COC Amb24414234 [0,1,0,0,0,0|2,0,1]=4 1202 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.5 CC(O)[C@@H](N)CC=C Amb24367846 [0,1,0,0,0,0|2,0,1]=4 1204 B7R0.5 CC(O)[C@H](N)CC=C Amb25336245 [0,1,0,0,0,0|2,0,1]=4 1205 B7R0.5 CC(SC#N)C(O)=O Amb24372688 [0,1,0,0,0,0|2,0,1]=4 1206 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [0,1,0,0,0,0|2,0,1]=4 1207 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [0,1,0,0,0,0|2,0,1]=4 1208 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [0,1,0,0,0,0|3,0,0]=4 1210 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [0,1,0,0,0,0|3,0,0]=4 1211 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [0,1,0,0,0,0|2,0,0]=3 1212 B7R0.5 CCCC(C(=O)O)O Amb2582532 [0,1,0,0,0,0|2,0,0]=3 1213 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [0,1,0,0,0,0|3,0,0]=4 1214 B7R0.5 CCCC(F)C(O)=O Amb25842008 [0,1,0,0,0,0|2,0,0]=3 1215 B7R0.5 CCCC(N)C(=O)S Amb25378817 [0,1,0,0,0,0|1,1,0]=3 1216 B7R0.5 CCCC(N)C(C)=C Amb24643425 [0,1,0,0,0,0|3,0,0]=4 1217 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,0,0,0,0|2,0,0]=3 1218 B7R0.5 CCCC(N)P(O)O Amb24401110 [0,1,0,0,0,0|2,0,1]=4 1219 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,1,0,0,0,0|3,0,0]=4 1220 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,1,0,0,0,0|3,0,0]=4 1221 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [0,1,0,0,0,0|2,0,1]=4 1222 B7R0.5 CCCC(O)P(O)=O Amb25143218 [0,1,0,0,0,0|3,0,0]=4 1223 B7R0.5 CCCC(S)C(C)=O Amb24689502 [0,1,0,0,0,0|3,0,0]=4 1224 B7R0.5 CCCC(S)C(O)=O Amb18124440 [0,1,0,0,0,0|2,0,0]=3 1225 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [0,1,0,0,0,0|3,0,0]=4 1226 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [0,1,0,0,0,0|3,0,0]=4 1227 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,0,0,0,0|2,0,0]=3 1228 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,0,0,0,0|2,0,0]=3 1229 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [0,1,0,0,0,0|3,0,0]=4 1230 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [0,1,0,0,0,0|2,0,0]=3 1231 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [0,1,0,0,0,0|3,0,0]=4 1232 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [0,1,0,0,0,0|2,0,0]=3 1233 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,1,0,0,0,0|3,0,0]=4 1234 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [0,1,0,0,0,0|3,0,0]=4 1235 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [0,1,0,0,0,0|2,0,0]=3 1236 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [0,1,0,0,0,0|1,0,2]=4 1237 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|3,0,0]=4 1238 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [0,1,0,0,0,0|2,0,0]=3 1239 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [0,1,0,0,0,0|2,0,1]=4 1240 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|2,0,1]=4 1241 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|3,0,0]=4 1242 B7R0.5 CCOC(O)C(C)=O Amb25189063 [0,1,0,0,0,0|3,0,0]=4 1243 B7R0.5 CCOC(O)C(O)=O Amb24680848 [0,1,0,0,0,0|2,0,0]=3 1244 B7R0.5 CCO[C@@H](O)C(C)=O Amb25092956 [0,1,0,0,0,0|3,0,0]=4 1245 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [0,1,0,0,0,0|2,0,0]=3 1246 B7R0.5 CCSC(=S)C(O)=O Amb25210892 [0,1,0,0,0,0|2,0,1]=4 1247 B7R0.5 CCSC(O)C(O)=O Amb24444218 [0,1,0,0,0,0|2,0,0]=3 1248 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [0,1,0,0,0,0|2,0,0]=3 1249 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [0,1,0,0,0,0|2,0,0]=3 1250 B7R0.5 CC\C=C(/N)\C(N)=O Amb25858729 [0,1,0,0,0,0|2,0,1]=4 1251 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [0,1,0,0,0,0|2,0,1]=4 1252 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [0,1,0,0,0,0|2,0,1]=4 1253 B7R0.5 CC\C=C(\N)/C(N)=O Amb24515060 [0,1,0,0,0,0|2,0,1]=4 1254 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [0,1,0,0,0,0|1,0,1]=3 1255 B7R0.5 CNCC(=C)C(O)=O Amb24561619 [0,1,0,0,0,0|2,0,1]=4 1256 B7R0.5 CNCC(C(=O)O)N Amb10071505 [0,1,0,0,0,0|1,0,0]=2 1257 B7R0.5 CNCC(C(=O)O)N Amb10845350 [0,1,0,0,0,0|1,0,0]=2 1258 B7R0.5 CNCC(C)C(C)=O Amb25340555 [0,1,0,0,0,0|3,0,0]=4 1259 B7R0.5 CNCC(F)C(O)=O Amb24666017 [0,1,0,0,0,0|2,0,0]=3 1260 B7R0.5 CNCC(N)C(N)=O Amb25316352 [0,1,0,0,0,0|2,0,0]=3 1261 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [0,1,0,0,0,0|1,0,0]=2 1262 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [0,1,0,0,0,0|1,0,0]=2 1263 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [0,1,0,0,0,0|1,0,0]=2 1264 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [0,1,0,0,0,0|1,0,0]=2 1265 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [0,1,0,0,0,0|1,0,0]=2 1266 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [0,1,0,0,0,0|2,0,0]=3 1267 B7R0.5 CNN=C(N)C(O)=O Amb25684306 [0,1,0,0,0,0|2,0,1]=4 1268 B7R0.5 CNNC(C)C(O)=O Amb24070183 [0,1,0,0,0,0|3,0,0]=4 1269 B7R0.5 COCC(=C)C(N)=O Amb24668981 [0,1,0,0,0,0|2,0,1]=4 1270 B7R0.5 COCC(=O)C(O)=O Amb25304863 [0,1,0,0,0,0|1,0,1]=3 1271 B7R0.5 COCC(Br)C(C)=O Amb24483184 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.5 COCC(Br)C(N)=O Amb24740751 [0,1,0,0,0,0|2,0,0]=3 1273 B7R0.5 COCC(C(=O)O)Br Amb17594709 [0,1,0,0,0,0|1,0,0]=2 1274 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [0,1,0,0,0,0|1,0,0]=2 1275 B7R0.5 COCC(C)B(O)O Amb24561016 [0,1,0,0,0,0|2,0,1]=4 1276 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|2,0,0]=3 1277 B7R0.5 COCC(C)S(O)=O Amb25280974 [0,1,0,0,0,0|2,0,0]=3 1278 B7R0.5 COCC(C)S([O-])=O Amb24481940 [0,1,0,0,0,0|2,0,1]=4 1279 B7R0.5 COCC(Cl)C(C)=O Amb25073897 [0,1,0,0,0,0|2,0,0]=3 1280 B7R0.5 COCC(Cl)C(N)=N Amb22493750 [0,1,0,0,0,0|3,0,0]=4 1281 B7R0.5 COCC(Cl)C(N)=N Amb25269639 [0,1,0,0,0,0|3,0,0]=4 1282 B7R0.5 COCC(F)C(O)=O Amb24526772 [0,1,0,0,0,0|1,0,0]=2 1283 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,0,0,0,0|1,0,0]=2 1284 B7R0.5 COCC(O)C(=C)Cl Amb25662110 [0,1,0,0,0,0|3,0,0]=4 1285 B7R0.5 COCC(O)C(C)=O Amb25072841 [0,1,0,0,0,0|2,0,0]=3 1286 B7R0.5 COCC(O)C(O)=O Amb18124273 [0,1,0,0,0,0|1,0,0]=2 1287 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [0,1,0,0,0,0|1,0,0]=2 1288 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [0,1,0,0,0,0|0,0,0]=1 1289 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [0,1,0,0,0,0|1,0,0]=2 1290 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [0,1,0,0,0,0|0,0,0]=1 1291 B7R0.5 COC[C@H](C(C)C)N Amb17061638 [0,1,0,0,0,0|2,0,1]=4 1292 B7R0.5 CONC(=O)C(O)=O Amb25340523 [0,1,0,0,0,0|2,0,1]=4 1293 B7R0.5 CO\C=C(\Cl)/C(O)=O Amb24385677 [0,1,0,0,0,0|1,0,2]=4 1294 B7R0.5 CO\C=C(\F)/C(O)=O Amb22641708 [0,1,0,0,0,0|1,0,2]=4 1295 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [0,1,0,0,0,0|2,1,0]=4 1296 B7R0.5 CSCC(C)C(C)=O Amb25268934 [0,1,0,0,0,0|2,1,0]=4 1297 B7R0.5 CSCC(C)C(N)=O Amb24475326 [0,1,0,0,0,0|2,1,0]=4 1298 B7R0.5 CSCC(C)C(O)=O Amb18967825 [0,1,0,0,0,0|1,1,0]=3 1299 B7R0.5 CSCC(N)C(C)=C Amb25142968 [0,1,0,0,0,0|2,1,0]=4 1300 B7R0.5 CSCC(N)C(N)=O Amb18294390 [0,1,0,0,0,0|1,1,0]=3 1301 B7R0.5 CSCC(O)C(O)=O Amb25131873 [0,1,0,0,0,0|1,1,0]=3 1302 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [0,1,0,0,0,0|1,1,0]=3 1303 B7R0.5 CSSC(C)C(O)=O Amb25701741 [0,1,0,0,0,0|2,1,0]=4 1304 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [0,1,0,0,0,0|2,0,0]=3 1305 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [0,1,0,0,0,0|2,0,0]=3 1306 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [0,1,0,0,0,0|2,0,0]=3 1307 B7R0.5 C[C@@H](CC=C)C(N)=O Amb25232867 [0,1,0,0,0,0|3,0,0]=4 1308 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [0,1,0,0,0,0|1,1,0]=3 1309 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [0,1,0,0,0,0|1,0,2]=4 1310 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [0,1,0,0,0,0|2,0,0]=3 1311 B7R0.5 C[C@@H](O)C(N)CC=C Amb24332662 [0,1,0,0,0,0|2,0,1]=4 1312 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [0,1,0,0,0,0|2,0,1]=4 1313 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [0,1,0,0,0,0|2,0,1]=4 1314 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [0,1,0,0,0,0|2,0,1]=4 1315 B7R0.5 C[C@@H](O)[C@H](N)COC Amb25304782 [0,1,0,0,0,0|1,0,1]=3 1316 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [0,1,0,0,0,0|2,0,0]=3 1317 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [0,1,0,0,0,0|2,0,0]=3 1318 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [0,1,0,0,0,0|2,0,0]=3 1319 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [0,1,0,0,0,0|2,0,0]=3 1320 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [0,1,0,0,0,0|1,0,0]=2 1321 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [0,1,0,0,0,0|2,0,0]=3 1322 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [0,1,0,0,0,0|1,0,0]=2 1323 B7R0.5 C[C@H](N=[N+]=[N-])C(O)=O Amb25274282 [0,1,0,0,0,0|3,0,0]=4 1324 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [0,1,0,0,0,0|1,0,0]=2 1325 B7R0.5 C[C@H](O)[C@@H](N)CC=C Amb25264318 [0,1,0,0,0,0|2,0,1]=4 1326 B7R0.5 C[C@H](O)[C@@H](N)COC Amb25169361 [0,1,0,0,0,0|1,0,1]=3 1327 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [0,1,0,0,0,0|2,0,1]=4 1328 B7R0.5 C[C@H](O)[C@H](N)CC=C Amb24454742 [0,1,0,0,0,0|2,0,1]=4 1329 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [0,1,0,0,0,0|2,0,1]=4 1330 B7R0.5 C[C@H](SC#N)C(O)=O Amb24333429 [0,1,0,0,0,0|2,0,1]=4 1331 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [0,1,0,0,0,0|1,1,1]=4 1332 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [0,1,0,0,0,0|0,1,0]=2 1333 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [0,1,0,0,0,0|0,1,0]=2 1334 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [0,1,0,0,0,0|0,1,0]=2 1335 B7R0.5 C\C(=C/CBr)\C(O)=O Amb24433947 [0,1,0,0,0,0|2,0,1]=4 1336 B7R0.5 C\C(=C/CCl)\C(O)=O Amb25844891 [0,1,0,0,0,0|2,0,1]=4 1337 B7R0.5 C\C(=C/CO)\C(C)=O Amb25188393 [0,1,0,0,0,0|2,0,1]=4 1338 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [0,1,0,0,0,0|1,0,1]=3 1339 B7R0.5 C\C(=C/OC)\C(O)=O Amb18641867 [0,1,0,0,0,0|1,0,2]=4 1340 B7R0.5 C\C=C/C(N)C(N)=O Amb24679364 [0,1,0,0,0,0|2,0,1]=4 1341 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [0,1,0,0,0,0|2,0,1]=4 1342 B7R0.5 C\C=C\C(N)C(N)=O Amb24515058 [0,1,0,0,0,0|2,0,1]=4 1343 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [0,1,0,0,0,0|1,0,1]=3 1344 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [0,1,0,0,0,0|2,0,1]=4 1345 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [0,1,0,0,0,0|2,0,1]=4 1346 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [0,1,0,0,0,0|2,0,1]=4 1347 B7R0.5 N#CCC(O)C(O)=O Amb25678609 [0,1,0,0,0,0|2,0,0]=3 1348 B7R0.5 NC(=N)N(N)CCO Amb24542574 [0,1,0,0,0,0|3,0,0]=4 1349 B7R0.5 NC(=O)C(Br)CCBr Amb25174083 [0,1,0,0,0,0|3,0,0]=4 1350 B7R0.5 NC(=O)C(O)CCO Amb25703294 [0,1,0,0,0,0|2,0,0]=3 1351 B7R0.5 NC(=O)C(S)CCO Amb24525295 [0,1,0,0,0,0|2,0,0]=3 1352 B7R0.5 NC(=O)N(N)CCO Amb18641972 [0,1,0,0,0,0|2,0,0]=3 1353 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [0,1,0,0,0,0|1,0,0]=2 1354 B7R0.5 NC(CC#N)B(O)O Amb24405139 [0,1,0,0,0,0|2,0,1]=4 1355 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [0,1,0,0,0,0|1,0,0]=2 1356 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [0,1,0,0,0,0|1,0,0]=2 1357 B7R0.5 NC(CCF)C(N)=O Amb24391278 [0,1,0,0,0,0|2,0,0]=3 1358 B7R0.5 NC(CCI)C(O)=O Amb25339674 [0,1,0,0,0,0|1,0,0]=2 1359 B7R0.5 NC(CCO)C(N)=O Amb24481392 [0,1,0,0,0,0|1,0,0]=2 1360 B7R0.5 NC(CCS)C(N)=O Amb24599383 [0,1,0,0,0,0|1,1,0]=3 1361 B7R0.5 NC(CCS)C(O)=O Amb19267093 [0,1,0,0,0,0|0,1,0]=2 1362 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [0,1,0,0,0,0|0,0,1]=2 1363 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [0,1,0,0,0,0|0,1,0]=2 1364 B7R0.5 NC(CSO)C(O)=O Amb24746797 [0,1,0,0,0,0|0,0,0]=1 1365 B7R0.5 NC(CSS)C(O)=O Amb24614616 [0,1,0,0,0,0|0,1,0]=2 1366 B7R0.5 NC(O)C(O)CCO Amb24505849 [0,1,0,0,0,0|2,0,1]=4 1367 B7R0.5 NC(\C=C\Cl)C(O)=O Amb24483058 [0,1,0,0,0,0|1,0,1]=3 1368 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [0,1,0,0,0,0|2,0,1]=4 1369 B7R0.5 NCCC(C(=O)O)F Amb10838221 [0,1,0,0,0,0|2,0,0]=3 1370 B7R0.5 NCCC(C(=O)O)O Amb16232090 [0,1,0,0,0,0|2,0,0]=3 1371 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [0,1,0,0,0,0|2,0,0]=3 1372 B7R0.5 NCCC(F)C(O)=O Amb22229524 [0,1,0,0,0,0|2,0,0]=3 1373 B7R0.5 NCCC(N)C(N)=O Amb24634873 [0,1,0,0,0,0|2,0,0]=3 1374 B7R0.5 NCCC(N)C(O)=O Amb17678762 [0,1,0,0,0,0|1,0,0]=2 1375 B7R0.5 NCCC(N)C(O)=O Amb22348212 [0,1,0,0,0,0|1,0,0]=2 1376 B7R0.5 NCCC(S)C(O)=O Amb25083375 [0,1,0,0,0,0|2,0,0]=3 1377 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [0,1,0,0,0,0|2,0,0]=3 1378 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [0,1,0,0,0,0|2,0,0]=3 1379 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [0,1,0,0,0,0|1,0,0]=2 1380 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [0,1,0,0,0,0|1,0,0]=2 1381 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [0,1,0,0,0,0|2,0,0]=3 1382 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [0,1,0,0,0,0|2,0,0]=3 1383 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [0,1,0,0,0,0|2,0,0]=3 1384 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [0,1,0,0,0,0|1,0,0]=2 1385 B7R0.5 NC\C=C(/Br)\C(O)=O Amb24483175 [0,1,0,0,0,0|2,0,1]=4 1386 B7R0.5 NC\C=C(\Br)/C(O)=O Amb24627030 [0,1,0,0,0,0|2,0,1]=4 1387 B7R0.5 NC\C=C(\Cl)/C(O)=O Amb25231611 [0,1,0,0,0,0|2,0,1]=4 1388 B7R0.5 NOCC(N)C(N)=O Amb24388788 [0,1,0,0,0,0|1,0,0]=2 1389 B7R0.5 NOCC(N)C(O)=O Amb24184086 [0,1,0,0,0,0|0,0,0]=1 1390 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [0,1,0,0,0,0|0,0,0]=1 1391 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [0,1,0,0,0,0|0,0,0]=1 1392 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [0,1,0,0,0,0|1,0,0]=2 1393 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [0,1,0,0,0,0|1,0,0]=2 1394 B7R0.5 N[C@@H](CC#N)B(O)O Amb24397942 [0,1,0,0,0,0|2,0,1]=4 1395 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [0,1,0,0,0,0|0,0,1]=2 1396 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [0,1,0,0,0,0|0,0,1]=2 1397 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [0,1,0,0,0,0|1,0,0]=2 1398 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [0,1,0,0,0,0|0,0,0]=1 1399 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [0,1,0,0,0,0|1,1,0]=3 1400 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [0,1,0,0,0,0|1,1,0]=3 1401 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [0,1,0,0,0,0|0,0,0]=1 1402 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [0,1,0,0,0,0|0,0,0]=1 1403 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [0,1,0,0,0,0|0,1,0]=2 1404 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [0,1,0,0,0,0|0,0,0]=1 1405 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [0,1,0,0,0,0|1,0,0]=2 1406 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [0,1,0,0,0,0|1,0,0]=2 1407 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [0,1,0,0,0,0|1,0,0]=2 1408 B7R0.5 N[C@H](CC#N)B(O)O Amb24615456 [0,1,0,0,0,0|2,0,1]=4 1409 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [0,1,0,0,0,0|0,1,0]=2 1410 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [0,1,0,0,0,0|0,0,0]=1 1411 B7R0.5 N[C@H](\C=C\Cl)C(O)=O Amb25230190 [0,1,0,0,0,0|1,0,1]=3 1412 B7R0.5 O=C(Br)C(Br)CCBr Amb22234970 [0,1,0,0,0,0|3,0,0]=4 1413 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,1,0,0,0,0|3,0,0]=4 1414 B7R0.5 O=C(Cl)C(Cl)CCCl Amb24423919 [0,1,0,0,0,0|3,0,0]=4 1415 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [0,1,0,0,0,0|0,0,1]=2 1416 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [0,1,0,0,0,0|1,0,2]=4 1417 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [0,1,0,0,0,0|2,0,1]=4 1418 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 1419 B7R0.5 OC(=O)C(=O)\C=C\O Amb24699120 [0,1,0,0,0,0|1,0,2]=4 1420 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|2,0,0]=3 1421 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [0,1,0,0,0,0|2,0,0]=3 1422 B7R0.5 OC(=O)C(Cl)=CCBr Amb24621021 [0,1,0,0,0,0|2,0,1]=4 1423 B7R0.5 OC(=O)C(Cl)=CCCl Amb25836746 [0,1,0,0,0,0|2,0,1]=4 1424 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|2,0,0]=3 1425 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [0,1,0,0,0,0|1,1,0]=3 1426 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [0,1,0,0,0,0|1,0,1]=3 1427 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [0,1,0,0,0,0|1,0,1]=3 1428 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [0,1,0,0,0,0|1,0,1]=3 1429 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [0,1,0,0,0,0|1,0,1]=3 1430 B7R0.5 OC(CCS)C(O)=O Amb24586206 [0,1,0,0,0,0|1,1,0]=3 1431 B7R0.5 OC(O)C(O)CCO Amb25806560 [0,1,0,0,0,0|1,0,2]=4 1432 B7R0.5 OCC/C(Br)=C(/O)Br Amb17942926 [0,1,0,0,0,0|2,0,1]=4 1433 B7R0.5 OCCC(C(C)C)N Amb1993950 [0,1,0,0,0,0|2,0,1]=4 1434 B7R0.5 OCCC(O)C(O)=O Amb24689942 [0,1,0,0,0,0|1,0,0]=2 1435 B7R0.5 OCNC(=N)S(O)=O Amb17674108 [0,1,0,0,0,0|1,0,2]=4 1436 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [0,1,0,0,0,0|0,0,0]=1 1437 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [0,1,0,0,0,0|2,0,0]=3 1438 B7R0.5 [N-]=[N+]=NC(O)C(O)=O Amb24374125 [0,1,0,0,0,0|3,0,0]=4 1439 B7R0.10 BrCC(=O)C(=O)OC Amb2455971 [0,1,0,0,0,0|2,0,1]=4 1440 B7R0.10 C#CC(O)C(O)CO Amb24524280 [0,1,0,0,0,0|2,0,1]=4 1441 B7R0.10 C#CC(O)[C@H](N)CO Amb24436532 [0,1,0,0,0,0|1,0,1]=3 1442 B7R0.10 C#C[C@@H](O)[C@H](O)CO Amb24398044 [0,1,0,0,0,0|2,0,1]=4 1443 B7R0.10 C#C[C@H](O)[C@H](O)CO Amb25296536 [0,1,0,0,0,0|2,0,1]=4 1444 B7R0.10 C=CC(=O)C(N)CS Amb25082980 [0,1,0,0,0,0|1,1,0]=3 1445 B7R0.10 C=CC(O)C(O)CO Amb25082759 [0,1,0,0,0,0|2,0,1]=4 1446 B7R0.10 C=CC(O)[C@H](O)CO Amb25716025 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.10 C=C[C@@H](O)[C@@H](N)CO Amb24120616 [0,1,0,0,0,0|1,0,1]=3 1448 B7R0.10 C=C[C@H](O)[C@@H](O)CO Amb25280157 [0,1,0,0,0,0|2,0,1]=4 1449 B7R0.10 CC(=C=C)C(O)CO Amb25144082 [0,1,0,0,0,0|3,0,0]=4 1450 B7R0.10 CC(=NN)C(O)CO Amb25214716 [0,1,0,0,0,0|3,0,0]=4 1451 B7R0.10 CC(C#N)C(=O)NO Amb25106145 [0,1,0,0,0,0|2,0,1]=4 1452 B7R0.10 CC(C#N)C(N)CO Amb25731562 [0,1,0,0,0,0|2,0,1]=4 1453 B7R0.10 CC(C(=O)NC)CN Amb15701296 [0,1,0,0,0,0|3,0,0]=4 1454 B7R0.10 CC(C(=O)NN)CC Amb1124144 [0,1,0,0,0,0|3,0,0]=4 1455 B7R0.10 CC(C(=O)OC)C#N Amb17210509 [0,1,0,0,0,0|2,0,1]=4 1456 B7R0.10 CC(C(=O)OC)CN Amb13952562 [0,1,0,0,0,0|2,0,0]=3 1457 B7R0.10 CC(CC)C(=O)CC Amb22229845 [0,1,0,0,0,0|3,0,0]=4 1458 B7R0.10 CC(CC)C(N)CO Amb19267092 [0,1,0,0,0,0|2,0,1]=4 1459 B7R0.10 CC(CC)[C@@H](N)CO Amb18015117 [0,1,0,0,0,0|2,0,1]=4 1460 B7R0.10 CC(CC)[C@@H](N)CO Amb22800764 [0,1,0,0,0,0|2,0,1]=4 1461 B7R0.10 CC(CCl)C(=O)NO Amb24659587 [0,1,0,0,0,0|2,0,0]=3 1462 B7R0.10 CC(CO)C(=C)CBr Amb25711181 [0,1,0,0,0,0|3,0,0]=4 1463 B7R0.10 CC(CO)C(=C)CO Amb25832740 [0,1,0,0,0,0|2,0,0]=3 1464 B7R0.10 CC(CO)C(=O)C=C Amb25370664 [0,1,0,0,0,0|2,0,0]=3 1465 B7R0.10 CC(CO)C(C)=C=C Amb25699984 [0,1,0,0,0,0|3,0,0]=4 1466 B7R0.10 CC(CO)C(O)C#C Amb25845326 [0,1,0,0,0,0|2,0,1]=4 1467 B7R0.10 CC(CO)C(O)CC Amb24461954 [0,1,0,0,0,0|2,0,1]=4 1468 B7R0.10 CC(CO)C(O)CCl Amb25783961 [0,1,0,0,0,0|2,0,1]=4 1469 B7R0.10 CC(CO)N(C)C=O Amb25803142 [0,1,0,0,0,0|3,0,0]=4 1470 B7R0.10 CC(CO)N(C)N=O Amb25109586 [0,1,0,0,0,0|3,0,0]=4 1471 B7R0.10 CC(CO)N(O)N=O Amb24367422 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.10 CC(OC)C(N)CO Amb24693968 [0,1,0,0,0,0|1,0,1]=3 1473 B7R0.10 CC(OC)C(O)CO Amb25769768 [0,1,0,0,0,0|2,0,1]=4 1474 B7R0.10 CCC(=C)C(=O)OC Amb24469857 [0,1,0,0,0,0|2,0,1]=4 1475 B7R0.10 CCC(=O)C(=C)CO Amb24364209 [0,1,0,0,0,0|2,0,1]=4 1476 B7R0.10 CCC(=O)C(=O)NO Amb25304726 [0,1,0,0,0,0|2,0,1]=4 1477 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,0,0,0,0|2,0,1]=4 1478 B7R0.10 CCC(=O)C(C)CCl Amb25824175 [0,1,0,0,0,0|3,0,0]=4 1479 B7R0.10 CCC(=O)C(C)CN Amb18831500 [0,1,0,0,0,0|3,0,0]=4 1480 B7R0.10 CCC(=O)C(C)CO Amb25371915 [0,1,0,0,0,0|2,0,0]=3 1481 B7R0.10 CCC(=O)C(CC)Cl Amb17593422 [0,1,0,0,0,0|3,0,0]=4 1482 B7R0.10 CCC(=O)C(Cl)CCl Amb25791653 [0,1,0,0,0,0|3,0,0]=4 1483 B7R0.10 CCC(=O)C(N)CC Amb18203255 [0,1,0,0,0,0|2,0,0]=3 1484 B7R0.10 CCC(=O)C(O)CN Amb25835829 [0,1,0,0,0,0|3,0,0]=4 1485 B7R0.10 CCC(=O)C(S)CC Amb25801155 [0,1,0,0,0,0|3,0,0]=4 1486 B7R0.10 CCC(=O)[C@@H](O)CC Amb24724312 [0,1,0,0,0,0|3,0,0]=4 1487 B7R0.10 CCC(=O)[C@@H](O)CO Amb25346866 [0,1,0,0,0,0|2,0,0]=3 1488 B7R0.10 CCC(=O)[C@H](O)CC Amb24333825 [0,1,0,0,0,0|3,0,0]=4 1489 B7R0.10 CCC(=O)[C@H](O)CO Amb24364207 [0,1,0,0,0,0|2,0,0]=3 1490 B7R0.10 CCC(Br)C(=O)C#N Amb24390870 [0,1,0,0,0,0|3,0,0]=4 1491 B7R0.10 CCC(Br)C(=O)CCl Amb24483130 [0,1,0,0,0,0|3,0,0]=4 1492 B7R0.10 CCC(Br)C(=O)NC Amb18181033 [0,1,0,0,0,0|3,0,0]=4 1493 B7R0.10 CCC(Br)C(=O)SC Amb24692936 [0,1,0,0,0,0|2,1,0]=4 1494 B7R0.10 CCC(C(=O)OC)Br Amb1157544 [0,1,0,0,0,0|2,0,0]=3 1495 B7R0.10 CCC(C(=O)OC)N Amb17601372 [0,1,0,0,0,0|1,0,0]=2 1496 B7R0.10 CCC(C(OC)C)N Amb1128200 [0,1,0,0,0,0|2,0,1]=4 1497 B7R0.10 CCC(C)C(=C)C=O Amb18641701 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.10 CCC(C)C(=N)OC Amb20623203 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.10 CCC(C)C(=O)C#C Amb25745951 [0,1,0,0,0,0|3,0,0]=4 1500 B7R0.10 CCC(C)C(=O)C=O Amb24481549 [0,1,0,0,0,0|2,0,1]=4 1501 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [0,1,0,0,0,0|3,0,0]=4 1502 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [0,1,0,0,0,0|3,0,0]=4 1503 B7R0.10 CCC(C)C(=O)CF Amb25736326 [0,1,0,0,0,0|3,0,0]=4 1504 B7R0.10 CCC(C)C(=O)CO Amb24680373 [0,1,0,0,0,0|2,0,0]=3 1505 B7R0.10 CCC(C)C(=O)SC Amb22168284 [0,1,0,0,0,0|2,1,0]=4 1506 B7R0.10 CCC(C)\C(\N)=N\O Amb19516921 [0,1,0,0,0,0|3,0,0]=4 1507 B7R0.10 CCC(C)\C(\N)=N\O Amb22586630 [0,1,0,0,0,0|3,0,0]=4 1508 B7R0.10 CCC(Cl)C(=O)CBr Amb24577526 [0,1,0,0,0,0|3,0,0]=4 1509 B7R0.10 CCC(Cl)C(=O)CCl Amb25265568 [0,1,0,0,0,0|3,0,0]=4 1510 B7R0.10 CCC(Cl)C(=O)NCl Amb24449533 [0,1,0,0,0,0|3,0,0]=4 1511 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [0,1,0,0,0,0|2,0,0]=3 1512 B7R0.10 CCC(Cl)C(=O)OF Amb24483107 [0,1,0,0,0,0|2,0,0]=3 1513 B7R0.10 CCC(Cl)C(C)=NO Amb24661921 [0,1,0,0,0,0|3,0,0]=4 1514 B7R0.10 CCC(F)C(=O)CBr Amb25359543 [0,1,0,0,0,0|3,0,0]=4 1515 B7R0.10 CCC(N)C(=O)NC Amb22587219 [0,1,0,0,0,0|2,0,0]=3 1516 B7R0.10 CCC(N)C(=O)NN Amb18061942 [0,1,0,0,0,0|2,0,0]=3 1517 B7R0.10 CCC(N)C(=O)NO Amb21922881 [0,1,0,0,0,0|1,0,0]=2 1518 B7R0.10 CCC(N)C(=O)OC Amb22349873 [0,1,0,0,0,0|1,0,0]=2 1519 B7R0.10 CCC(N)C(O)CC Amb18641928 [0,1,0,0,0,0|2,0,1]=4 1520 B7R0.10 CCC(N)C(O)CF Amb25727496 [0,1,0,0,0,0|2,0,1]=4 1521 B7R0.10 CCC(O)C(=C)CO Amb25369426 [0,1,0,0,0,0|3,0,0]=4 1522 B7R0.10 CCC(O)C(=N)OC Amb24617831 [0,1,0,0,0,0|3,0,0]=4 1523 B7R0.10 CCC(O)C(=O)C#C Amb25050768 [0,1,0,0,0,0|3,0,0]=4 1524 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [0,1,0,0,0,0|2,0,1]=4 1525 B7R0.10 CCC(O)C(=O)SC Amb25257037 [0,1,0,0,0,0|2,1,0]=4 1526 B7R0.10 CCC(O)C(O)CO Amb24642404 [0,1,0,0,0,0|2,0,1]=4 1527 B7R0.10 CCC(O)[C@H](O)CO Amb24352310 [0,1,0,0,0,0|2,0,1]=4 1528 B7R0.10 CCC(S)C(=O)NN Amb25189705 [0,1,0,0,0,0|3,0,0]=4 1529 B7R0.10 CC[C@@H](C)C(=O)OC Amb24549105 [0,1,0,0,0,0|2,0,0]=3 1530 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb17678825 [0,1,0,0,0,0|2,0,1]=4 1531 B7R0.10 CC[C@@H](N)C(=O)NN Amb24483099 [0,1,0,0,0,0|2,0,0]=3 1532 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [0,1,0,0,0,0|1,0,0]=2 1533 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [0,1,0,0,0,0|1,0,0]=2 1534 B7R0.10 CC[C@@H](N)[C@@H](O)CC Amb25835253 [0,1,0,0,0,0|2,0,1]=4 1535 B7R0.10 CC[C@@H](O)C(=O)OC Amb22746930 [0,1,0,0,0,0|2,0,0]=3 1536 B7R0.10 CC[C@@H](O)[C@@H](N)CO Amb25131931 [0,1,0,0,0,0|1,0,1]=3 1537 B7R0.10 CC[C@@H](O)[C@@H](O)CO Amb24354362 [0,1,0,0,0,0|2,0,1]=4 1538 B7R0.10 CC[C@H](C)C(=C)CO Amb25270604 [0,1,0,0,0,0|3,0,0]=4 1539 B7R0.10 CC[C@H](C)C(=O)C#C Amb25830032 [0,1,0,0,0,0|3,0,0]=4 1540 B7R0.10 CC[C@H](C)C(=O)C=C Amb25052297 [0,1,0,0,0,0|3,0,0]=4 1541 B7R0.10 CC[C@H](C)C(=O)CCl Amb24578496 [0,1,0,0,0,0|3,0,0]=4 1542 B7R0.10 CC[C@H](C)C(=O)NN Amb24423489 [0,1,0,0,0,0|3,0,0]=4 1543 B7R0.10 CC[C@H](F)[C@H](N)CO Amb25197755 [0,1,0,0,0,0|2,0,1]=4 1544 B7R0.10 CC[C@H](N)C(=O)NC Amb25259660 [0,1,0,0,0,0|2,0,0]=3 1545 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [0,1,0,0,0,0|1,0,0]=2 1546 B7R0.10 CC[C@H](N)C(O)CC Amb24683759 [0,1,0,0,0,0|2,0,1]=4 1547 B7R0.10 CC[C@H](N)[C@@H](O)CC Amb24453099 [0,1,0,0,0,0|2,0,1]=4 1548 B7R0.10 CC[C@H](N)[C@H](O)CC Amb25378124 [0,1,0,0,0,0|2,0,1]=4 1549 B7R0.10 CC[C@H](O)[C@@H](N)CO Amb25722027 [0,1,0,0,0,0|1,0,1]=3 1550 B7R0.10 CC[C@H](O)[C@@H](O)CO Amb25024752 [0,1,0,0,0,0|2,0,1]=4 1551 B7R0.10 CN(CO)C(=O)C=C Amb25284221 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.10 CNC(=O)C(=C)CO Amb25145253 [0,1,0,0,0,0|2,0,1]=4 1553 B7R0.10 CNC(=O)C(C#N)N Amb10844809 [0,1,0,0,0,0|2,0,1]=4 1554 B7R0.10 CNC(=O)C(C)CBr Amb24434006 [0,1,0,0,0,0|3,0,0]=4 1555 B7R0.10 CNC(=O)C(C)CCl Amb25306794 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.10 CNC(=O)C(C)CN Amb19929904 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.10 CNC(=O)C(C)CS Amb25117297 [0,1,0,0,0,0|2,1,0]=4 1558 B7R0.10 CNC(=O)C(C)NO Amb25131329 [0,1,0,0,0,0|3,0,0]=4 1559 B7R0.10 CNC(=O)C(N)CO Amb18641958 [0,1,0,0,0,0|1,0,0]=2 1560 B7R0.10 CNC(=O)C(N)CS Amb24729394 [0,1,0,0,0,0|1,1,0]=3 1561 B7R0.10 CNC(=O)[C@@H](C)NO Amb25703163 [0,1,0,0,0,0|3,0,0]=4 1562 B7R0.10 CNC(=O)[C@@H](N)CO Amb22899002 [0,1,0,0,0,0|1,0,0]=2 1563 B7R0.10 CNC(=O)[C@@H](N)CO Amb24120441 [0,1,0,0,0,0|1,0,0]=2 1564 B7R0.10 CNC(=O)[C@@H](N)CS Amb24524250 [0,1,0,0,0,0|1,1,0]=3 1565 B7R0.10 CNC(=O)[C@H](C)NO Amb24659614 [0,1,0,0,0,0|3,0,0]=4 1566 B7R0.10 CNC(=O)[C@H](O)CN Amb25710771 [0,1,0,0,0,0|3,0,0]=4 1567 B7R0.10 CNC(=O)\C(\N)=N/O Amb19517087 [0,1,0,0,0,0|2,0,1]=4 1568 B7R0.10 CNC(=O)\C(\N)=N\O Amb19651443 [0,1,0,0,0,0|2,0,1]=4 1569 B7R0.10 CNC(C)C(=O)OC Amb18299580 [0,1,0,0,0,0|3,0,0]=4 1570 B7R0.10 CNC(C)C(=O)OC Amb21961535 [0,1,0,0,0,0|3,0,0]=4 1571 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [0,1,0,0,0,0|3,0,0]=4 1572 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [0,1,0,0,0,0|3,0,0]=4 1573 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [0,1,0,0,0,0|3,0,0]=4 1574 B7R0.10 COC(=N)C(N)C=O Amb25340734 [0,1,0,0,0,0|1,0,2]=4 1575 B7R0.10 COC(=O)C(/C)=C\O Amb17778951 [0,1,0,0,0,0|1,0,2]=4 1576 B7R0.10 COC(=O)C(=C)CCl Amb19958340 [0,1,0,0,0,0|2,0,1]=4 1577 B7R0.10 COC(=O)C(=C)CO Amb17933844 [0,1,0,0,0,0|1,0,1]=3 1578 B7R0.10 COC(=O)C(Br)C#N Amb18128032 [0,1,0,0,0,0|2,0,1]=4 1579 B7R0.10 COC(=O)C(Br)C=C Amb24483227 [0,1,0,0,0,0|2,0,1]=4 1580 B7R0.10 COC(=O)C(Br)CO Amb22491520 [0,1,0,0,0,0|1,0,0]=2 1581 B7R0.10 COC(=O)C(Br)CS Amb25831266 [0,1,0,0,0,0|1,1,0]=3 1582 B7R0.10 COC(=O)C(Br)OC Amb21964964 [0,1,0,0,0,0|3,0,0]=4 1583 B7R0.10 COC(=O)C(C)C#C Amb20171370 [0,1,0,0,0,0|2,0,1]=4 1584 B7R0.10 COC(=O)C(C)C=O Amb18641861 [0,1,0,0,0,0|1,0,2]=4 1585 B7R0.10 COC(=O)C(C)CBr Amb23440928 [0,1,0,0,0,0|2,0,0]=3 1586 B7R0.10 COC(=O)C(C)CI Amb25114121 [0,1,0,0,0,0|2,0,0]=3 1587 B7R0.10 COC(=O)C(C)CS Amb17673607 [0,1,0,0,0,0|1,1,0]=3 1588 B7R0.10 COC(=O)C(C)NN Amb24367186 [0,1,0,0,0,0|3,0,0]=4 1589 B7R0.10 COC(=O)C(C)SC Amb22043309 [0,1,0,0,0,0|3,0,0]=4 1590 B7R0.10 COC(=O)C(C=O)Cl Amb17621536 [0,1,0,0,0,0|1,0,2]=4 1591 B7R0.10 COC(=O)C(CCl)N Amb1019565 [0,1,0,0,0,0|1,0,0]=2 1592 B7R0.10 COC(=O)C(CCl)N Amb10601654 [0,1,0,0,0,0|1,0,0]=2 1593 B7R0.10 COC(=O)C(CF)Br Amb10605572 [0,1,0,0,0,0|2,0,0]=3 1594 B7R0.10 COC(=O)C(CO)Cl Amb10605503 [0,1,0,0,0,0|1,0,0]=2 1595 B7R0.10 COC(=O)C(Cl)=CO Amb25847918 [0,1,0,0,0,0|1,0,2]=4 1596 B7R0.10 COC(=O)C(Cl)=NO Amb25082179 [0,1,0,0,0,0|2,0,1]=4 1597 B7R0.10 COC(=O)C(Cl)C#C Amb24391495 [0,1,0,0,0,0|2,0,1]=4 1598 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [0,1,0,0,0,0|3,0,0]=4 1599 B7R0.10 COC(=O)C(F)CCl Amb22735421 [0,1,0,0,0,0|2,0,0]=3 1600 B7R0.10 COC(=O)C(F)CF Amb25246790 [0,1,0,0,0,0|2,0,0]=3 1601 B7R0.10 COC(=O)C(F)CN Amb25241379 [0,1,0,0,0,0|2,0,0]=3 1602 B7R0.10 COC(=O)C(F)CO Amb22235114 [0,1,0,0,0,0|1,0,0]=2 1603 B7R0.10 COC(=O)C(I)CN Amb25189042 [0,1,0,0,0,0|2,0,0]=3 1604 B7R0.10 COC(=O)C(N)=NN Amb25244637 [0,1,0,0,0,0|2,0,1]=4 1605 B7R0.10 COC(=O)C(N)C#N Amb23400152 [0,1,0,0,0,0|1,0,1]=3 1606 B7R0.10 COC(=O)C(N)C#N Amb23402903 [0,1,0,0,0,0|1,0,1]=3 1607 B7R0.10 COC(=O)C(N)C#N Amb23437075 [0,1,0,0,0,0|1,0,1]=3 1608 B7R0.10 COC(=O)C(N)C=C Amb24427259 [0,1,0,0,0,0|1,0,1]=3 1609 B7R0.10 COC(=O)C(N)CBr Amb25701710 [0,1,0,0,0,0|1,0,0]=2 1610 B7R0.10 COC(=O)C(N)CF Amb24482199 [0,1,0,0,0,0|1,0,0]=2 1611 B7R0.10 COC(=O)C(N)CN Amb18641956 [0,1,0,0,0,0|1,0,0]=2 1612 B7R0.10 COC(=O)C(N)CO Amb22489451 [0,1,0,0,0,0|0,0,0]=1 1613 B7R0.10 COC(=O)C(N)OC Amb24401525 [0,1,0,0,0,0|2,0,0]=3 1614 B7R0.10 COC(=O)C(O)C#N Amb23596490 [0,1,0,0,0,0|2,0,1]=4 1615 B7R0.10 COC(=O)C(O)C=C Amb22734006 [0,1,0,0,0,0|2,0,1]=4 1616 B7R0.10 COC(=O)C(O)CBr Amb25757463 [0,1,0,0,0,0|2,0,0]=3 1617 B7R0.10 COC(=O)C(O)CCl Amb22261563 [0,1,0,0,0,0|2,0,0]=3 1618 B7R0.10 COC(=O)C(O)CF Amb25734186 [0,1,0,0,0,0|2,0,0]=3 1619 B7R0.10 COC(=O)C(O)CN Amb22058759 [0,1,0,0,0,0|2,0,0]=3 1620 B7R0.10 COC(=O)C(O)SC Amb24362213 [0,1,0,0,0,0|3,0,0]=4 1621 B7R0.10 COC(=O)C(OC)O Amb17593224 [0,1,0,0,0,0|3,0,0]=4 1622 B7R0.10 COC(=O)C(S)CCl Amb24469139 [0,1,0,0,0,0|2,0,0]=3 1623 B7R0.10 COC(=O)C(S)CN Amb25271434 [0,1,0,0,0,0|2,0,0]=3 1624 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [0,1,0,0,0,0|1,0,2]=4 1625 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [0,1,0,0,0,0|2,0,0]=3 1626 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [0,1,0,0,0,0|2,0,0]=3 1627 B7R0.10 COC(=O)[C@@H](C)NN Amb24117928 [0,1,0,0,0,0|3,0,0]=4 1628 B7R0.10 COC(=O)[C@@H](C)NN Amb24377162 [0,1,0,0,0,0|3,0,0]=4 1629 B7R0.10 COC(=O)[C@@H](CCl)N Amb10601655 [0,1,0,0,0,0|1,0,0]=2 1630 B7R0.10 COC(=O)[C@@H](Cl)CO Amb24739681 [0,1,0,0,0,0|1,0,0]=2 1631 B7R0.10 COC(=O)[C@@H](F)CN Amb24505312 [0,1,0,0,0,0|2,0,0]=3 1632 B7R0.10 COC(=O)[C@@H](N)C=C Amb25127988 [0,1,0,0,0,0|1,0,1]=3 1633 B7R0.10 COC(=O)[C@@H](N)CCl Amb24099304 [0,1,0,0,0,0|1,0,0]=2 1634 B7R0.10 COC(=O)[C@@H](N)CF Amb24600133 [0,1,0,0,0,0|1,0,0]=2 1635 B7R0.10 COC(=O)[C@@H](O)C#C Amb25682181 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.10 COC(=O)[C@@H](O)CBr Amb24529091 [0,1,0,0,0,0|2,0,0]=3 1637 B7R0.10 COC(=O)[C@@H](O)CN Amb24670217 [0,1,0,0,0,0|2,0,0]=3 1638 B7R0.10 COC(=O)[C@@H](O)CO Amb22226736 [0,1,0,0,0,0|1,0,0]=2 1639 B7R0.10 COC(=O)[C@H](C)CN Amb25317379 [0,1,0,0,0,0|2,0,0]=3 1640 B7R0.10 COC(=O)[C@H](C)NN Amb25115282 [0,1,0,0,0,0|3,0,0]=4 1641 B7R0.10 COC(=O)[C@H](C)ON Amb24439736 [0,1,0,0,0,0|3,0,0]=4 1642 B7R0.10 COC(=O)[C@H](CCl)N Amb10608842 [0,1,0,0,0,0|1,0,0]=2 1643 B7R0.10 COC(=O)[C@H](N)C=C Amb24376395 [0,1,0,0,0,0|1,0,1]=3 1644 B7R0.10 COC(=O)[C@H](N)CCl Amb25261480 [0,1,0,0,0,0|1,0,0]=2 1645 B7R0.10 COC(=O)[C@H](N)CF Amb24351631 [0,1,0,0,0,0|1,0,0]=2 1646 B7R0.10 COC(=O)[C@H](O)CBr Amb25783921 [0,1,0,0,0,0|2,0,0]=3 1647 B7R0.10 COC(=O)[C@H](O)CN Amb24073731 [0,1,0,0,0,0|2,0,0]=3 1648 B7R0.10 COC(=O)[C@H](O)CS Amb25098943 [0,1,0,0,0,0|1,1,0]=3 1649 B7R0.10 COC(=O)\C(\Cl)=N/O Amb24665681 [0,1,0,0,0,0|2,0,1]=4 1650 B7R0.10 COC(=O)\C(\Cl)=N\O Amb22741121 [0,1,0,0,0,0|2,0,1]=4 1651 B7R0.10 COC(=O)\C(\N)=N\O Amb22741276 [0,1,0,0,0,0|1,0,1]=3 1652 B7R0.10 COC(O)C(O)CO Amb24474148 [0,1,0,0,0,0|1,0,2]=4 1653 B7R0.10 CSC(=O)C(O)CO Amb25051310 [0,1,0,0,0,0|1,1,0]=3 1654 B7R0.10 C[C@@H](C(=O)OC)CBr Amb10844721 [0,1,0,0,0,0|2,0,0]=3 1655 B7R0.10 C[C@@H](C(=O)OC)CO Amb17615446 [0,1,0,0,0,0|1,0,0]=2 1656 B7R0.10 C[C@@H](CC)C(=O)CC Amb25735825 [0,1,0,0,0,0|3,0,0]=4 1657 B7R0.10 C[C@@H](CO)[C@H](O)CC Amb24361979 [0,1,0,0,0,0|2,0,1]=4 1658 B7R0.10 C[C@@H](OC)[C@H](N)CO Amb25221786 [0,1,0,0,0,0|1,0,1]=3 1659 B7R0.10 C[C@H](C(=O)OC)CO Amb17615445 [0,1,0,0,0,0|1,0,0]=2 1660 B7R0.10 C[C@H](C=O)[C@@H](C)CO Amb24418439 [0,1,0,0,0,0|2,0,1]=4 1661 B7R0.10 C[C@H](CC)[C@H](N)CO Amb25081749 [0,1,0,0,0,0|2,0,1]=4 1662 B7R0.10 C[C@H](CO)[C@@H](O)C=C Amb25801976 [0,1,0,0,0,0|2,0,1]=4 1663 B7R0.10 C[C@H](CO)[C@H](O)CC Amb24398245 [0,1,0,0,0,0|2,0,1]=4 1664 B7R0.10 C[C@H](CO)[C@H](O)CO Amb25357327 [0,1,0,0,0,0|1,0,2]=4 1665 B7R0.10 C\C(=N/O)\C(=O)CO Amb24676551 [0,1,0,0,0,0|2,0,1]=4 1666 B7R0.10 C\C=C(/N)\C(=O)OC Amb25684543 [0,1,0,0,0,0|1,0,2]=4 1667 B7R0.10 C\C=C(\C)/C(F)CO Amb24748492 [0,1,0,0,0,0|3,0,0]=4 1668 B7R0.10 C\C=C(\C)/C(O)CO Amb25284457 [0,1,0,0,0,0|3,0,0]=4 1669 B7R0.10 C\C=C(\C)/[C@@H](O)CO Amb25769225 [0,1,0,0,0,0|3,0,0]=4 1670 B7R0.10 C\C=C(\C)/[C@H](O)CO Amb24472342 [0,1,0,0,0,0|3,0,0]=4 1671 B7R0.10 N#CC(O)C(O)CO Amb24475331 [0,1,0,0,0,0|2,0,1]=4 1672 B7R0.10 N#C[C@@H](O)[C@H](O)CO Amb25092056 [0,1,0,0,0,0|2,0,1]=4 1673 B7R0.10 N=C(NO)C(O)CO Amb25090215 [0,1,0,0,0,0|2,0,0]=3 1674 B7R0.10 NC(CO)C(=O)NO Amb22352399 [0,1,0,0,0,0|0,0,0]=1 1675 B7R0.10 NC(CO)C(=O)OBr Amb25102550 [0,1,0,0,0,0|0,0,0]=1 1676 B7R0.10 NC(CO)C(N)CO Amb24743310 [0,1,0,0,0,0|1,0,1]=3 1677 B7R0.10 NC(CO)C(O)CI Amb25680864 [0,1,0,0,0,0|1,0,1]=3 1678 B7R0.10 NC(CO)C(O)CO Amb18641994 [0,1,0,0,0,0|0,0,2]=3 1679 B7R0.10 NCC(O)C(O)CO Amb25775606 [0,1,0,0,0,0|2,0,1]=4 1680 B7R0.10 N[C@@H](CCl)C(=O)NO Amb22747830 [0,1,0,0,0,0|1,0,0]=2 1681 B7R0.10 N[C@@H](CO)C(=O)OBr Amb24665775 [0,1,0,0,0,0|0,0,0]=1 1682 B7R0.10 N[C@@H](CO)[C@@H](O)CO Amb25772184 [0,1,0,0,0,0|0,0,2]=3 1683 B7R0.10 N[C@H](C(=O)NN)CS Amb16231457 [0,1,0,0,0,0|1,1,0]=3 1684 B7R0.10 N[C@H](CO)C(=O)NO Amb24555900 [0,1,0,0,0,0|0,0,0]=1 1685 B7R0.10 N[C@H](CO)[C@H](O)CI Amb24476586 [0,1,0,0,0,0|1,0,1]=3 1686 B7R0.10 N[C@H](CO)[C@H](O)CO Amb25809433 [0,1,0,0,0,0|0,0,2]=3 1687 B7R0.10 OC(CO)C(Br)CO Amb25376569 [0,1,0,0,0,0|1,0,2]=4 1688 B7R0.10 OCC(C(CO)C)C Amb17593215 [0,1,0,0,0,0|2,0,1]=4 1689 B7R0.10 OCC(O)C(O)=NO Amb25687962 [0,1,0,0,0,0|1,0,1]=3 1690 B7R0.10 OCC(O)C(O)CCl Amb25683508 [0,1,0,0,0,0|2,0,1]=4 1691 B7R0.10 OCC(O)[C@H](O)C=O Amb25733091 [0,1,0,0,0,0|1,0,1]=3 1692 B7R0.10 OC[C@@H](O)C(O)C=O Amb24481538 [0,1,0,0,0,0|1,0,1]=3 1693 B7R0.10 OC[C@@H](O)[C@H](O)C=O Amb22746428 [0,1,0,0,0,0|1,0,1]=3 1694 B7R0.10 OC[C@@H](S)[C@H](S)CO Amb25810678 [0,1,0,0,0,0|1,1,1]=4 1695 B7R0.10 OC[C@H](Cl)[C@@H](Cl)CO Amb24483150 [0,1,0,0,0,0|2,0,1]=4 1696 B7R0.10 OC[C@H](F)[C@H](F)CO Amb24505181 [0,1,0,0,0,0|2,0,1]=4 1697 B7R0.10 OC[C@H](O)[C@@H](O)C=O Amb24481533 [0,1,0,0,0,0|1,0,1]=3 1698 B7R0.10 OC[C@H](O)[C@H](O)C=O Amb25839823 [0,1,0,0,0,0|1,0,1]=3 1699 B7R0.10 ONC(=O)C(Cl)CCl Amb24618974 [0,1,0,0,0,0|2,0,0]=3 1700 B7R0.10 ONC(\C(=N/O)\C)C Amb2226895 [0,1,0,0,0,0|3,0,0]=4 1701 B7R0.10 O[C@@H](CO)C(=O)CO Amb22337027 [0,1,0,0,0,0|1,0,0]=2 1702 B7R0.10 O[C@@H](CO)C(O)CO Amb25682221 [0,1,0,0,0,0|1,0,2]=4 1703 B7R0.10 O[C@@H](CO)[C@H](Br)CO Amb25359607 [0,1,0,0,0,0|1,0,2]=4 1704 B7R0.10 O[C@H](CO)C(=O)CO Amb24628483 [0,1,0,0,0,0|1,0,0]=2 1705 B7R0.10 O[C@H](CO)[C@@H](S)CO Amb24407455 [0,1,0,0,0,0|1,0,2]=4 1706 B7R0.10 O[C@H](CO)[C@H](O)CO Amb20242423 [0,1,0,0,0,0|1,0,2]=4 1707 B7R0.10 O\N=C(\C(=N\O)\C)/N Amb16229981 [0,1,0,0,0,0|2,0,1]=4 1708 B7R0.10 O\N=C(\C(=N\O)\N)/N Amb1086365 [0,1,0,0,0,0|2,0,1]=4 1709 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC Amb25175826 [0,1,0,0,0,0|3,0,0]=4 1710 B7R0.13 C([2H])(C(=O)O)(ON)[2H] Amb17610567 [0,1,0,0,0,0|3,0,0]=4 1711 B7R0.13 C=SC(O)(O)C(O)=O Amb25716067 [0,1,0,0,0,0|3,0,0]=4 1712 B7R0.13 CC(=C)C(C)(F)CO Amb25761332 [0,1,0,0,0,0|3,0,0]=4 1713 B7R0.13 CC(=C)C(C)(N)CS Amb18642863 [0,1,0,0,0,0|2,1,0]=4 1714 B7R0.13 CC(=O)C(C)(C)CN Amb25253798 [0,1,0,0,0,0|3,0,0]=4 1715 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [0,1,0,0,0,0|2,0,0]=3 1716 B7R0.13 CC(=O)C(C)(C)NO Amb22734768 [0,1,0,0,0,0|3,0,0]=4 1717 B7R0.13 CC(=O)C(C)(C)NO Amb25322857 [0,1,0,0,0,0|3,0,0]=4 1718 B7R0.13 CC(=O)C(C)(Cl)CBr Amb24692951 [0,1,0,0,0,0|3,0,0]=4 1719 B7R0.13 CC(=O)C(C)(Cl)CO Amb24752373 [0,1,0,0,0,0|2,0,0]=3 1720 B7R0.13 CC(=O)C(C)(N)CO Amb25765120 [0,1,0,0,0,0|1,0,0]=2 1721 B7R0.13 CC(=O)C(C)(O)CCl Amb25794165 [0,1,0,0,0,0|3,0,0]=4 1722 B7R0.13 CC(=O)C(C)(O)NO Amb25231984 [0,1,0,0,0,0|3,0,0]=4 1723 B7R0.13 CC(=O)C(Cl)(Cl)CO Amb24601361 [0,1,0,0,0,0|2,0,0]=3 1724 B7R0.13 CC(=O)C(F)(F)CBr Amb25286601 [0,1,0,0,0,0|3,0,0]=4 1725 B7R0.13 CC(=O)C(F)(F)CO Amb25724409 [0,1,0,0,0,0|2,0,0]=3 1726 B7R0.13 CC(Br)(CO)[N+]([O-])=O Amb22002172 [0,1,0,0,0,0|2,0,1]=4 1727 B7R0.13 CC(C(=O)N)(CC)N Amb13952193 [0,1,0,0,0,0|2,0,0]=3 1728 B7R0.13 CC(C(=O)O)(CC)N Amb2235200 [0,1,0,0,0,0|1,0,0]=2 1729 B7R0.13 CC(C)(C=O)C(O)=O Amb25260968 [0,1,0,0,0,0|1,0,2]=4 1730 B7R0.13 CC(C)(CBr)C(=O)Cl Amb25320872 [0,1,0,0,0,0|3,0,0]=4 1731 B7R0.13 CC(C)(CBr)C(N)=O Amb24635645 [0,1,0,0,0,0|3,0,0]=4 1732 B7R0.13 CC(C)(CF)C(O)=O Amb22000679 [0,1,0,0,0,0|2,0,0]=3 1733 B7R0.13 CC(C)(CN)C(N)=O Amb23402034 [0,1,0,0,0,0|3,0,0]=4 1734 B7R0.13 CC(C)(CN)C(O)=O Amb22371031 [0,1,0,0,0,0|2,0,0]=3 1735 B7R0.13 CC(C)(CO)C(N)=N Amb25337772 [0,1,0,0,0,0|3,0,0]=4 1736 B7R0.13 CC(C)(CO)[N+]([O-])=O Amb21520421 [0,1,0,0,0,0|2,0,1]=4 1737 B7R0.13 CC(C)(NCl)C(O)=O Amb25698269 [0,1,0,0,0,0|3,0,0]=4 1738 B7R0.13 CC(C)(NO)C(O)=O Amb24407386 [0,1,0,0,0,0|2,0,0]=3 1739 B7R0.13 CC(C)(ON)C(O)=O Amb18641969 [0,1,0,0,0,0|3,0,0]=4 1740 B7R0.13 CC(C)(O[NH3+])C(O)=O Amb22167603 [0,1,0,0,0,0|3,0,0]=4 1741 B7R0.13 CC(C)C(C)(N)CO Amb18286211 [0,1,0,0,0,0|2,0,1]=4 1742 B7R0.13 CC(C)[C@@](C)(N)CO Amb22503794 [0,1,0,0,0,0|2,0,1]=4 1743 B7R0.13 CC(C)[C@](C)(N)CO Amb22503795 [0,1,0,0,0,0|2,0,1]=4 1744 B7R0.13 CC(Cl)(C#C)C(O)=O Amb25771733 [0,1,0,0,0,0|2,0,1]=4 1745 B7R0.13 CC(Cl)(CCl)C(N)=O Amb24481419 [0,1,0,0,0,0|3,0,0]=4 1746 B7R0.13 CC(Cl)(CCl)C([O-])=O Amb22730332 [0,1,0,0,0,0|2,0,1]=4 1747 B7R0.13 CC(F)(CCl)C(=O)Cl Amb24351071 [0,1,0,0,0,0|3,0,0]=4 1748 B7R0.13 CC(F)(CF)C(O)=O Amb24545976 [0,1,0,0,0,0|2,0,0]=3 1749 B7R0.13 CC(N)(C#C)C(O)=O Amb23504061 [0,1,0,0,0,0|1,0,1]=3 1750 B7R0.13 CC(N)(C=C)C(O)=O Amb18641826 [0,1,0,0,0,0|1,0,1]=3 1751 B7R0.13 CC(N)(CN)C(O)=O Amb25310586 [0,1,0,0,0,0|1,0,0]=2 1752 B7R0.13 CC(N)(CS)C(O)=O Amb18124446 [0,1,0,0,0,0|0,1,0]=2 1753 B7R0.13 CC(N)(CS)C(O)=O Amb24480151 [0,1,0,0,0,0|0,1,0]=2 1754 B7R0.13 CC(O)(C#C)C(O)=O Amb25071834 [0,1,0,0,0,0|2,0,1]=4 1755 B7R0.13 CC(O)(CBr)C(=O)Cl Amb24483059 [0,1,0,0,0,0|3,0,0]=4 1756 B7R0.13 CC(O)(CBr)C(N)=O Amb25108659 [0,1,0,0,0,0|3,0,0]=4 1757 B7R0.13 CC(O)(CBr)C(O)=O Amb18522184 [0,1,0,0,0,0|2,0,0]=3 1758 B7R0.13 CC(O)(CCl)C(N)=O Amb25198321 [0,1,0,0,0,0|3,0,0]=4 1759 B7R0.13 CC(O)(CN)C(O)=O Amb25378699 [0,1,0,0,0,0|2,0,0]=3 1760 B7R0.13 CC(O)(CO)C(O)=O Amb22270195 [0,1,0,0,0,0|1,0,0]=2 1761 B7R0.13 CC(O)(NO)C(O)=O Amb24482657 [0,1,0,0,0,0|2,0,0]=3 1762 B7R0.13 CC(O)C(C)(F)CO Amb25745843 [0,1,0,0,0,0|2,0,1]=4 1763 B7R0.13 CC(O)C(C)(N)CO Amb24483101 [0,1,0,0,0,0|1,0,1]=3 1764 B7R0.13 CC(O)C(C)(O)CO Amb24642681 [0,1,0,0,0,0|2,0,1]=4 1765 B7R0.13 CC(S)(C#N)C(O)=O Amb25134394 [0,1,0,0,0,0|2,0,1]=4 1766 B7R0.13 CCC(C(=O)C)(O)C Amb17593200 [0,1,0,0,0,0|3,0,0]=4 1767 B7R0.13 CCC(C(=O)O)(F)F Amb10982488 [0,1,0,0,0,0|2,0,0]=3 1768 B7R0.13 CCC(C)(Br)C(=O)Br Amb24061144 [0,1,0,0,0,0|3,0,0]=4 1769 B7R0.13 CCC(C)(Br)C(=O)Cl Amb25127778 [0,1,0,0,0,0|3,0,0]=4 1770 B7R0.13 CCC(C)(Br)C(C)=O Amb24570848 [0,1,0,0,0,0|3,0,0]=4 1771 B7R0.13 CCC(C)(Br)C(N)=O Amb25111192 [0,1,0,0,0,0|3,0,0]=4 1772 B7R0.13 CCC(C)(Br)C(O)=O Amb22228657 [0,1,0,0,0,0|2,0,0]=3 1773 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [0,1,0,0,0,0|2,1,0]=4 1774 B7R0.13 CCC(C)(Cl)C(C)=O Amb24434571 [0,1,0,0,0,0|3,0,0]=4 1775 B7R0.13 CCC(C)(Cl)C(O)=O Amb25730682 [0,1,0,0,0,0|2,0,0]=3 1776 B7R0.13 CCC(C)(F)C(O)=O Amb24481385 [0,1,0,0,0,0|2,0,0]=3 1777 B7R0.13 CCC(C)(N)C(C)=O Amb25857157 [0,1,0,0,0,0|2,0,0]=3 1778 B7R0.13 CCC(C)(N)C(N)=N Amb25835758 [0,1,0,0,0,0|3,0,0]=4 1779 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,0,0,0,0|2,0,0]=3 1780 B7R0.13 CCC(C)(N)C(N)=S Amb24387902 [0,1,0,0,0,0|2,1,0]=4 1781 B7R0.13 CCC(C)(N)P(O)=O Amb24505272 [0,1,0,0,0,0|2,0,0]=3 1782 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,0,0,0,0|3,0,0]=4 1783 B7R0.13 CCC(Cl)(Cl)C(C)=O Amb25714198 [0,1,0,0,0,0|3,0,0]=4 1784 B7R0.13 CCC(Cl)(Cl)C(O)=O Amb25274946 [0,1,0,0,0,0|2,0,0]=3 1785 B7R0.13 CCC(F)(Cl)C(C)=O Amb24575964 [0,1,0,0,0,0|3,0,0]=4 1786 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [0,1,0,0,0,0|3,0,0]=4 1787 B7R0.13 CCC(F)(F)C([O-])=O Amb19889420 [0,1,0,0,0,0|2,0,1]=4 1788 B7R0.13 CCC(O)(O)C(N)=O Amb24419277 [0,1,0,0,0,0|3,0,0]=4 1789 B7R0.13 CC[C@@](C)(N)C(O)=O Amb19929605 [0,1,0,0,0,0|1,0,0]=2 1790 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [0,1,0,0,0,0|3,0,0]=4 1791 B7R0.13 CC[C@@](C)(O)C(N)=O Amb24668764 [0,1,0,0,0,0|3,0,0]=4 1792 B7R0.13 CC[C@@](C)(O)C([O-])=O Amb17772231 [0,1,0,0,0,0|2,0,1]=4 1793 B7R0.13 CC[C@](C)(Cl)C(O)=O Amb24402244 [0,1,0,0,0,0|2,0,0]=3 1794 B7R0.13 CNC(C)(F)C(O)=O Amb25225635 [0,1,0,0,0,0|3,0,0]=4 1795 B7R0.13 CN[C@@](C)(F)C(O)=O Amb25697457 [0,1,0,0,0,0|3,0,0]=4 1796 B7R0.13 CN[C@](C)(F)C(O)=O Amb25085415 [0,1,0,0,0,0|3,0,0]=4 1797 B7R0.13 COC(C)(N)C(C)=O Amb24608852 [0,1,0,0,0,0|3,0,0]=4 1798 B7R0.13 COC(C)(S)C(O)=O Amb25201636 [0,1,0,0,0,0|3,0,0]=4 1799 B7R0.13 CSC(C(=O)O)(C)C Amb17501488 [0,1,0,0,0,0|3,0,0]=4 1800 B7R0.13 CSC(F)(F)C(O)=O Amb23586472 [0,1,0,0,0,0|3,0,0]=4 1801 B7R0.13 C[C@@](C(=O)O)(CC)N Amb16183896 [0,1,0,0,0,0|1,0,0]=2 1802 B7R0.13 C[C@@](C(=O)O)(CC)O Amb10067076 [0,1,0,0,0,0|2,0,0]=3 1803 B7R0.13 C[C@@](N)(CF)C(O)=O Amb25169596 [0,1,0,0,0,0|1,0,0]=2 1804 B7R0.13 C[C@@](N)(CS)C(O)=O Amb22757501 [0,1,0,0,0,0|0,1,0]=2 1805 B7R0.13 C[C@@](O)(CN)C(O)=O Amb24698181 [0,1,0,0,0,0|2,0,0]=3 1806 B7R0.13 C[C@H](O)[C@@](C)(O)CO Amb24333575 [0,1,0,0,0,0|2,0,1]=4 1807 B7R0.13 C[C@H](O)[C@](C)(F)CO Amb24474590 [0,1,0,0,0,0|2,0,1]=4 1808 B7R0.13 C[C@H](O)[C@](C)(O)CO Amb25832648 [0,1,0,0,0,0|2,0,1]=4 1809 B7R0.13 C[C@](C(=O)O)(CBr)O Amb17610012 [0,1,0,0,0,0|2,0,0]=3 1810 B7R0.13 C[C@](C(=O)O)(CC)O Amb10067075 [0,1,0,0,0,0|2,0,0]=3 1811 B7R0.13 C[C@](C(=O)O)(CS)N Amb16183893 [0,1,0,0,0,0|0,1,0]=2 1812 B7R0.13 C[C@](F)(CN)C(O)=O Amb25110675 [0,1,0,0,0,0|2,0,0]=3 1813 B7R0.13 C[C@](N)(C#C)C(O)=O Amb24406693 [0,1,0,0,0,0|1,0,1]=3 1814 B7R0.13 C[C@](N)(C=C)C(O)=O Amb24481465 [0,1,0,0,0,0|1,0,1]=3 1815 B7R0.13 C[C@](N)(CF)C(O)=O Amb25775618 [0,1,0,0,0,0|1,0,0]=2 1816 B7R0.13 C[C@](N)(CN)C(O)=O Amb25690446 [0,1,0,0,0,0|1,0,0]=2 1817 B7R0.13 C[C@](N)(CS)C(O)=O Amb22388665 [0,1,0,0,0,0|0,1,0]=2 1818 B7R0.13 C[C@](N)(CS)C(O)=O Amb24053489 [0,1,0,0,0,0|0,1,0]=2 1819 B7R0.13 C[C@](O)(C=C)C(O)=O Amb24556886 [0,1,0,0,0,0|2,0,1]=4 1820 B7R0.13 C[C@](O)(CBr)C(=O)Cl Amb25824129 [0,1,0,0,0,0|3,0,0]=4 1821 B7R0.13 C[C@](O)(CBr)C(O)=O Amb22224875 [0,1,0,0,0,0|2,0,0]=3 1822 B7R0.13 C[C@](O)(CO)C(O)=O Amb25173833 [0,1,0,0,0,0|1,0,0]=2 1823 B7R0.13 C[C@](O)(NO)C(O)=O Amb24412529 [0,1,0,0,0,0|2,0,0]=3 1824 B7R0.13 ClCC(C(=O)N)(Cl)Cl Amb10844816 [0,1,0,0,0,0|3,0,0]=4 1825 B7R0.13 N#CC(Br)(Br)C(O)=O Amb25793697 [0,1,0,0,0,0|2,0,1]=4 1826 B7R0.13 N#CC(F)(F)C(O)=O Amb23455365 [0,1,0,0,0,0|2,0,1]=4 1827 B7R0.13 NC(=O)C(F)(F)CO Amb25378711 [0,1,0,0,0,0|2,0,0]=3 1828 B7R0.13 NC(N)(CS)C(O)=O Amb24746383 [0,1,0,0,0,0|0,1,0]=2 1829 B7R0.13 NC(O)(CS)C(O)=O Amb25211789 [0,1,0,0,0,0|0,1,0]=2 1830 B7R0.13 NCC(F)(F)C(O)=O Amb19888004 [0,1,0,0,0,0|2,0,0]=3 1831 B7R0.13 O=C(Cl)C(Cl)(Cl)CCl Amb25701579 [0,1,0,0,0,0|3,0,0]=4 1832 B7R0.13 OC(=O)C(Cl)(Cl)CCl Amb22731239 [0,1,0,0,0,0|2,0,0]=3 1833 B7R0.13 OC(=O)C(F)(Cl)CCl Amb25189030 [0,1,0,0,0,0|2,0,0]=3 1834 B7R0.13 OC(=O)C(F)(F)CF Amb25711017 [0,1,0,0,0,0|2,0,0]=3 1835 B7R0.13 OCC(C(=O)O)(F)F Amb17593305 [0,1,0,0,0,0|1,0,0]=2 1836 B7R0.13 OCC(O)(Br)C(O)Br Amb24483157 [0,1,0,0,0,0|2,0,1]=4 1837 B7R0.13 [C-]#[N+]C(C)(C)C(O)=O Amb24481414 [0,1,0,0,0,0|3,0,0]=4 1838 B7R0.14 CC(C)(C)C(N)CO Amb19338133 [0,1,0,0,0,0|2,0,1]=4 1839 B7R0.14 CC(C)(C)[C@H](N)CO Amb22349422 [0,1,0,0,0,0|2,0,1]=4 1840 B7R0.14 CC(C)(F)C(N)CO Amb25075200 [0,1,0,0,0,0|2,0,1]=4 1841 B7R0.14 CC(C)(O)C(Br)CO Amb25201013 [0,1,0,0,0,0|2,0,1]=4 1842 B7R0.14 CC(C)(O)C(Cl)CO Amb20620744 [0,1,0,0,0,0|2,0,1]=4 1843 B7R0.14 CC(C)(O)C(O)CO Amb24404708 [0,1,0,0,0,0|2,0,1]=4 1844 B7R0.14 CC(C)(O)[C@@H](O)CO Amb24733946 [0,1,0,0,0,0|2,0,1]=4 1845 B7R0.14 CC(C)(O)[C@H](N)CO Amb25132177 [0,1,0,0,0,0|1,0,1]=3 1846 B7R0.14 CC(CN)S(O)(=O)=O Amb24481489 [0,1,0,0,0,0|3,0,0]=4 1847 B7R0.14 CC(CO)P(O)(O)=O Amb25135495 [0,1,0,0,0,0|2,0,0]=3 1848 B7R0.14 CC(CO)S(C)(=O)=O Amb24340232 [0,1,0,0,0,0|2,0,1]=4 1849 B7R0.14 CC(CO)S(N)(=O)=O Amb24367553 [0,1,0,0,0,0|2,0,1]=4 1850 B7R0.14 CC(CO)S(O)(=O)=O Amb25285698 [0,1,0,0,0,0|2,0,0]=3 1851 B7R0.14 CC(F)(F)C(N)CO Amb25207871 [0,1,0,0,0,0|2,0,1]=4 1852 B7R0.14 CCC(C)S(O)(=O)=O Amb22372234 [0,1,0,0,0,0|3,0,0]=4 1853 B7R0.14 CCC(Cl)S(O)(=O)=O Amb24627108 [0,1,0,0,0,0|3,0,0]=4 1854 B7R0.14 CCC(N)C(C)(C)O Amb18198391 [0,1,0,0,0,0|2,0,1]=4 1855 B7R0.14 CCC(N)C(N)(O)O Amb25810948 [0,1,0,0,0,0|1,0,2]=4 1856 B7R0.14 CCC(N)S(O)(=O)=O Amb24558367 [0,1,0,0,0,0|2,0,0]=3 1857 B7R0.14 CCC(O)P(O)(O)=O Amb24354457 [0,1,0,0,0,0|3,0,0]=4 1858 B7R0.14 CCC(P(=O)(O)O)C Amb10560197 [0,1,0,0,0,0|3,0,0]=4 1859 B7R0.14 CC[C@@H](Cl)P(O)(O)=O Amb24332616 [0,1,0,0,0,0|3,0,0]=4 1860 B7R0.14 CC[C@@H](N)C(C)(C)O Amb25800412 [0,1,0,0,0,0|2,0,1]=4 1861 B7R0.14 CC[C@H](N)C(C)(C)O Amb25131729 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.14 CP(O)(=O)C(N)CO Amb25809584 [0,1,0,0,0,0|1,0,0]=2 1863 B7R0.14 C[C@@H](CO)C(C)(C)O Amb22737257 [0,1,0,0,0,0|2,0,1]=4 1864 B7R0.14 ClCC(S(=O)(=O)O)O Amb17594012 [0,1,0,0,0,0|3,0,0]=4 1865 B7R0.14 NC(C#N)S(O)(=O)=O Amb25173830 [0,1,0,0,0,0|2,0,1]=4 1866 B7R0.14 NC(CBr)P(O)(O)=O Amb24374007 [0,1,0,0,0,0|2,0,0]=3 1867 B7R0.14 NC(CF)P(O)(O)=O Amb25117594 [0,1,0,0,0,0|2,0,0]=3 1868 B7R0.14 NC(CO)C(F)(F)F Amb18202893 [0,1,0,0,0,0|2,0,1]=4 1869 B7R0.14 NC(CO)C(F)(F)F Amb22738564 [0,1,0,0,0,0|2,0,1]=4 1870 B7R0.14 NC(CS)P(O)(O)=O Amb24740823 [0,1,0,0,0,0|1,1,0]=3 1871 B7R0.14 NC[C@@H](O)P(O)(O)=O Amb25293388 [0,1,0,0,0,0|3,0,0]=4 1872 B7R0.14 NC[C@H](Br)P(O)(O)=O Amb24401576 [0,1,0,0,0,0|3,0,0]=4 1873 B7R0.14 NC[C@H](O)P(O)(O)=O Amb24333105 [0,1,0,0,0,0|3,0,0]=4 1874 B7R0.14 N[C@@H](CO)C(F)(F)F Amb19374710 [0,1,0,0,0,0|2,0,1]=4 1875 B7R0.14 N[C@@H](CO)C(F)(F)F Amb24088864 [0,1,0,0,0,0|2,0,1]=4 1876 B7R0.14 N[C@@H](CO)P(O)(O)=O Amb25211599 [0,1,0,0,0,0|1,0,0]=2 1877 B7R0.14 N[C@H](CO)C(F)(F)F Amb24055870 [0,1,0,0,0,0|2,0,1]=4 1878 B7R0.14 OCC(Cl)S(O)(=O)=O Amb24613047 [0,1,0,0,0,0|2,0,0]=3 1879 B7R0.15 C=CC(C#C)C(O)=O Amb24562856 [0,1,0,0,0,0|2,0,1]=4 1880 B7R0.15 C=CC(C=O)C(O)=O Amb25042871 [0,1,0,0,0,0|1,0,2]=4 1881 B7R0.15 CC(=C)C(CO)C=C Amb24334037 [0,1,0,0,0,0|3,0,0]=4 1882 B7R0.15 CC(=C)C(CO)CO Amb24632128 [0,1,0,0,0,0|3,0,0]=4 1883 B7R0.15 CC(=O)C(CBr)C=O Amb24483303 [0,1,0,0,0,0|3,0,0]=4 1884 B7R0.15 CC(=O)C(CC)=NN Amb25373336 [0,1,0,0,0,0|2,0,1]=4 1885 B7R0.15 CC(=O)C(CO)CO Amb22904340 [0,1,0,0,0,0|2,0,0]=3 1886 B7R0.15 CC(C)C(CN)CO Amb22304811 [0,1,0,0,0,0|2,0,1]=4 1887 B7R0.15 CC(C)C(CO)NC Amb18291223 [0,1,0,0,0,0|2,0,1]=4 1888 B7R0.15 CC(C)C(CO)NO Amb24432794 [0,1,0,0,0,0|2,0,1]=4 1889 B7R0.15 CC(C)C(CO)ON Amb25175780 [0,1,0,0,0,0|2,0,1]=4 1890 B7R0.15 CC(C)[C@@H](CN)CO Amb25075276 [0,1,0,0,0,0|2,0,1]=4 1891 B7R0.15 CC(C)[C@H](CN)CO Amb25224738 [0,1,0,0,0,0|2,0,1]=4 1892 B7R0.15 CC(O)=C(CO)NC Amb25210013 [0,1,0,0,0,0|1,0,1]=3 1893 B7R0.15 CC(O)C(CO)C=C Amb25787350 [0,1,0,0,0,0|2,0,1]=4 1894 B7R0.15 CCC(=C=C)C(O)=O Amb25246162 [0,1,0,0,0,0|2,0,1]=4 1895 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [0,1,0,0,0,0|2,0,1]=4 1896 B7R0.15 CCC(C#C)C(C)=O Amb25128229 [0,1,0,0,0,0|3,0,0]=4 1897 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [0,1,0,0,0,0|2,0,0]=3 1898 B7R0.15 CCC(C(=O)N)NC Amb15701261 [0,1,0,0,0,0|2,0,0]=3 1899 B7R0.15 CCC(C(=O)N)OC Amb2027289 [0,1,0,0,0,0|3,0,0]=4 1900 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [0,1,0,0,0,0|1,0,1]=3 1901 B7R0.15 CCC(C(=O)O)NC Amb10610245 [0,1,0,0,0,0|1,0,0]=2 1902 B7R0.15 CCC(C(=O)O)SC Amb17501348 [0,1,0,0,0,0|2,0,0]=3 1903 B7R0.15 CCC(C(=O)[O-])CCl Amb10604125 [0,1,0,0,0,0|2,0,1]=4 1904 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [0,1,0,0,0,0|2,0,0]=3 1905 B7R0.15 CCC(CC)C(=O)Br Amb25280424 [0,1,0,0,0,0|3,0,0]=4 1906 B7R0.15 CCC(CC)C([O-])=O Amb22585838 [0,1,0,0,0,0|2,0,1]=4 1907 B7R0.15 CCC(CN)B(O)O Amb25075896 [0,1,0,0,0,0|2,0,1]=4 1908 B7R0.15 CCC(CN)C(C)=O Amb24548156 [0,1,0,0,0,0|2,0,0]=3 1909 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,0,0,0,0|2,0,0]=3 1910 B7R0.15 CCC(CN)C(O)=O Amb18987934 [0,1,0,0,0,0|1,0,0]=2 1911 B7R0.15 CCC(CN)C(O)=O Amb19514932 [0,1,0,0,0,0|1,0,0]=2 1912 B7R0.15 CCC(CN)S(C)=O Amb25106958 [0,1,0,0,0,0|3,0,0]=4 1913 B7R0.15 CCC(CO)C(C)=O Amb24709237 [0,1,0,0,0,0|2,0,0]=3 1914 B7R0.15 CCC(CO)C(O)=O Amb18641947 [0,1,0,0,0,0|1,0,0]=2 1915 B7R0.15 CCC(CS)C(O)=O Amb24435402 [0,1,0,0,0,0|1,1,0]=3 1916 B7R0.15 CCC(N=C)C(N)=O Amb25811618 [0,1,0,0,0,0|2,0,1]=4 1917 B7R0.15 CCC(NN)C(O)=O Amb18641955 [0,1,0,0,0,0|1,0,0]=2 1918 B7R0.15 CCC(ON)C(N)=O Amb24483121 [0,1,0,0,0,0|2,0,0]=3 1919 B7R0.15 CCC(ON)C(O)=O Amb25697895 [0,1,0,0,0,0|1,0,0]=2 1920 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [0,1,0,0,0,0|1,0,0]=2 1921 B7R0.15 CC[C@@H](CO)C(C)=C Amb24525664 [0,1,0,0,0,0|3,0,0]=4 1922 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [0,1,0,0,0,0|1,0,0]=2 1923 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [0,1,0,0,0,0|1,1,0]=3 1924 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [0,1,0,0,0,0|1,0,0]=2 1925 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [0,1,0,0,0,0|2,0,0]=3 1926 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [0,1,0,0,0,0|1,0,0]=2 1927 B7R0.15 CC[C@H](CO)C(C)=C Amb25071554 [0,1,0,0,0,0|3,0,0]=4 1928 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [0,1,0,0,0,0|1,1,0]=3 1929 B7R0.15 CC[C@H](N=C)C(N)=O Amb25738279 [0,1,0,0,0,0|2,0,1]=4 1930 B7R0.15 CC[C@H](NC)C(N)=O Amb25745002 [0,1,0,0,0,0|2,0,0]=3 1931 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [0,1,0,0,0,0|1,0,0]=2 1932 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [0,1,0,0,0,0|2,0,1]=4 1933 B7R0.15 CC\C(=N/O)\C(O)=O Amb25378085 [0,1,0,0,0,0|1,0,2]=4 1934 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [0,1,0,0,0,0|1,0,1]=3 1935 B7R0.15 CNC(CF)C(O)=O Amb25695388 [0,1,0,0,0,0|1,0,0]=2 1936 B7R0.15 CNC(CN)C(O)=O Amb23515020 [0,1,0,0,0,0|1,0,0]=2 1937 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,0,0,0,0|1,0,0]=2 1938 B7R0.15 CNC(SC)C(O)=O Amb25745282 [0,1,0,0,0,0|2,0,0]=3 1939 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [0,1,0,0,0,0|1,0,0]=2 1940 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [0,1,0,0,0,0|1,0,0]=2 1941 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [0,1,0,0,0,0|1,0,0]=2 1942 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [0,1,0,0,0,0|0,0,0]=1 1943 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [0,1,0,0,0,0|1,0,0]=2 1944 B7R0.15 COC(=CO)C(O)=O Amb25730461 [0,1,0,0,0,0|1,0,2]=4 1945 B7R0.15 COC(C=C)C(O)=O Amb18641874 [0,1,0,0,0,0|2,0,1]=4 1946 B7R0.15 COC(CBr)C(C)=O Amb24737219 [0,1,0,0,0,0|3,0,0]=4 1947 B7R0.15 COC(CBr)C(N)=O Amb24563790 [0,1,0,0,0,0|3,0,0]=4 1948 B7R0.15 COC(CCl)C(O)=O Amb18643355 [0,1,0,0,0,0|2,0,0]=3 1949 B7R0.15 COC(CN)C(N)=O Amb24719552 [0,1,0,0,0,0|3,0,0]=4 1950 B7R0.15 COC(CN)C(O)=O Amb22059584 [0,1,0,0,0,0|2,0,0]=3 1951 B7R0.15 COC(CN)C(O)=O Amb24271092 [0,1,0,0,0,0|2,0,0]=3 1952 B7R0.15 COC(CO)C(=C)Cl Amb25080420 [0,1,0,0,0,0|3,0,0]=4 1953 B7R0.15 COC(CO)C(O)=O Amb24482992 [0,1,0,0,0,0|1,0,0]=2 1954 B7R0.15 COC(CS)C(O)=O Amb25305649 [0,1,0,0,0,0|1,1,0]=3 1955 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [0,1,0,0,0,0|2,0,0]=3 1956 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [0,1,0,0,0,0|2,0,0]=3 1957 B7R0.15 CSC(CO)C(C)=O Amb25746293 [0,1,0,0,0,0|2,0,0]=3 1958 B7R0.15 CSC(CO)C(N)=O Amb25849170 [0,1,0,0,0,0|2,0,0]=3 1959 B7R0.15 C\C(\O)=C(\CO)/NC Amb25759923 [0,1,0,0,0,0|1,0,1]=3 1960 B7R0.15 C\C=C(/CBr)\C(O)=O Amb18128301 [0,1,0,0,0,0|2,0,1]=4 1961 B7R0.15 C\C=C(\CBr)/C(O)=O Amb24606924 [0,1,0,0,0,0|2,0,1]=4 1962 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [0,1,0,0,0,0|1,0,1]=3 1963 B7R0.15 N#CC(C#N)C(O)=O Amb24529093 [0,1,0,0,0,0|1,0,2]=4 1964 B7R0.15 NC(=O)N(CO)CO Amb22167903 [0,1,0,0,0,0|3,0,0]=4 1965 B7R0.15 NCC(C(=O)O)C#N Amb10842157 [0,1,0,0,0,0|1,0,1]=3 1966 B7R0.15 NCC(CN)C(O)=O Amb25335570 [0,1,0,0,0,0|1,0,0]=2 1967 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [0,1,0,0,0,0|0,0,0]=1 1968 B7R0.15 NNC(CS)C(O)=O Amb24117863 [0,1,0,0,0,0|0,1,0]=2 1969 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [0,1,0,0,0,0|0,0,0]=1 1970 B7R0.15 NN\C(=N/N)\C(O)=O Amb24377685 [0,1,0,0,0,0|2,0,1]=4 1971 B7R0.15 NOC(ON)C(O)=O Amb24642031 [0,1,0,0,0,0|2,0,0]=3 1972 B7R0.15 OC(=O)C(CBr)=NO Amb24621133 [0,1,0,0,0,0|1,0,2]=4 1973 B7R0.15 OC(=O)C(CI)CI Amb17779784 [0,1,0,0,0,0|2,0,0]=3 1974 B7R0.15 OC(=O)C(CO)CO Amb18124271 [0,1,0,0,0,0|1,0,0]=2 1975 B7R0.15 OC(=O)C(CS)=NO Amb24685236 [0,1,0,0,0,0|0,1,2]=4 1976 B7R0.15 OC(=O)C(CS)NS Amb25286626 [0,1,0,0,0,0|0,1,0]=2 1977 B7R0.15 OC(=O)\C(\CS)=N\O Amb24551064 [0,1,0,0,0,0|0,1,2]=4 1978 B7R0.15 OCC(NO)C(O)=O Amb24719766 [0,1,0,0,0,0|0,0,0]=1 1979 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [0,1,0,0,0,0|1,0,1]=3 1980 B7R0.15 [O-]CC(CO)[N+]([O-])=O Amb21961874 [0,1,0,0,0,0|2,0,1]=4 1981 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [0,1,0,0,0,0|3,0,0]=4 1982 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,1,0,0,0,0|1,0,1]=3 1983 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,1,0,0,0,0|2,0,1]=4 1984 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,1,0,0,0,0|1,0,1]=3 1985 B7R0.16 C=C(C(F)F)C(O)=O Amb24117234 [0,1,0,0,0,0|2,0,1]=4 1986 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,1,0,0,0,0|1,0,2]=4 1987 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,1,0,0,0,0|1,0,1]=3 1988 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,1,0,0,0,0|1,0,1]=3 1989 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,1,0,0,0,0|2,0,1]=4 1990 B7R0.16 CC(=C)C(N)C(F)F Amb24720668 [0,1,0,0,0,0|3,0,0]=4 1991 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,1,0,0,0,0|1,0,1]=3 1992 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,1,0,0,0,0|2,0,1]=4 1993 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,1,0,0,0,0|2,0,1]=4 1994 B7R0.16 CC(=O)C(=O)C(C)O Amb25173440 [0,1,0,0,0,0|2,0,1]=4 1995 B7R0.16 CC(=O)C(F)C(F)F Amb25697000 [0,1,0,0,0,0|3,0,0]=4 1996 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,1,0,0,0,0|0,0,2]=3 1997 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,1,0,0,0,0|2,0,1]=4 1998 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,1,0,0,0,0|1,0,0]=2 1999 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,1,0,0,0,0|2,0,1]=4 2000 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,1,0,0,0,0|2,0,1]=4 2001 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,1,0,0,0,0|1,0,2]=4 2002 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,1,0,0,0,0|2,0,0]=3 2003 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [0,1,0,0,0,0|3,0,0]=4 2004 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,1,0,0,0,0|2,0,0]=3 2005 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,1,0,0,0,0|1,0,0]=2 2006 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,1,0,0,0,0|1,0,0]=2 2007 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,1,0,0,0,0|1,0,0]=2 2008 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,1,0,0,0,0|1,0,0]=2 2009 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,1,0,0,0,0|0,1,0]=2 2010 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,1,0,0,0,0|2,0,0]=3 2011 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,1,0,0,0,0|3,0,0]=4 2012 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,1,0,0,0,0|3,0,0]=4 2013 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,1,0,0,0,0|2,0,0]=3 2014 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,1,0,0,0,0|2,0,0]=3 2015 B7R0.16 CC(C(C)O)C(N)=S Amb24583963 [0,1,0,0,0,0|2,1,0]=4 2016 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,1,0,0,0,0|1,1,0]=3 2017 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,1,0,0,0,0|1,1,1]=4 2018 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,1,0,0,0,0|3,0,0]=4 2019 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,1,0,0,0,0|3,0,0]=4 2020 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,1,0,0,0,0|3,0,0]=4 2021 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,1,0,0,0,0|2,0,0]=3 2022 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,1,0,0,0,0|2,0,1]=4 2023 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,1,0,0,0,0|2,0,0]=3 2024 B7R0.16 CC(C(O)C)C(O)C Amb2583260 [0,1,0,0,0,0|2,0,1]=4 2025 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,1,0,0,0,0|2,0,1]=4 2026 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [0,1,0,0,0,0|3,0,0]=4 2027 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,1,0,0,0,0|3,0,0]=4 2028 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,1,0,0,0,0|3,0,0]=4 2029 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,0,0|3,0,0]=4 2030 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [0,1,0,0,0,0|3,0,0]=4 2031 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [0,1,0,0,0,0|3,0,0]=4 2032 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [0,1,0,0,0,0|3,0,0]=4 2033 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [0,1,0,0,0,0|3,0,0]=4 2034 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,1,0,0,0,0|2,0,0]=3 2035 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,1,0,0,0,0|2,0,1]=4 2036 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,1,0,0,0,0|1,1,0]=3 2037 B7R0.16 CC(C)C(N)C(C)=C Amb18641748 [0,1,0,0,0,0|3,0,0]=4 2038 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,1,0,0,0,0|2,0,0]=3 2039 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,1,0,0,0,0|2,0,1]=4 2040 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,0,0|2,0,0]=3 2041 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,0,0,0,0|2,1,0]=4 2042 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,1,0,0,0,0|1,0,0]=2 2043 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [0,1,0,0,0,0|3,0,0]=4 2044 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [0,1,0,0,0,0|3,0,0]=4 2045 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [0,1,0,0,0,0|3,0,0]=4 2046 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,1,0,0,0,0|2,0,0]=3 2047 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,1,0,0,0,0|1,0,0]=2 2048 B7R0.16 CC(C)N(N)C(N)=O Amb24679360 [0,1,0,0,0,0|3,0,0]=4 2049 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,1,0,0,0,0|1,0,0]=2 2050 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [0,1,0,0,0,0|3,0,0]=4 2051 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,1,0,0,0,0|3,0,0]=4 2052 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,1,0,0,0,0|2,0,0]=3 2053 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,1,0,0,0,0|2,0,0]=3 2054 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,1,0,0,0,0|2,0,0]=3 2055 B7R0.16 CC(C)[C@@H](N)C(C)O Amb24575417 [0,1,0,0,0,0|2,0,1]=4 2056 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,0,0|2,0,0]=3 2057 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,0,0|2,0,0]=3 2058 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,1,0,0,0,0|1,0,0]=2 2059 B7R0.16 CC(C)[C@@H](N)[C@@H](C)O Amb24540375 [0,1,0,0,0,0|2,0,1]=4 2060 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [0,1,0,0,0,0|3,0,0]=4 2061 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,1,0,0,0,0|2,0,0]=3 2062 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,1,0,0,0,0|2,0,0]=3 2063 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,1,0,0,0,0|1,1,0]=3 2064 B7R0.16 CC(C)[C@H](N)C(N)=S Amb24714667 [0,1,0,0,0,0|2,1,0]=4 2065 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,1,0,0,0,0|1,0,0]=2 2066 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,1,0,0,0,0|1,0,0]=2 2067 B7R0.16 CC(C)[C@H](N)[C@@H](C)O Amb24611787 [0,1,0,0,0,0|2,0,1]=4 2068 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [0,1,0,0,0,0|3,0,0]=4 2069 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [0,1,0,0,0,0|3,0,0]=4 2070 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,1,0,0,0,0|2,0,0]=3 2071 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,1,0,0,0,0|2,0,1]=4 2072 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,1,0,0,0,0|3,0,0]=4 2073 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [0,1,0,0,0,0|3,0,0]=4 2074 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [0,1,0,0,0,0|3,0,0]=4 2075 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,1,0,0,0,0|1,0,0]=2 2076 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,1,0,0,0,0|2,0,0]=3 2077 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,1,0,0,0,0|2,0,0]=3 2078 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,1,0,0,0,0|2,0,0]=3 2079 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,1,0,0,0,0|2,0,0]=3 2080 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,1,0,0,0,0|1,0,0]=2 2081 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,1,0,0,0,0|1,0,0]=2 2082 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,1,0,0,0,0|2,0,0]=3 2083 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,1,0,0,0,0|1,0,0]=2 2084 B7R0.16 CC(O)=C(O)C(C)O Amb25227909 [0,1,0,0,0,0|2,0,1]=4 2085 B7R0.16 CC(O)C(=C)C(N)=O Amb24694487 [0,1,0,0,0,0|2,0,1]=4 2086 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,1,0,0,0,0|1,0,1]=3 2087 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,1,0,0,0,0|1,0,0]=2 2088 B7R0.16 CC(O)C(N)C(C)O Amb24374632 [0,1,0,0,0,0|1,0,1]=3 2089 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,0,0|1,0,0]=2 2090 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,1,0,0,0,0|1,0,0]=2 2091 B7R0.16 CC(O)C(N)P(O)O Amb25305040 [0,1,0,0,0,0|1,0,1]=3 2092 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,1,0,0,0,0|1,0,0]=2 2093 B7R0.16 CC(O)C(O)C(O)O Amb25792462 [0,1,0,0,0,0|1,0,2]=4 2094 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,1,0,0,0,0|2,0,0]=3 2095 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,1,0,0,0,0|1,0,0]=2 2096 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [0,1,0,0,0,0|2,1,0]=4 2097 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,1,0,0,0,0|0,1,0]=2 2098 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,1,0,0,0,0|0,1,0]=2 2099 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,1,0,0,0,0|2,0,0]=3 2100 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,1,0,0,0,0|2,0,0]=3 2101 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,1,0,0,0,0|2,0,0]=3 2102 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,1,0,0,0,0|3,0,0]=4 2103 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,1,0,0,0,0|3,0,0]=4 2104 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,1,0,0,0,0|2,0,0]=3 2105 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,1,0,0,0,0|2,0,0]=3 2106 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,1,0,0,0,0|1,0,0]=2 2107 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,1,0,0,0,0|1,0,0]=2 2108 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,1,0,0,0,0|1,0,0]=2 2109 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,1,0,0,0,0|1,0,0]=2 2110 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,1,0,0,0,0|1,0,0]=2 2111 B7R0.16 C[C@@H](O)C(N)C(C)O Amb24394814 [0,1,0,0,0,0|1,0,1]=3 2112 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,1,0,0,0,0|0,0,0]=1 2113 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,1,0,0,0,0|1,0,0]=2 2114 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,1,0,0,0,0|1,0,0]=2 2115 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,1,0,0,0,0|2,0,0]=3 2116 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,1,0,0,0,0|1,0,0]=2 2117 B7R0.16 C[C@@H](O)[C@H](N)C(C)O Amb25141789 [0,1,0,0,0,0|1,0,1]=3 2118 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,0,0|1,0,0]=2 2119 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,1,0,0,0,0|0,0,0]=1 2120 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,1,0,0,0,0|2,0,0]=3 2121 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,1,0,0,0,0|0,0,0]=1 2122 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,1,0,0,0,0|0,1,0]=2 2123 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,1,0,0,0,0|0,1,0]=2 2124 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,1,0,0,0,0|0,1,0]=2 2125 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,1,0,0,0,0|2,0,0]=3 2126 B7R0.16 C[C@@H]([C@@H](C)O)C(=C)Br Amb25144623 [0,1,0,0,0,0|3,0,0]=4 2127 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,1,0,0,0,0|1,0,0]=2 2128 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,1,0,0,0,0|3,0,0]=4 2129 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,1,0,0,0,0|1,0,0]=2 2130 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,1,0,0,0,0|2,0,0]=3 2131 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,1,0,0,0,0|3,0,0]=4 2132 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,1,0,0,0,0|1,0,0]=2 2133 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,1,0,0,0,0|2,0,1]=4 2134 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [0,1,0,0,0,0|3,0,0]=4 2135 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,1,0,0,0,0|2,0,0]=3 2136 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [0,1,0,0,0,0|3,0,0]=4 2137 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,1,0,0,0,0|2,0,0]=3 2138 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,1,0,0,0,0|1,0,0]=2 2139 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [0,1,0,0,0,0|3,0,0]=4 2140 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,1,0,0,0,0|1,0,0]=2 2141 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,1,0,0,0,0|2,0,0]=3 2142 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,1,0,0,0,0|2,0,0]=3 2143 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,1,0,0,0,0|0,0,0]=1 2144 B7R0.16 C[C@H](O)[C@@H](O)C(C)=C Amb24719527 [0,1,0,0,0,0|3,0,0]=4 2145 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,1,0,0,0,0|1,0,0]=2 2146 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,1,0,0,0,0|1,0,0]=2 2147 B7R0.16 C[C@H](O)[C@H](O)C(=C)Br Amb25333755 [0,1,0,0,0,0|3,0,0]=4 2148 B7R0.16 C[C@H](O)[C@H](O)C(C)=C Amb24688259 [0,1,0,0,0,0|3,0,0]=4 2149 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,1,0,0,0,0|0,1,0]=2 2150 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,1,0,0,0,0|1,0,0]=2 2151 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,1,0,0,0,0|1,0,0]=2 2152 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,1,0,0,0,0|3,0,0]=4 2153 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,1,0,0,0,0|2,0,0]=3 2154 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,1,0,0,0,0|2,0,0]=3 2155 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,1,0,0,0,0|0,0,0]=1 2156 B7R0.16 C[C@H]([C@H](C)O)S(C)=O Amb24332098 [0,1,0,0,0,0|3,0,0]=4 2157 B7R0.16 C[C@H]([C@H](C)O)[C@@H](C)O Amb24445952 [0,1,0,0,0,0|2,0,1]=4 2158 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,1,0,0,0,0|1,1,0]=3 2159 B7R0.16 C\C(\O)=C(/O)\C(C)O Amb24364699 [0,1,0,0,0,0|2,0,1]=4 2160 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,1,0,0,0,0|0,0,2]=3 2161 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,1,0,0,0,0|2,0,0]=3 2162 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,1,0,0,0,0|0,0,3]=4 2163 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,1,0,0,0,0|1,0,2]=4 2164 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,1,0,0,0,0|1,0,2]=4 2165 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,1,0,0,0,0|0,0,2]=3 2166 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,1,0,0,0,0|1,0,2]=4 2167 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|0,0,1]=2 2168 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,1,0,0,0,0|1,0,0]=2 2169 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,1,0,0,0,0|1,0,0]=2 2170 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,1,0,0,0,0|1,0,0]=2 2171 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,1,0,0,0,0|0,0,0]=1 2172 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,1,0,0,0,0|1,0,0]=2 2173 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,1,0,0,0,0|1,0,0]=2 2174 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,1,0,0,0,0|2,0,0]=3 2175 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,1,0,0,0,0|2,0,0]=3 2176 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,1,0,0,0,0|1,0,0]=2 2177 B7R0.16 OC(=O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,0,0|2,0,1]=4 2178 B7R0.16 OC(=O)C(=O)C(Cl)Cl Amb24652562 [0,1,0,0,0,0|2,0,1]=4 2179 B7R0.16 OC(=O)C(=O)C(F)Br Amb25111221 [0,1,0,0,0,0|2,0,1]=4 2180 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,1,0,0,0,0|1,0,2]=4 2181 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,1,0,0,0,0|1,0,2]=4 2182 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,1,0,0,0,0|1,0,2]=4 2183 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,1,0,0,0,0|2,0,0]=3 2184 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,1,0,0,0,0|1,0,1]=3 2185 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,1,0,0,0,0|1,0,1]=3 2186 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,1,0,0,0,0|1,0,1]=3 2187 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,1,0,0,0,0|2,0,0]=3 2188 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,1,0,0,0,0|2,0,0]=3 2189 B7R0.16 OC(C(O)=O)S(O)=O Amb24551214 [0,1,0,0,0,0|2,0,0]=3 2190 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,1,0,0,0,0|2,0,0]=3 2191 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,1,0,0,0,0|0,0,0]=1 2192 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,1,0,0,0,0|1,0,0]=2 2193 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,1,0,0,0,0|0,0,0]=1 2194 B7R1.4 C=C1COCC1O Amb24423437 [0,0,0,1,0,0|3,0,0]=4 2195 B7R1.4 CC1CC=CC1=O Amb25143468 [0,0,0,1,0,0|3,0,0]=4 2196 B7R1.4 CC1CCSC1=O Amb25271791 [0,0,0,1,0,0|2,1,0]=4 2197 B7R1.4 CC1COCC1=C Amb25830669 [0,0,0,1,0,0|3,0,0]=4 2198 B7R1.4 CC1COCC1=O Amb24333426 [0,0,0,1,0,0|2,0,0]=3 2199 B7R1.4 CC1CSCC1=O Amb21964769 [0,0,0,1,0,0|2,1,0]=4 2200 B7R1.4 CC1CSSC1=O Amb25757909 [0,0,0,1,0,0|1,2,0]=4 2201 B7R1.4 CC1N=COC1=O Amb24518855 [0,0,0,1,0,0|3,0,0]=4 2202 B7R1.4 CC1NCOC1=O Amb24409631 [0,0,0,1,0,0|3,0,0]=4 2203 B7R1.4 CC1OCCC1N Amb22058722 [0,0,0,1,0,0|2,0,1]=4 2204 B7R1.4 CC1O[Ag]OC1=O Amb22352183 [0,0,0,1,0,0|3,0,0]=4 2205 B7R1.4 CC1SCOC1=O Amb25347819 [0,0,0,1,0,0|3,0,0]=4 2206 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,1,0,0|3,0,0]=4 2207 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,1,0,0|3,0,0]=4 2208 B7R1.4 C[C@@H]1COC[C@@H]1N Amb25766097 [0,0,0,1,0,0|2,0,1]=4 2209 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [0,0,0,1,0,0|2,0,1]=4 2210 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [0,0,0,1,0,0|2,0,1]=4 2211 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [0,0,0,1,0,0|2,0,1]=4 2212 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [0,0,0,1,0,0|3,0,0]=4 2213 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [0,0,0,1,0,0|2,0,1]=4 2214 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [0,0,0,1,0,0|2,0,1]=4 2215 B7R1.4 C[C@H]1CC=CC1=O Amb24364068 [0,0,0,1,0,0|3,0,0]=4 2216 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [0,0,0,1,0,0|2,0,1]=4 2217 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [0,0,0,1,0,0|2,0,1]=4 2218 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [0,0,0,1,0,0|2,0,1]=4 2219 B7R1.4 NC1=CCOC1=O Amb22234102 [0,0,0,1,0,0|1,0,2]=4 2220 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,1,0,0|1,0,2]=4 2221 B7R1.4 NC1C=NNC1=O Amb18202634 [0,0,0,1,0,0|2,0,1]=4 2222 B7R1.4 NC1CCCC1=O Amb17939050 [0,0,0,1,0,0|2,0,0]=3 2223 B7R1.4 NC1CCNC1=O Amb21955321 [0,0,0,1,0,0|2,0,0]=3 2224 B7R1.4 NC1CCOC1=O Amb22233082 [0,0,0,1,0,0|1,0,0]=2 2225 B7R1.4 NC1CNCC1O Amb22235661 [0,0,0,1,0,0|2,0,1]=4 2226 B7R1.4 NC1CNCC1O Amb22497199 [0,0,0,1,0,0|2,0,1]=4 2227 B7R1.4 NC1COCC1Br Amb24369528 [0,0,0,1,0,0|2,0,1]=4 2228 B7R1.4 NC1COCC1N Amb23590778 [0,0,0,1,0,0|2,0,1]=4 2229 B7R1.4 NC1COCC1O Amb18277417 [0,0,0,1,0,0|1,0,1]=3 2230 B7R1.4 NC1COCC1O Amb19515137 [0,0,0,1,0,0|1,0,1]=3 2231 B7R1.4 NC1CONC1=O Amb1865548 [0,0,0,1,0,0|1,0,0]=2 2232 B7R1.4 NC1CONC1O Amb24571000 [0,0,0,1,0,0|1,0,1]=3 2233 B7R1.4 NC1CSCC1=O Amb18202693 [0,0,0,1,0,0|1,1,0]=3 2234 B7R1.4 NC1N=CNC1=O Amb25195540 [0,0,0,1,0,0|3,0,0]=4 2235 B7R1.4 NC1NOCC1=O Amb25811419 [0,0,0,1,0,0|2,0,0]=3 2236 B7R1.4 NN1C=COC1=O Amb24626105 [0,0,0,1,0,0|2,0,1]=4 2237 B7R1.4 N[C@@H]1CCCC1O Amb24347806 [0,0,0,1,0,0|2,0,1]=4 2238 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,0,0,1,0,0|2,0,0]=3 2239 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,0,0,1,0,0|2,0,0]=3 2240 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,0,0,1,0,0|1,0,0]=2 2241 B7R1.4 N[C@@H]1CCSC1=O Amb22745304 [0,0,0,1,0,0|1,1,0]=3 2242 B7R1.4 N[C@@H]1CCSC1=O Amb22750668 [0,0,0,1,0,0|1,1,0]=3 2243 B7R1.4 N[C@@H]1CNC[C@H]1O Amb24604330 [0,0,0,1,0,0|2,0,1]=4 2244 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [0,0,0,1,0,0|2,0,1]=4 2245 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [0,0,0,1,0,0|2,0,1]=4 2246 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [0,0,0,1,0,0|1,0,1]=3 2247 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [0,0,0,1,0,0|1,0,1]=3 2248 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [0,0,0,1,0,0|2,0,1]=4 2249 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [0,0,0,1,0,0|2,0,1]=4 2250 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [0,0,0,1,0,0|1,0,1]=3 2251 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [0,0,0,1,0,0|1,0,1]=3 2252 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [0,0,0,1,0,0|1,0,1]=3 2253 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [0,0,0,1,0,0|1,1,1]=4 2254 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [0,0,0,1,0,0|1,0,1]=3 2255 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,0,0,1,0,0|2,0,0]=3 2256 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,0,0,1,0,0|2,0,0]=3 2257 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,0,0,1,0,0|1,1,0]=3 2258 B7R1.4 N[C@H]1CNC[C@@H]1O Amb25187848 [0,0,0,1,0,0|2,0,1]=4 2259 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [0,0,0,1,0,0|1,0,1]=3 2260 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [0,0,0,1,0,0|1,0,1]=3 2261 B7R1.4 N[C@H]1CONC1O Amb24332118 [0,0,0,1,0,0|1,0,1]=3 2262 B7R1.4 N[C@H]1CSC[C@H]1O Amb25324268 [0,0,0,1,0,0|1,1,1]=4 2263 B7R1.4 Nc1cocc1O Amb24078810 [0,0,0,1,0,0|1,0,2]=4 2264 B7R1.4 O=C1C=CCC1Br Amb24739668 [0,0,0,1,0,0|3,0,0]=4 2265 B7R1.4 O=C1CCCC1Br Amb16234114 [0,0,0,1,0,0|3,0,0]=4 2266 B7R1.4 O=C1CCCC1I Amb25756212 [0,0,0,1,0,0|3,0,0]=4 2267 B7R1.4 O=C1CCCC1O Amb17593081 [0,0,0,1,0,0|3,0,0]=4 2268 B7R1.4 O=C1CCC[C@H]1Br Amb25778341 [0,0,0,1,0,0|3,0,0]=4 2269 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,0,0,1,0,0|3,0,0]=4 2270 B7R1.4 O=C1CNCC1F Amb24540356 [0,0,0,1,0,0|3,0,0]=4 2271 B7R1.4 O=C1COCC1=O Amb25723319 [0,0,0,1,0,0|2,0,1]=4 2272 B7R1.4 O=C1COCC1Br Amb24525921 [0,0,0,1,0,0|2,0,0]=3 2273 B7R1.4 O=C1NCCC1Br Amb20623055 [0,0,0,1,0,0|3,0,0]=4 2274 B7R1.4 O=C1NCCC1C Amb10603701 [0,0,0,1,0,0|3,0,0]=4 2275 B7R1.4 O=C1NCCC1F Amb25838145 [0,0,0,1,0,0|3,0,0]=4 2276 B7R1.4 O=C1NCCC1O Amb10603089 [0,0,0,1,0,0|3,0,0]=4 2277 B7R1.4 O=C1NCCC1S Amb18202686 [0,0,0,1,0,0|3,0,0]=4 2278 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,0,0,1,0,0|3,0,0]=4 2279 B7R1.4 O=C1NCC[C@@H]1S Amb25366927 [0,0,0,1,0,0|3,0,0]=4 2280 B7R1.4 O=C1NCC[C@H]1Cl Amb25331827 [0,0,0,1,0,0|3,0,0]=4 2281 B7R1.4 O=C1NCC[C@H]1F Amb24481058 [0,0,0,1,0,0|3,0,0]=4 2282 B7R1.4 O=C1NCC[C@H]1S Amb25304928 [0,0,0,1,0,0|3,0,0]=4 2283 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,1,0,0|2,0,1]=4 2284 B7R1.4 O=C1OC=CC1I Amb24679050 [0,0,0,1,0,0|2,0,1]=4 2285 B7R1.4 O=C1OCCC1C Amb16185414 [0,0,0,1,0,0|2,0,0]=3 2286 B7R1.4 O=C1OCCC1Cl Amb25065373 [0,0,0,1,0,0|2,0,0]=3 2287 B7R1.4 O=C1OCCC1I Amb24418518 [0,0,0,1,0,0|2,0,0]=3 2288 B7R1.4 O=C1OCCC1N Amb1151850 [0,0,0,1,0,0|1,0,0]=2 2289 B7R1.4 O=C1OCCC1N Amb17614991 [0,0,0,1,0,0|1,0,0]=2 2290 B7R1.4 O=C1OCCC1S Amb25146639 [0,0,0,1,0,0|2,0,0]=3 2291 B7R1.4 O=C1OCCN1N Amb10068971 [0,0,0,1,0,0|2,0,0]=3 2292 B7R1.4 O=C1OCC[C@@H]1N Amb10982617 [0,0,0,1,0,0|1,0,0]=2 2293 B7R1.4 O=C1OCC[C@H]1N Amb10601656 [0,0,0,1,0,0|1,0,0]=2 2294 B7R1.4 O=C1OCNC1Br Amb25299209 [0,0,0,1,0,0|3,0,0]=4 2295 B7R1.4 O=C1OCOC1Br Amb25237748 [0,0,0,1,0,0|3,0,0]=4 2296 B7R1.4 O=C1SCCC1N Amb1151877 [0,0,0,1,0,0|1,1,0]=3 2297 B7R1.4 O=C1SCC[C@@H]1Cl Amb25279498 [0,0,0,1,0,0|2,1,0]=4 2298 B7R1.4 O=C1SSCC1Cl Amb25810342 [0,0,0,1,0,0|1,2,0]=4 2299 B7R1.4 OC1C=COC1=O Amb25296159 [0,0,0,1,0,0|2,0,1]=4 2300 B7R1.4 OC1CCCC1N Amb13951342 [0,0,0,1,0,0|2,0,1]=4 2301 B7R1.4 OC1CNCC1=O Amb22500423 [0,0,0,1,0,0|3,0,0]=4 2302 B7R1.4 OC1COCC1Br Amb25321008 [0,0,0,1,0,0|2,0,1]=4 2303 B7R1.4 OC1COCC1Cl Amb24479454 [0,0,0,1,0,0|2,0,1]=4 2304 B7R1.4 OC1COCC1I Amb24332672 [0,0,0,1,0,0|2,0,1]=4 2305 B7R1.4 O[C@@H]1CC=CC1=O Amb24571805 [0,0,0,1,0,0|3,0,0]=4 2306 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [0,0,0,1,0,0|3,0,0]=4 2307 B7R1.4 O[C@@H]1CCC[C@@H]1N Amb10603107 [0,0,0,1,0,0|2,0,1]=4 2308 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993811 [0,0,0,1,0,0|2,0,1]=4 2309 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993922 [0,0,0,1,0,0|2,0,1]=4 2310 B7R1.4 O[C@@H]1CCNC1=O Amb22225343 [0,0,0,1,0,0|3,0,0]=4 2311 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [0,0,0,1,0,0|2,0,1]=4 2312 B7R1.4 O[C@@H]1COC[C@@H]1O Amb22406017 [0,0,0,1,0,0|2,0,1]=4 2313 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [0,0,0,1,0,0|2,0,1]=4 2314 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [0,0,0,1,0,0|2,0,1]=4 2315 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [0,0,0,1,0,0|2,0,1]=4 2316 B7R1.4 O[C@@H]1CSC[C@H]1N Amb1099355 [0,0,0,1,0,0|1,1,1]=4 2317 B7R1.4 O[C@H]1CC=CC1=O Amb25745808 [0,0,0,1,0,0|3,0,0]=4 2318 B7R1.4 O[C@H]1CCC[C@@H]1N Amb10604100 [0,0,0,1,0,0|2,0,1]=4 2319 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993810 [0,0,0,1,0,0|2,0,1]=4 2320 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993921 [0,0,0,1,0,0|2,0,1]=4 2321 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [0,0,0,1,0,0|2,0,1]=4 2322 B7R1.4 O[C@H]1COC[C@@H]1F Amb25168929 [0,0,0,1,0,0|2,0,1]=4 2323 B7R1.4 O[C@H]1COC[C@@H]1N Amb10608341 [0,0,0,1,0,0|1,0,1]=3 2324 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [0,0,0,1,0,0|2,0,1]=4 2325 B7R1.4 O[C@H]1COC[C@H]1Cl Amb25321006 [0,0,0,1,0,0|2,0,1]=4 2326 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,0,0,1,0,0|1,1,1]=4 2327 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,0,0,1,0,0|1,1,1]=4 2328 B7R1.8 CC1CNC1CO Amb25310037 [0,0,0,1,0,0|2,0,1]=4 2329 B7R1.8 CCC1OCC1=O Amb23456089 [0,0,0,1,0,0|3,0,0]=4 2330 B7R1.8 C[C@@H]1CN[C@@H]1CO Amb25230021 [0,0,0,1,0,0|2,0,1]=4 2331 B7R1.8 O=C1CCC1CBr Amb24633095 [0,0,0,1,0,0|3,0,0]=4 2332 B7R1.8 OC1CNC1CO Amb25276544 [0,0,0,1,0,0|1,0,1]=3 2333 B7R1.8 OC1CSC1CO Amb25044422 [0,0,0,1,0,0|2,0,1]=4 2334 B7R1.8 OCC1CCC1=O Amb24722181 [0,0,0,1,0,0|2,0,0]=3 2335 B7R1.8 OC[C@H]1NCC1=O Amb25313229 [0,0,0,1,0,0|1,0,0]=2 2336 B7R1.8 O[C@@H]1CC[C@@H]1CO Amb25662759 [0,0,0,1,0,0|2,0,1]=4 2337 B7R1.8 O[C@@H]1CN[C@H]1CO Amb25663178 [0,0,0,1,0,0|1,0,1]=3 2338 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,1,0,0|2,0,1]=4 2339 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,1,0,0|2,0,1]=4 2340 B7R1.12 CC(=O)C1CC1Br Amb24426068 [0,0,0,1,0,0|3,0,0]=4 2341 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [0,0,0,1,0,0|3,0,0]=4 2342 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [0,0,0,1,0,0|3,0,0]=4 2343 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [0,0,0,1,0,0|3,0,0]=4 2344 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [0,0,0,1,0,0|3,0,0]=4 2345 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [0,0,0,1,0,0|3,0,0]=4 2346 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,1,0,0|3,0,0]=4 2347 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|2,0,0]=3 2348 B7R1.12 CC1SC1C(C)=O Amb24333031 [0,0,0,1,0,0|3,0,0]=4 2349 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,1,0,0|3,0,0]=4 2350 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,1,0,0|3,0,0]=4 2351 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,1,0,0|2,0,0]=3 2352 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|3,0,0]=4 2353 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,1,0,0|2,0,0]=3 2354 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,1,0,0|1,0,0]=2 2355 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,1,0,0|2,0,0]=3 2356 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [0,0,0,1,0,0|3,0,0]=4 2357 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,1,0,0|2,0,0]=3 2358 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|2,0,0]=3 2359 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,1,0,0|3,0,0]=4 2360 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [0,0,0,1,0,0|3,0,0]=4 2361 B7R1.12 NC1CC1C(N)=O Amb18279694 [0,0,0,1,0,0|3,0,0]=4 2362 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,1,0,0|2,0,0]=3 2363 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,1,0,0|2,0,0]=3 2364 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,1,0,0|2,0,0]=3 2365 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [0,0,0,1,0,0|3,0,0]=4 2366 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [0,0,0,1,0,0|3,0,0]=4 2367 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|3,0,0]=4 2368 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,1,0,0|2,0,0]=3 2369 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,1,0]=3 2370 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,1,0,0|2,0,0]=3 2371 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|2,0,0]=3 2372 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|2,0,0]=3 2373 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|2,0,0]=3 2374 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|2,0,0]=3 2375 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|2,0,0]=3 2376 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|2,0,0]=3 2377 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|2,0,0]=3 2378 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,1,0,0|1,0,0]=2 2379 B7R1.15 C=C1C(O)CC1=O Amb24731884 [0,0,0,1,0,0|2,0,1]=4 2380 B7R1.15 CC1=C[C@H](O)[C@@H]1O Amb25357588 [0,0,0,1,0,0|3,0,0]=4 2381 B7R1.15 CC1C(C)CC1=O Amb24605096 [0,0,0,1,0,0|3,0,0]=4 2382 B7R1.15 CC1C(C)NC1=O Amb22364651 [0,0,0,1,0,0|3,0,0]=4 2383 B7R1.15 CC1CC(=O)N1N Amb24415255 [0,0,0,1,0,0|3,0,0]=4 2384 B7R1.15 CC1CC(O)C1N Amb24564236 [0,0,0,1,0,0|2,0,1]=4 2385 B7R1.15 CC1NC(=O)C1I Amb24504951 [0,0,0,1,0,0|3,0,0]=4 2386 B7R1.15 CC1NC(=O)C1O Amb24536600 [0,0,0,1,0,0|3,0,0]=4 2387 B7R1.15 CC1OC(=O)C1N Amb25169554 [0,0,0,1,0,0|1,0,0]=2 2388 B7R1.15 C[C@@H]1CC(=O)[C@@H]1Br Amb24656008 [0,0,0,1,0,0|3,0,0]=4 2389 B7R1.15 C[C@@H]1CC(=O)[C@H]1Br Amb24626651 [0,0,0,1,0,0|3,0,0]=4 2390 B7R1.15 C[C@@H]1NC(=O)[C@@H]1O Amb24632755 [0,0,0,1,0,0|3,0,0]=4 2391 B7R1.15 C[C@@H]1NC(=O)[C@H]1Cl Amb24746811 [0,0,0,1,0,0|3,0,0]=4 2392 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [0,0,0,1,0,0|2,0,0]=3 2393 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [0,0,0,1,0,0|2,0,0]=3 2394 B7R1.15 C[C@@H]1[C@H](C)CC1=O Amb25745705 [0,0,0,1,0,0|3,0,0]=4 2395 B7R1.15 C[C@H]1NC(=O)[C@H]1Br Amb25327771 [0,0,0,1,0,0|3,0,0]=4 2396 B7R1.15 C[C@H]1NC(=O)[C@H]1I Amb24561079 [0,0,0,1,0,0|3,0,0]=4 2397 B7R1.15 NC1C(S)NC1=O Amb24479821 [0,0,0,1,0,0|1,1,0]=3 2398 B7R1.15 O=C1NC(Cl)C1Br Amb25828416 [0,0,0,1,0,0|3,0,0]=4 2399 B7R1.15 O=C1N[C@H](Cl)[C@H]1Br Amb24563354 [0,0,0,1,0,0|3,0,0]=4 2400 B7R1.17 CC1(O)CCC1N Amb24117490 [0,0,0,1,0,0|2,0,1]=4 2401 B7R1.17 C[C@@]1(O)CC[C@@H]1N Amb24694300 [0,0,0,1,0,0|2,0,1]=4 2402 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [0,0,0,1,0,0|3,0,0]=4 2403 B7R1.18 CC(=O)C1CCO1 Amb25745997 [0,0,0,1,0,0|3,0,0]=4 2404 B7R1.18 CC(=O)C1CCS1 Amb24105980 [0,0,0,1,0,0|3,0,0]=4 2405 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,0,0,1,0,0|3,0,0]=4 2406 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,0,0,1,0,0|3,0,0]=4 2407 B7R1.18 CC(O)C1CCN1 Amb25195548 [0,0,0,1,0,0|2,0,1]=4 2408 B7R1.18 NC(=N)[C@H]1CCN1 Amb24542766 [0,0,0,1,0,0|3,0,0]=4 2409 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,0]=3 2410 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,0]=3 2411 B7R1.18 NC(=O)C1CCO1 Amb24478900 [0,0,0,1,0,0|3,0,0]=4 2412 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,0,1,0,0|3,0,0]=4 2413 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,0,1,0,0|3,0,0]=4 2414 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,0,1,0,0|3,0,0]=4 2415 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [0,0,0,1,0,0|2,0,0]=3 2416 B7R1.18 OB(O)C1COC1 Amb24544756 [0,0,0,1,0,0|2,0,1]=4 2417 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|2,0,1]=4 2418 B7R1.18 OC(=O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,0]=2 2419 B7R1.18 OC(=O)C1CCO1 Amb2383526 [0,0,0,1,0,0|2,0,0]=3 2420 B7R1.18 OC(=O)C1CNC1 Amb2444164 [0,0,0,1,0,0|2,0,0]=3 2421 B7R1.18 OC(=O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,1,0]=3 2422 B7R1.18 OP(=O)C1CNC1 Amb25212879 [0,0,0,1,0,0|3,0,0]=4 2423 B7R1.18 [O-][N+](=O)C1COC1 Amb22289560 [0,0,0,1,0,0|2,0,1]=4 2424 B7R1.19 CC(=O)C1(Br)CC1 Amb22498709 [0,0,0,1,0,0|3,0,0]=4 2425 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [0,0,0,1,0,0|3,0,0]=4 2426 B7R1.19 CC(=O)C1(Cl)CC1 Amb20671915 [0,0,0,1,0,0|3,0,0]=4 2427 B7R1.19 CC(=O)C1(F)CC1 Amb22388893 [0,0,0,1,0,0|3,0,0]=4 2428 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [0,0,0,1,0,0|2,0,0]=3 2429 B7R1.19 CC1(C=C1)C(O)=O Amb25042785 [0,0,0,1,0,0|2,0,1]=4 2430 B7R1.19 CC1(CC1)C(N)=O Amb19958822 [0,0,0,1,0,0|3,0,0]=4 2431 B7R1.19 CC1(CC1)C(N)=O Amb22752771 [0,0,0,1,0,0|3,0,0]=4 2432 B7R1.19 CC1(CO1)C(=O)O Amb17593087 [0,0,0,1,0,0|1,0,0]=2 2433 B7R1.19 CC1(CO1)C(N)=O Amb25261467 [0,0,0,1,0,0|2,0,0]=3 2434 B7R1.19 CC1(CS1)C(O)=O Amb24760846 [0,0,0,1,0,0|1,1,0]=3 2435 B7R1.19 C[C@@H](O)[C@]1(C)CO1 Amb24686435 [0,0,0,1,0,0|2,0,1]=4 2436 B7R1.19 C[C@@]1(CO1)C(O)=O Amb25785347 [0,0,0,1,0,0|1,0,0]=2 2437 B7R1.19 C[C@H](O)C1(C)CO1 Amb24719679 [0,0,0,1,0,0|2,0,1]=4 2438 B7R1.19 C[C@H](O)[C@]1(C)CO1 Amb25350322 [0,0,0,1,0,0|2,0,1]=4 2439 B7R1.19 C[C@]1(CO1)C(O)=O Amb25063884 [0,0,0,1,0,0|1,0,0]=2 2440 B7R1.19 ClC(=O)C1(C)CC1 Amb16230812 [0,0,0,1,0,0|3,0,0]=4 2441 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [0,0,0,1,0,0|3,0,0]=4 2442 B7R1.19 NC(=O)C1(N)CC1 Amb20622292 [0,0,0,1,0,0|2,0,0]=3 2443 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [0,0,0,1,0,0|2,0,0]=3 2444 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [0,0,0,1,0,0|3,0,0]=4 2445 B7R1.19 NC(=S)C1(N)CC1 Amb24640491 [0,0,0,1,0,0|2,1,0]=4 2446 B7R1.19 NC1(CC1)C(=O)Cl Amb24565891 [0,0,0,1,0,0|2,0,0]=3 2447 B7R1.19 O=C(F)C1(F)CC1 Amb24600068 [0,0,0,1,0,0|3,0,0]=4 2448 B7R1.19 OC(=O)C1(Br)CC1 Amb19888922 [0,0,0,1,0,0|2,0,0]=3 2449 B7R1.19 OC(=O)C1(Cl)CC1 Amb25841916 [0,0,0,1,0,0|2,0,0]=3 2450 B7R1.19 OC(=O)C1(F)CC1 Amb22001836 [0,0,0,1,0,0|2,0,0]=3 2451 B7R1.22 C[C@@H](CO)[C@H]1CO1 Amb25257153 [0,0,0,1,0,0|2,0,1]=4 2452 B7R1.22 NC(CO)C1CC1 Amb18282445 [0,0,0,1,0,0|2,0,1]=4 2453 B7R1.22 NC(CO)C1CC1 Amb19374057 [0,0,0,1,0,0|2,0,1]=4 2454 B7R1.22 N[C@@H](CO)C1CC1 Amb24077521 [0,0,0,1,0,0|2,0,1]=4 2455 B7R1.22 N[C@@H](CO)C1CC1 Amb25798421 [0,0,0,1,0,0|2,0,1]=4 2456 B7R1.22 N[C@H](CO)C1CC1 Amb24077489 [0,0,0,1,0,0|2,0,1]=4 2457 B7R1.22 N[C@H](CO)C1CC1 Amb24568257 [0,0,0,1,0,0|2,0,1]=4 2458 B7R1.22 O[C@@H](CO)[C@@H]1CO1 Amb25245465 [0,0,0,1,0,0|2,0,1]=4 2459 B7R1.27 CC1(CC1O)CO Amb24699167 [0,0,0,1,0,0|2,0,1]=4 2460 B7R1.27 CC1(CO)CC1=C Amb24577215 [0,0,0,1,0,0|3,0,0]=4 2461 B7R1.27 CC1OC1(O)CO Amb25173824 [0,0,0,1,0,0|2,0,1]=4 2462 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [0,0,0,0,0,1|1,0,1]=3 2463 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [0,0,0,0,0,1|2,0,1]=4 2464 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [0,0,0,0,0,1|3,0,0]=4 2465 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [0,0,0,0,0,1|3,0,0]=4 2466 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,0,0,0,0,1|3,0,0]=4 2467 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,0,0,0,0,1|2,0,1]=4 2468 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,0,0,0,0,1|2,0,1]=4 2469 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,0,0,0,0,1|2,0,1]=4 2470 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,0,0,0,0,1|1,0,1]=3 2471 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,0,0,0,0,1|2,0,1]=4 2472 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,0,0,0,0,1|2,0,1]=4 2473 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,0,0,0,0,1|2,0,1]=4 2474 B7R0.2 CC(=C)CC(N)CO Amb24665584 [0,0,0,0,0,1|2,0,0]=3 2475 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,0,0,0,0,1|3,0,0]=4 2476 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [0,0,0,0,0,1|3,0,0]=4 2477 B7R0.2 CC(=O)CC(O)CO Amb25304727 [0,0,0,0,0,1|2,0,0]=3 2478 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [0,0,0,0,0,1|2,0,0]=3 2479 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [0,0,0,0,0,1|3,0,0]=4 2480 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,0,0,0,0,1|3,0,0]=4 2481 B7R0.2 CC(=O)OC(Cl)CBr Amb25843189 [0,0,0,0,0,1|3,0,0]=4 2482 B7R0.2 CC(=O)OC(Cl)CCl Amb22729073 [0,0,0,0,0,1|3,0,0]=4 2483 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,0,0,0,0,1|2,0,1]=4 2484 B7R0.2 CC(C)=CC(O)CO Amb25144589 [0,0,0,0,0,1|3,0,0]=4 2485 B7R0.2 CC(C)CC(N)CO Amb18015118 [0,0,0,0,0,1|2,0,1]=4 2486 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [0,0,0,0,0,1|2,0,1]=4 2487 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [0,0,0,0,0,1|2,0,1]=4 2488 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [0,0,0,0,0,1|3,0,0]=4 2489 B7R0.2 CC(CBr)NC(C)=O Amb25223671 [0,0,0,0,0,1|3,0,0]=4 2490 B7R0.2 CC(CBr)OC(N)=O Amb24368693 [0,0,0,0,0,1|3,0,0]=4 2491 B7R0.2 CC(CC(N)=O)CN Amb18641899 [0,0,0,0,0,1|3,0,0]=4 2492 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,0,0,0,0,1|2,0,1]=4 2493 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,0,0,0,0,1|1,0,2]=4 2494 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,0,0,0,0,1|1,0,0]=2 2495 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,0,0,0,0,1|3,0,0]=4 2496 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,0,0,0,0,1|3,0,0]=4 2497 B7R0.2 CC(CCl)OC(C)=O Amb24481416 [0,0,0,0,0,1|3,0,0]=4 2498 B7R0.2 CC(CF)NC(C)=O Amb25077726 [0,0,0,0,0,1|3,0,0]=4 2499 B7R0.2 CC(CF)NC(N)=O Amb24354538 [0,0,0,0,0,1|3,0,0]=4 2500 B7R0.2 CC(CN)CC(C)=O Amb18251072 [0,0,0,0,0,1|3,0,0]=4 2501 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,0,0,0,0,1|2,0,0]=3 2502 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,0,0,0,0,1|2,0,0]=3 2503 B7R0.2 CC(CN)CP(O)=O Amb25757942 [0,0,0,0,0,1|3,0,0]=4 2504 B7R0.2 CC(CN)NC(C)=O Amb18251073 [0,0,0,0,0,1|3,0,0]=4 2505 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,0,0,0,0,1|3,0,0]=4 2506 B7R0.2 CC(CN)SC(C)=O Amb25255492 [0,0,0,0,0,1|3,0,0]=4 2507 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,0,0,0,0,1|1,0,1]=3 2508 B7R0.2 CC(CO)CC(C)=O Amb24606485 [0,0,0,0,0,1|2,0,0]=3 2509 B7R0.2 CC(CO)CC(N)=N Amb24579212 [0,0,0,0,0,1|3,0,0]=4 2510 B7R0.2 CC(CO)CC(N)=O Amb24452895 [0,0,0,0,0,1|2,0,0]=3 2511 B7R0.2 CC(CO)N=C(C)C Amb24699220 [0,0,0,0,0,1|3,0,0]=4 2512 B7R0.2 CC(CO)NC(C)=S Amb24482996 [0,0,0,0,0,1|2,1,0]=4 2513 B7R0.2 CC(CO)OC(C)=O Amb25144303 [0,0,0,0,0,1|2,0,0]=3 2514 B7R0.2 CC(CO)OP(O)=O Amb24643413 [0,0,0,0,0,1|2,0,0]=3 2515 B7R0.2 CC(CO)SC(N)=N Amb25119560 [0,0,0,0,0,1|3,0,0]=4 2516 B7R0.2 CC(CO)\C=C(\C)/Br Amb25807120 [0,0,0,0,0,1|3,0,0]=4 2517 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,0,0,0,0,1|1,1,1]=4 2518 B7R0.2 CC(NC(=O)N)CC Amb1105272 [0,0,0,0,0,1|3,0,0]=4 2519 B7R0.2 CC(O)CC(C)CO Amb25262806 [0,0,0,0,0,1|2,0,1]=4 2520 B7R0.2 CC(O)CC(N)CI Amb25197705 [0,0,0,0,0,1|2,0,1]=4 2521 B7R0.2 CC(O)CC(N)CO Amb25828018 [0,0,0,0,0,1|1,0,1]=3 2522 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,0,0,0,0,1|2,0,1]=4 2523 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,0,0,0,0,1|2,0,1]=4 2524 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,0,0,0,0,1|2,0,0]=3 2525 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,0,0,0,0,1|3,0,0]=4 2526 B7R0.2 CCC(C)NC(O)=S Amb25368326 [0,0,0,0,0,1|2,1,0]=4 2527 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,0,0,0,0,1|3,0,0]=4 2528 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,0,0,0,0,1|3,0,0]=4 2529 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,0,0,0,0,1|3,0,0]=4 2530 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,0,0,0,0,1|1,0,0]=2 2531 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,0,0,0,0,1|2,0,0]=3 2532 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [0,0,0,0,0,1|3,0,0]=4 2533 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [0,0,0,0,0,1|3,0,0]=4 2534 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,0,0,0,0,1|2,0,1]=4 2535 B7R0.2 CCC(N)CC(C)=C Amb24367516 [0,0,0,0,0,1|3,0,0]=4 2536 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,0,0,0,0,1|2,0,0]=3 2537 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,0,0,0,0,1|2,0,0]=3 2538 B7R0.2 CCC(N)CS(C)=O Amb24481377 [0,0,0,0,0,1|3,0,0]=4 2539 B7R0.2 CCC(N)NC(C)=O Amb25062531 [0,0,0,0,0,1|2,0,0]=3 2540 B7R0.2 CCC(N)NC(N)=N Amb25275524 [0,0,0,0,0,1|3,0,0]=4 2541 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,0,0,0,0,1|3,0,0]=4 2542 B7R0.2 CCC(O)CC(N)=O Amb24616660 [0,0,0,0,0,1|3,0,0]=4 2543 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,0,0,0,0,1|2,0,0]=3 2544 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,0,0,0,0,1|2,0,0]=3 2545 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,0,0,0,0,1|2,0,0]=3 2546 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,0,1|3,0,0]=4 2547 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,0,0,0,0,1|2,0,0]=3 2548 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,0,0,0,0,1|3,0,0]=4 2549 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,0,0,0,0,1|3,0,0]=4 2550 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [0,0,0,0,0,1|3,0,0]=4 2551 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,0,0,0,0,1|1,0,0]=2 2552 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,0,0,0,0,1|3,0,0]=4 2553 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,0,0,0,0,1|2,0,0]=3 2554 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,0,0,0,0,1|3,0,0]=4 2555 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [0,0,0,0,0,1|3,0,0]=4 2556 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,0,0,0,0,1|1,0,0]=2 2557 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,0,0,0,0,1|3,0,0]=4 2558 B7R0.2 CC\C(\N)=C/C(N)=O Amb24624408 [0,0,0,0,0,1|2,0,1]=4 2559 B7R0.2 CN(C)CC(N)CO Amb25742525 [0,0,0,0,0,1|3,0,0]=4 2560 B7R0.2 CN(C)C[C@@H](N)CO Amb24411936 [0,0,0,0,0,1|3,0,0]=4 2561 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,0,0,0,0,1|3,0,0]=4 2562 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,0,0,0,0,1|3,0,0]=4 2563 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,0,0,0,0,1|3,0,0]=4 2564 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,0,0,0,0,1|3,0,0]=4 2565 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [0,0,0,0,0,1|2,0,0]=3 2566 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,0,0,0,0,1|3,0,0]=4 2567 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,0,0,0,0,1|3,0,0]=4 2568 B7R0.2 C[C@@H](CCl)OC(C)=O Amb24419691 [0,0,0,0,0,1|3,0,0]=4 2569 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [0,0,0,0,0,1|3,0,0]=4 2570 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [0,0,0,0,0,1|2,0,0]=3 2571 B7R0.2 C[C@@H](CO)N=C(C)C Amb25343868 [0,0,0,0,0,1|3,0,0]=4 2572 B7R0.2 C[C@@H](CO)NC(N)=N Amb24724774 [0,0,0,0,0,1|3,0,0]=4 2573 B7R0.2 C[C@@H](CO)NC(N)=O Amb25315937 [0,0,0,0,0,1|2,0,0]=3 2574 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [0,0,0,0,0,1|2,0,0]=3 2575 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [0,0,0,0,0,1|2,0,1]=4 2576 B7R0.2 C[C@H](CBr)NC(C)=O Amb24690410 [0,0,0,0,0,1|3,0,0]=4 2577 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,0,0,0,0,1|2,0,1]=4 2578 B7R0.2 C[C@H](CO)C=C(C)C Amb25850751 [0,0,0,0,0,1|3,0,0]=4 2579 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [0,0,0,0,0,1|2,0,0]=3 2580 B7R0.2 C[C@H](CO)NC(C)=S Amb24746025 [0,0,0,0,0,1|2,1,0]=4 2581 B7R0.2 C[C@H](CO)NC(N)=O Amb24682644 [0,0,0,0,0,1|2,0,0]=3 2582 B7R0.2 C[C@H](CO)\C=C(\C)/Br Amb25682034 [0,0,0,0,0,1|3,0,0]=4 2583 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [0,0,0,0,0,1|2,0,1]=4 2584 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [0,0,0,0,0,1|1,0,1]=3 2585 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,0,0,0,0,1|2,0,1]=4 2586 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,0,0,0,0,1|2,0,1]=4 2587 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,0,0,0,0,1|2,0,1]=4 2588 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,0,0,0,0,1|2,0,1]=4 2589 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,0,0,0,0,1|1,0,1]=3 2590 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,0,0,0,0,1|2,0,1]=4 2591 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,0,0,0,0,1|2,0,0]=3 2592 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [0,0,0,0,0,1|3,0,0]=4 2593 B7R0.2 NC(CC(N)=O)C#N Amb24122907 [0,0,0,0,0,1|2,0,1]=4 2594 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [0,0,0,0,0,1|1,0,2]=4 2595 B7R0.2 NC(CF)CC(O)=O Amb24428065 [0,0,0,0,0,1|1,0,0]=2 2596 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,0,0,0,0,1|0,0,1]=2 2597 B7R0.2 NC(CO)CC(N)=O Amb24384089 [0,0,0,0,0,1|1,0,0]=2 2598 B7R0.2 NC(CS)CC(O)=O Amb25090412 [0,0,0,0,0,1|0,1,0]=2 2599 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,0,0,0,0,1|2,0,1]=4 2600 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,0,0,0,0,1|2,0,1]=4 2601 B7R0.2 NCC(F)CC(O)=O Amb24550169 [0,0,0,0,0,1|2,0,0]=3 2602 B7R0.2 NCC(N)=NS(O)=O Amb24629109 [0,0,0,0,0,1|2,0,1]=4 2603 B7R0.2 NCC(N)CC(O)=O Amb19515145 [0,0,0,0,0,1|1,0,0]=2 2604 B7R0.2 NCC(N)CC(O)=O Amb21858324 [0,0,0,0,0,1|1,0,0]=2 2605 B7R0.2 NCC(N)CC(O)=O Amb22751661 [0,0,0,0,0,1|1,0,0]=2 2606 B7R0.2 NCC(O)CC(N)=O Amb18641952 [0,0,0,0,0,1|3,0,0]=4 2607 B7R0.2 NCC(O)CP(O)=O Amb24714285 [0,0,0,0,0,1|3,0,0]=4 2608 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [0,0,0,0,0,1|3,0,0]=4 2609 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [0,0,0,0,0,1|1,0,0]=2 2610 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [0,0,0,0,0,1|1,0,0]=2 2611 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [0,0,0,0,0,1|1,0,0]=2 2612 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [0,0,0,0,0,1|3,0,0]=4 2613 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [0,0,0,0,0,1|1,0,0]=2 2614 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [0,0,0,0,0,1|3,0,0]=4 2615 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,0,0,0,0,1|2,0,1]=4 2616 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [0,0,0,0,0,1|1,0,2]=4 2617 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [0,0,0,0,0,1|1,0,1]=3 2618 B7R0.2 N[C@@H](CC([O-])=O)C=O Amb22800169 [0,0,0,0,0,1|0,0,3]=4 2619 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [0,0,0,0,0,1|1,0,0]=2 2620 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,0,0,0,0,1|0,0,2]=3 2621 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [0,0,0,0,0,1|0,0,0]=1 2622 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [0,0,0,0,0,1|1,0,0]=2 2623 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,0,0,0,0,1|2,0,1]=4 2624 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [0,0,0,0,0,1|3,0,0]=4 2625 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,0,0,0,0,1|2,0,1]=4 2626 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,0,0,0,0,1|2,0,1]=4 2627 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [0,0,0,0,0,1|2,0,0]=3 2628 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [0,0,0,0,0,1|2,0,0]=3 2629 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,0,0,0,0,1|1,0,2]=4 2630 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,0,0,0,0,1|2,0,1]=4 2631 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,0,0,0,0,1|2,0,1]=4 2632 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [0,0,0,0,0,1|3,0,0]=4 2633 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [0,0,0,0,0,1|2,0,0]=3 2634 B7R0.2 OCC(O)C=C(Cl)Cl Amb25848600 [0,0,0,0,0,1|3,0,0]=4 2635 B7R0.2 OCC(O)CP(O)=O Amb25316128 [0,0,0,0,0,1|2,0,0]=3 2636 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [0,0,0,0,0,1|0,0,0]=1 2637 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [0,0,0,0,0,1|1,0,0]=2 2638 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [0,0,0,0,0,1|2,0,0]=3 2639 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [0,0,0,0,0,1|1,0,1]=3 2640 B4R0.1 BC(=O)OC Amb22337865 [2,0,0,0,0,0|2,0,0]=4 2641 B4R0.1 BC(=O)OC Amb25199772 [2,0,0,0,0,0|2,0,0]=4 2642 B4R0.1 BCC(C)=O Amb25024392 [2,0,0,0,0,0|2,0,0]=4 2643 B4R0.1 C=C(Br)CO Amb20620404 [2,0,0,0,0,0|1,0,1]=4 2644 B4R0.1 C=C(Cl)CN Amb18948531 [2,0,0,0,0,0|2,0,0]=4 2645 B4R0.1 C=C(Cl)CN Amb19514508 [2,0,0,0,0,0|2,0,0]=4 2646 B4R0.1 C=C(F)CN Amb22008378 [2,0,0,0,0,0|2,0,0]=4 2647 B4R0.1 C=C(F)CO Amb22008254 [2,0,0,0,0,0|1,0,1]=4 2648 B4R0.1 C=CC(O)=O Amb22227738 [2,0,0,0,0,0|0,0,2]=4 2649 B4R0.1 C=CC(O)=O Amb22336305 [2,0,0,0,0,0|0,0,2]=4 2650 B4R0.1 C=CC(O)=O Amb22338581 [2,0,0,0,0,0|0,0,2]=4 2651 B4R0.1 C=CC(O)=O Amb22351186 [2,0,0,0,0,0|0,0,2]=4 2652 B4R0.1 C=CC(O)=O Amb22351399 [2,0,0,0,0,0|0,0,2]=4 2653 B4R0.1 C=CC(O)=O Amb22363130 [2,0,0,0,0,0|0,0,2]=4 2654 B4R0.1 C=C[13C](O)=O Amb22351199 [2,0,0,0,0,0|0,0,2]=4 2655 B4R0.1 CC(=C)CN Amb10071222 [2,0,0,0,0,0|2,0,0]=4 2656 B4R0.1 CC(=C)CN Amb17749039 [2,0,0,0,0,0|2,0,0]=4 2657 B4R0.1 CC(=C)[13CH]=O Amb22055667 [2,0,0,0,0,0|1,0,1]=4 2658 B4R0.1 CC(=N)CO Amb24478077 [2,0,0,0,0,0|2,0,0]=4 2659 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 2660 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,0]=3 2661 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,0]=3 2662 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|1,0,0]=3 2663 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|1,1,0]=4 2664 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 2665 B4R0.1 CC(=S)C=O Amb24477343 [2,0,0,0,0,0|1,0,1]=4 2666 B4R0.1 CC(Br)C=C Amb17939275 [2,0,0,0,0,0|2,0,0]=4 2667 B4R0.1 CC(C#N)N Amb1130364 [2,0,0,0,0,0|1,0,1]=4 2668 B4R0.1 CC(C)C=C Amb17666952 [2,0,0,0,0,0|2,0,0]=4 2669 B4R0.1 CC(C)NO Amb22058701 [2,0,0,0,0,0|2,0,0]=4 2670 B4R0.1 CC(C=O)Cl Amb10603585 [2,0,0,0,0,0|1,0,0]=3 2671 B4R0.1 CC(CF)O Amb10841218 [2,0,0,0,0,0|2,0,0]=4 2672 B4R0.1 CC(Cl)CO Amb20623180 [2,0,0,0,0,0|1,0,1]=4 2673 B4R0.1 CC(I)C=C Amb24597828 [2,0,0,0,0,0|2,0,0]=4 2674 B4R0.1 CC(I)C=O Amb24477178 [2,0,0,0,0,0|1,0,0]=3 2675 B4R0.1 CC(I)CO Amb24477272 [2,0,0,0,0,0|1,0,1]=4 2676 B4R0.1 CC(N)=CO Amb24478074 [2,0,0,0,0,0|0,0,1]=3 2677 B4R0.1 CC(N)C#C Amb19148041 [2,0,0,0,0,0|1,0,1]=4 2678 B4R0.1 CC(N)C#C Amb22266061 [2,0,0,0,0,0|1,0,1]=4 2679 B4R0.1 CC(N)C#N Amb22230844 [2,0,0,0,0,0|1,0,1]=4 2680 B4R0.1 CC(N)C=C Amb19338158 [2,0,0,0,0,0|1,0,0]=3 2681 B4R0.1 CC(N)C=C Amb20669464 [2,0,0,0,0,0|1,0,0]=3 2682 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|0,0,0]=2 2683 B4R0.1 CC(N)CCl Amb24670798 [2,0,0,0,0,0|1,0,1]=4 2684 B4R0.1 CC(N)CF Amb24113179 [2,0,0,0,0,0|1,0,1]=4 2685 B4R0.1 CC(N)CI Amb24693906 [2,0,0,0,0,0|1,0,1]=4 2686 B4R0.1 CC(N)CO Amb22230596 [2,0,0,0,0,0|0,0,1]=3 2687 B4R0.1 CC(N)CS Amb24476863 [2,0,0,0,0,0|0,1,1]=4 2688 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|1,0,0]=3 2689 B4R0.1 CC(O)CI Amb25790038 [2,0,0,0,0,0|2,0,0]=4 2690 B4R0.1 CC(O)CN Amb22733873 [2,0,0,0,0,0|1,0,1]=4 2691 B4R0.1 CC(O)CO Amb22231414 [2,0,0,0,0,0|1,0,0]=3 2692 B4R0.1 CC(O)CO Amb22336184 [2,0,0,0,0,0|1,0,0]=3 2693 B4R0.1 CC(O)CO Amb22336311 [2,0,0,0,0,0|1,0,0]=3 2694 B4R0.1 CC(O)CO Amb22337860 [2,0,0,0,0,0|1,0,0]=3 2695 B4R0.1 CC(O)CO Amb22337955 [2,0,0,0,0,0|1,0,0]=3 2696 B4R0.1 CC(O)CO Amb22338488 [2,0,0,0,0,0|1,0,0]=3 2697 B4R0.1 CC(O)CO Amb22730967 [2,0,0,0,0,0|1,0,0]=3 2698 B4R0.1 CC(O)CS Amb22348002 [2,0,0,0,0,0|1,1,0]=4 2699 B4R0.1 CC(O)NO Amb24333811 [2,0,0,0,0,0|2,0,0]=4 2700 B4R0.1 CC(S)C=C Amb24477940 [2,0,0,0,0,0|2,0,0]=4 2701 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|1,0,0]=3 2702 B4R0.1 CC(S)CO Amb19375527 [2,0,0,0,0,0|1,0,1]=4 2703 B4R0.1 CCC(=C)Br Amb22052658 [2,0,0,0,0,0|2,0,0]=4 2704 B4R0.1 CCC(=C)C Amb10069004 [2,0,0,0,0,0|2,0,0]=4 2705 B4R0.1 CCC(=C)Cl Amb22228725 [2,0,0,0,0,0|2,0,0]=4 2706 B4R0.1 CCC(=C)O Amb22338693 [2,0,0,0,0,0|1,0,0]=3 2707 B4R0.1 CCC(=O)Cl Amb22338551 [2,0,0,0,0,0|1,0,0]=3 2708 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 2709 B4R0.1 CCC(=S)N Amb1114671 [2,0,0,0,0,0|1,1,0]=4 2710 B4R0.1 CCC(N)N Amb20247705 [2,0,0,0,0,0|2,0,0]=4 2711 B4R0.1 CCC(N)O Amb25076743 [2,0,0,0,0,0|1,0,0]=3 2712 B4R0.1 CCC(N)S Amb25068621 [2,0,0,0,0,0|1,1,0]=4 2713 B4R0.1 CCC(O)=O Amb22363268 [2,0,0,0,0,0|0,0,0]=2 2714 B4R0.1 CCC(O)Br Amb25045070 [2,0,0,0,0,0|1,0,1]=4 2715 B4R0.1 CCC(O)Cl Amb24390895 [2,0,0,0,0,0|1,0,1]=4 2716 B4R0.1 CCC(O)S Amb25057963 [2,0,0,0,0,0|0,1,1]=4 2717 B4R0.1 CCC(S)=S Amb25219037 [2,0,0,0,0,0|0,2,0]=4 2718 B4R0.1 CCC([O-])=O Amb17942918 [2,0,0,0,0,0|0,0,1]=3 2719 B4R0.1 CCC([O-])=O Amb22043363 [2,0,0,0,0,0|0,0,1]=3 2720 B4R0.1 CCC([O-])=O Amb22053980 [2,0,0,0,0,0|0,0,1]=3 2721 B4R0.1 CCC([O-])=O Amb22353324 [2,0,0,0,0,0|0,0,1]=3 2722 B4R0.1 CCC([O-])=O Amb22730265 [2,0,0,0,0,0|0,0,1]=3 2723 B4R0.1 CCC([O-])=O Amb22731204 [2,0,0,0,0,0|0,0,1]=3 2724 B4R0.1 CCC([O-])=O Amb22732964 [2,0,0,0,0,0|0,0,1]=3 2725 B4R0.1 CCC([O-])=O Amb22733966 [2,0,0,0,0,0|0,0,1]=3 2726 B4R0.1 CCI(=O)=O Amb25809920 [2,0,0,0,0,0|1,0,1]=4 2727 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 2728 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 2729 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 2730 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 2731 B4R0.1 CCS(O)=O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 2732 B4R0.1 CCS([O-])=O Amb17943109 [2,0,0,0,0,0|1,0,1]=4 2733 B4R0.1 CCS([O-])=O Amb22411287 [2,0,0,0,0,0|1,0,1]=4 2734 B4R0.1 CC[13C](O)=O Amb22336570 [2,0,0,0,0,0|0,0,0]=2 2735 B4R0.1 CC[13C](O)=O Amb22732548 [2,0,0,0,0,0|0,0,0]=2 2736 B4R0.1 CC[13C]([O-])=O Amb22363364 [2,0,0,0,0,0|0,0,1]=3 2737 B4R0.1 CC[C@@H](C)N Amb22225170 [2,0,0,0,0,0|1,0,1]=4 2738 B4R0.1 CC[C@@H](N)O Amb25824305 [2,0,0,0,0,0|1,0,0]=3 2739 B4R0.1 CC[C@H](C)N Amb19889468 [2,0,0,0,0,0|1,0,1]=4 2740 B4R0.1 CN(C)C=O Amb22168323 [2,0,0,0,0,0|2,0,0]=4 2741 B4R0.1 CN(C)[13CH]=O Amb22363163 [2,0,0,0,0,0|2,0,0]=4 2742 B4R0.1 CN(C=O)N Amb10843911 [2,0,0,0,0,0|1,0,0]=3 2743 B4R0.1 CNC(=O)Br Amb25764660 [2,0,0,0,0,0|2,0,0]=4 2744 B4R0.1 CNC(=O)N Amb1152075 [2,0,0,0,0,0|2,0,0]=4 2745 B4R0.1 CNC(C)N Amb25811368 [2,0,0,0,0,0|2,0,0]=4 2746 B4R0.1 CNC(Cl)=O Amb17942998 [2,0,0,0,0,0|2,0,0]=4 2747 B4R0.1 CNC(N)=O Amb22899158 [2,0,0,0,0,0|2,0,0]=4 2748 B4R0.1 CNC(O)=S Amb25747283 [2,0,0,0,0,0|1,1,0]=4 2749 B4R0.1 COC([O-])=O Amb22731820 [2,0,0,0,0,0|1,0,1]=4 2750 B4R0.1 COC([O-])=O Amb25688001 [2,0,0,0,0,0|1,0,1]=4 2751 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 2752 B4R0.1 CSC(C)=O Amb22043188 [2,0,0,0,0,0|2,0,0]=4 2753 B4R0.1 CSC(C)N Amb25363631 [2,0,0,0,0,0|2,0,0]=4 2754 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 2755 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [2,0,0,0,0,0|0,0,1]=3 2756 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [2,0,0,0,0,0|0,0,1]=3 2757 B4R0.1 C[15N](C)C=O Amb22338371 [2,0,0,0,0,0|2,0,0]=4 2758 B4R0.1 C[C@@H](Br)CO Amb24477146 [2,0,0,0,0,0|1,0,1]=4 2759 B4R0.1 C[C@@H](C#N)N Amb17399782 [2,0,0,0,0,0|1,0,1]=4 2760 B4R0.1 C[C@@H](CO)F Amb10840975 [2,0,0,0,0,0|1,0,1]=4 2761 B4R0.1 C[C@@H](N)C#C Amb23438860 [2,0,0,0,0,0|1,0,1]=4 2762 B4R0.1 C[C@@H](N)C#N Amb18542349 [2,0,0,0,0,0|1,0,1]=4 2763 B4R0.1 C[C@@H](N)C=C Amb22225390 [2,0,0,0,0,0|1,0,0]=3 2764 B4R0.1 C[C@@H](N)C=O Amb25090862 [2,0,0,0,0,0|0,0,0]=2 2765 B4R0.1 C[C@@H](N)CF Amb25745231 [2,0,0,0,0,0|1,0,1]=4 2766 B4R0.1 C[C@@H](N)CN Amb22747741 [2,0,0,0,0,0|1,0,1]=4 2767 B4R0.1 C[C@@H](N)CO Amb22748206 [2,0,0,0,0,0|0,0,1]=3 2768 B4R0.1 C[C@@H](N)CS Amb25745019 [2,0,0,0,0,0|0,1,1]=4 2769 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|1,0,0]=3 2770 B4R0.1 C[C@@H](O)CBr Amb20242351 [2,0,0,0,0,0|2,0,0]=4 2771 B4R0.1 C[C@@H](O)CI Amb20241371 [2,0,0,0,0,0|2,0,0]=4 2772 B4R0.1 C[C@@H](O)CS Amb25662551 [2,0,0,0,0,0|1,1,0]=4 2773 B4R0.1 C[C@@H](S)CO Amb25220615 [2,0,0,0,0,0|1,0,1]=4 2774 B4R0.1 C[C@H](Br)CO Amb24661942 [2,0,0,0,0,0|1,0,1]=4 2775 B4R0.1 C[C@H](CO)F Amb10840974 [2,0,0,0,0,0|1,0,1]=4 2776 B4R0.1 C[C@H](Cl)C=C Amb24477039 [2,0,0,0,0,0|2,0,0]=4 2777 B4R0.1 C[C@H](N)C=C Amb22226721 [2,0,0,0,0,0|1,0,0]=3 2778 B4R0.1 C[C@H](N)CF Amb20622784 [2,0,0,0,0,0|1,0,1]=4 2779 B4R0.1 C[C@H](N)CN Amb19515858 [2,0,0,0,0,0|1,0,1]=4 2780 B4R0.1 C[C@H](N)CN Amb20623334 [2,0,0,0,0,0|1,0,1]=4 2781 B4R0.1 C[C@H](N)CS Amb24332667 [2,0,0,0,0,0|0,1,1]=4 2782 B4R0.1 C[C@H](O)C=O Amb24452140 [2,0,0,0,0,0|1,0,0]=3 2783 B4R0.1 C[C@H](O)CBr Amb24477066 [2,0,0,0,0,0|2,0,0]=4 2784 B4R0.1 C[C@H](O)CF Amb24524627 [2,0,0,0,0,0|2,0,0]=4 2785 B4R0.1 C[C@H](O)CS Amb24554233 [2,0,0,0,0,0|1,1,0]=4 2786 B4R0.1 C[C@H](S)CO Amb25662302 [2,0,0,0,0,0|1,0,1]=4 2787 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|2,0,0]=4 2788 B4R0.1 C\C(=N\O)\N Amb10610482 [2,0,0,0,0,0|1,0,1]=4 2789 B4R0.1 C\C(\O)=N\O Amb22492489 [2,0,0,0,0,0|2,0,0]=4 2790 B4R0.1 ClCC(O)O Amb10575922 [2,0,0,0,0,0|2,0,0]=4 2791 B4R0.1 FC(=O)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 2792 B4R0.1 FCC(=O)Cl Amb16185604 [2,0,0,0,0,0|2,0,0]=4 2793 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|1,0,1]=4 2794 B4R0.1 NC(=O)CCl Amb20620153 [2,0,0,0,0,0|1,0,1]=4 2795 B4R0.1 NC(=O)CN Amb22234569 [2,0,0,0,0,0|1,0,0]=3 2796 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|0,0,1]=3 2797 B4R0.1 NC(=O)[15NH]O Amb17615941 [2,0,0,0,0,0|1,0,1]=4 2798 B4R0.1 NC(Cl)C=O Amb24696065 [2,0,0,0,0,0|1,0,0]=3 2799 B4R0.1 NC(O)CCl Amb24476943 [2,0,0,0,0,0|1,0,0]=3 2800 B4R0.1 NC(O)CO Amb25267126 [2,0,0,0,0,0|0,0,0]=2 2801 B4R0.1 NC(S)=CO Amb25173804 [2,0,0,0,0,0|0,1,1]=4 2802 B4R0.1 NC(S)CO Amb24392950 [2,0,0,0,0,0|0,1,0]=3 2803 B4R0.1 NCB(O)O Amb24477493 [2,0,0,0,0,0|1,0,1]=4 2804 B4R0.1 NCC(=C)Br Amb13951282 [2,0,0,0,0,0|2,0,0]=4 2805 B4R0.1 NCC(=N)N Amb17607865 [2,0,0,0,0,0|2,0,0]=4 2806 B4R0.1 NCC(=O)N Amb10604177 [2,0,0,0,0,0|1,0,0]=3 2807 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|0,1,0]=3 2808 B4R0.1 NCC(N)=N Amb24053305 [2,0,0,0,0,0|2,0,0]=4 2809 B4R0.1 NCC(N)=S Amb22059483 [2,0,0,0,0,0|1,1,0]=4 2810 B4R0.1 NCC(N)O Amb25340249 [2,0,0,0,0,0|1,0,0]=3 2811 B4R0.1 NCC(O)=O Amb22274145 [2,0,0,0,0,0|0,0,0]=2 2812 B4R0.1 NCC(O)=O Amb22731925 [2,0,0,0,0,0|0,0,0]=2 2813 B4R0.1 NCC(O)O Amb24605666 [2,0,0,0,0,0|0,0,2]=4 2814 B4R0.1 NCC([O-])=O Amb20240906 [2,0,0,0,0,0|0,0,1]=3 2815 B4R0.1 NCC([O-])=O Amb21962917 [2,0,0,0,0,0|0,0,1]=3 2816 B4R0.1 NCC([O-])=O Amb22167467 [2,0,0,0,0,0|0,0,1]=3 2817 B4R0.1 NCC([O-])=O Amb22167948 [2,0,0,0,0,0|0,0,1]=3 2818 B4R0.1 NCC([O-])=O Amb22336294 [2,0,0,0,0,0|0,0,1]=3 2819 B4R0.1 NCC([O-])=O Amb22493796 [2,0,0,0,0,0|0,0,1]=3 2820 B4R0.1 NCC([O-])=O Amb22729954 [2,0,0,0,0,0|0,0,1]=3 2821 B4R0.1 NCC([O-])=O Amb22729967 [2,0,0,0,0,0|0,0,1]=3 2822 B4R0.1 NCC([O-])=O Amb22733691 [2,0,0,0,0,0|0,0,1]=3 2823 B4R0.1 NCS([O-])=O Amb25146350 [2,0,0,0,0,0|1,0,1]=4 2824 B4R0.1 NC[13C](O)=O Amb22354047 [2,0,0,0,0,0|0,0,0]=2 2825 B4R0.1 N[13CH2]C(O)=O Amb22363299 [2,0,0,0,0,0|0,0,0]=2 2826 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [2,0,0,0,0,0|0,0,0]=2 2827 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 2828 B4R0.1 O=C(F)CF Amb24476837 [2,0,0,0,0,0|2,0,0]=4 2829 B4R0.1 O=C(P)CCl Amb24377624 [2,0,0,0,0,0|2,0,0]=4 2830 B4R0.1 O=CC(Cl)Br Amb22054538 [2,0,0,0,0,0|2,0,0]=4 2831 B4R0.1 O=CC(Cl)Cl Amb17593172 [2,0,0,0,0,0|2,0,0]=4 2832 B4R0.1 O=CC(Cl)Cl Amb22055052 [2,0,0,0,0,0|2,0,0]=4 2833 B4R0.1 OC(=O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 2834 B4R0.1 OC(=O)CI Amb22274295 [2,0,0,0,0,0|1,0,0]=3 2835 B4R0.1 OC(=O)CI Amb22353096 [2,0,0,0,0,0|1,0,0]=3 2836 B4R0.1 OC(=O)CO Amb22338156 [2,0,0,0,0,0|0,0,0]=2 2837 B4R0.1 OC(=O)CP Amb24476887 [2,0,0,0,0,0|0,1,0]=3 2838 B4R0.1 OC(=O)CS Amb22360787 [2,0,0,0,0,0|0,1,0]=3 2839 B4R0.1 OC(=O)CS Amb24323537 [2,0,0,0,0,0|0,1,0]=3 2840 B4R0.1 OC(=O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 2841 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [2,0,0,0,0,0|1,0,0]=3 2842 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [2,0,0,0,0,0|1,0,0]=3 2843 B4R0.1 OC(=O)[13CH2]I Amb22367368 [2,0,0,0,0,0|1,0,0]=3 2844 B4R0.1 OC(=S)CCl Amb25064312 [2,0,0,0,0,0|1,1,0]=4 2845 B4R0.1 OC(=[18O])CBr Amb22367291 [2,0,0,0,0,0|1,0,0]=3 2846 B4R0.1 OC(Cl)C=O Amb25700927 [2,0,0,0,0,0|1,0,0]=3 2847 B4R0.1 OC(O)CBr Amb25074543 [2,0,0,0,0,0|2,0,0]=4 2848 B4R0.1 OC(O)CF Amb25810677 [2,0,0,0,0,0|2,0,0]=4 2849 B4R0.1 OCC(=O)Cl Amb25121296 [2,0,0,0,0,0|1,0,0]=3 2850 B4R0.1 OCC(F)Br Amb22228819 [2,0,0,0,0,0|2,0,0]=4 2851 B4R0.1 OCC(O)=S Amb25245907 [2,0,0,0,0,0|0,1,0]=3 2852 B4R0.1 OCC(O)Br Amb25794267 [2,0,0,0,0,0|1,0,0]=3 2853 B4R0.1 OCC(O)Cl Amb24433225 [2,0,0,0,0,0|1,0,0]=3 2854 B4R0.1 OCC(O)I Amb25362172 [2,0,0,0,0,0|1,0,0]=3 2855 B4R0.1 OCC(O)O Amb25662266 [2,0,0,0,0,0|1,0,0]=3 2856 B4R0.1 OCC(S)=S Amb25746765 [2,0,0,0,0,0|0,2,0]=4 2857 B4R0.1 OCP(=O)O Amb1981423 [2,0,0,0,0,0|1,0,0]=3 2858 B4R0.1 OCS(=O)=O Amb25184792 [2,0,0,0,0,0|1,0,1]=4 2859 B4R0.1 ONC(O)O Amb24477378 [2,0,0,0,0,0|2,0,0]=4 2860 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [2,0,0,0,0,0|0,0,0]=2 2861 B4R0.1 O[13C](=O)CBr Amb22351346 [2,0,0,0,0,0|1,0,0]=3 2862 B4R0.1 O[13C](=O)CCl Amb22351545 [2,0,0,0,0,0|1,0,0]=3 2863 B4R0.1 O[13C](=O)CI Amb22367367 [2,0,0,0,0,0|1,0,0]=3 2864 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [2,0,0,0,0,0|1,0,0]=3 2865 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [2,0,0,0,0,0|1,0,0]=3 2866 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [2,0,0,0,0,0|1,0,0]=3 2867 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [2,0,0,0,0,0|0,0,2]=4 2868 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [2,0,0,0,0,0|0,0,2]=4 2869 B4R0.1 O[13C](=[18O])CBr Amb22337237 [2,0,0,0,0,0|1,0,0]=3 2870 B4R0.1 O[14C](=O)CBr Amb22731740 [2,0,0,0,0,0|1,0,0]=3 2871 B4R0.1 O[14C](=O)O[Na] Amb22350243 [2,0,0,0,0,0|2,0,0]=4 2872 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [2,0,0,0,0,0|0,0,1]=3 2873 B4R0.1 [13CH3]N([13CH3])C=O Amb22353459 [2,0,0,0,0,0|2,0,0]=4 2874 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [2,0,0,0,0,0|0,0,0]=2 2875 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [2,0,0,0,0,0|0,0,0]=2 2876 B4R0.1 [13CH3][13CH]([13CH3])[13CH2]O Amb22338875 [2,0,0,0,0,0|1,0,1]=4 2877 B4R0.1 [15NH2]C(=O)CI Amb22367467 [2,0,0,0,0,0|1,0,1]=4 2878 B4R0.1 [15NH2]CC(O)=O Amb22337980 [2,0,0,0,0,0|0,0,0]=2 2879 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [2,0,0,0,0,0|0,0,0]=2 2880 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [2,0,0,0,0,0|0,0,0]=2 2881 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [2,0,0,0,0,0|0,0,0]=2 2882 B4R0.1 [15NH2][13C](=O)[15NH]O Amb17615940 [2,0,0,0,0,0|1,0,1]=4 2883 B4R0.1 [15NH2][15NH][13C](=O)N Amb17620057 [2,0,0,0,0,0|2,0,0]=4 2884 B4R0.1 [O-]C(=O)CBr Amb22049507 [2,0,0,0,0,0|1,0,1]=4 2885 B4R0.1 [O-]C(=O)CC Amb10844614 [2,0,0,0,0,0|0,0,1]=3 2886 B4R0.1 [O-]C(=O)CCl Amb22330602 [2,0,0,0,0,0|1,0,1]=4 2887 B4R0.1 [O-]C(=O)CF Amb10840933 [2,0,0,0,0,0|1,0,1]=4 2888 B4R0.1 [O-]C(=O)CF Amb22230760 [2,0,0,0,0,0|1,0,1]=4 2889 B4R0.1 [O-]C(=O)CF Amb22730747 [2,0,0,0,0,0|1,0,1]=4 2890 B4R0.1 [O-]C(=O)CI Amb22229643 [2,0,0,0,0,0|1,0,1]=4 2891 B4R0.1 [O-]C(=O)CO Amb22045509 [2,0,0,0,0,0|0,0,1]=3 2892 B4R0.1 [O-]C(=O)CO Amb22730982 [2,0,0,0,0,0|0,0,1]=3 2893 B4R0.1 [O-]CC([O-])=O Amb22739620 [2,0,0,0,0,0|0,0,2]=4 2894 B4R0.1 [O-]S(=O)CO Amb19930207 [2,0,0,0,0,0|1,0,1]=4 2895 B4R0.2 C#CCC=O Amb25681696 [2,0,0,0,0,0|1,0,1]=4 2896 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|1,0,1]=4 2897 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|2,0,0]=4 2898 B4R0.2 C=CCCI Amb24079603 [2,0,0,0,0,0|2,0,0]=4 2899 B4R0.2 C=CCCS Amb24117955 [2,0,0,0,0,0|1,1,0]=4 2900 B4R0.2 CCCCO Amb22336484 [2,0,0,0,0,0|1,0,1]=4 2901 B4R0.2 CCCCO Amb22338139 [2,0,0,0,0,0|1,0,1]=4 2902 B4R0.2 CCCCO Amb22338167 [2,0,0,0,0,0|1,0,1]=4 2903 B4R0.2 CCCCO Amb22351678 [2,0,0,0,0,0|1,0,1]=4 2904 B4R0.2 CCCNO Amb20621997 [2,0,0,0,0,0|2,0,0]=4 2905 B4R0.2 CCCNO Amb24333131 [2,0,0,0,0,0|2,0,0]=4 2906 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|2,0,0]=4 2907 B4R0.2 CCO[13CH]=O Amb22351501 [2,0,0,0,0,0|2,0,0]=4 2908 B4R0.2 COCCO Amb22338563 [2,0,0,0,0,0|2,0,0]=4 2909 B4R0.2 C\C=C/CO Amb24089436 [2,0,0,0,0,0|1,0,1]=4 2910 B4R0.2 ClCCC=O Amb16233605 [2,0,0,0,0,0|1,0,0]=3 2911 B4R0.2 NCCC=C Amb10601640 [2,0,0,0,0,0|2,0,0]=4 2912 B4R0.2 NCCC=O Amb24476871 [2,0,0,0,0,0|1,0,0]=3 2913 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|1,0,1]=4 2914 B4R0.2 NCCCO Amb22350557 [2,0,0,0,0,0|1,0,1]=4 2915 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|2,0,0]=4 2916 B4R0.2 NCCS=O Amb25826403 [2,0,0,0,0,0|2,0,0]=4 2917 B4R0.2 NNCC=O Amb24550561 [2,0,0,0,0,0|2,0,0]=4 2918 B4R0.2 NOCCO Amb17190317 [2,0,0,0,0,0|2,0,0]=4 2919 B4R0.2 NOCCO Amb22896795 [2,0,0,0,0,0|2,0,0]=4 2920 B4R0.2 NSCCO Amb25025533 [2,0,0,0,0,0|2,0,0]=4 2921 B4R0.2 O=CCCBr Amb18124460 [2,0,0,0,0,0|1,0,0]=3 2922 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 2923 B4R0.2 O=CCN=O Amb24477338 [2,0,0,0,0,0|1,0,1]=4 2924 B4R0.2 O=CNCCl Amb24613099 [2,0,0,0,0,0|2,0,0]=4 2925 B4R0.2 O=NCCCl Amb25721260 [2,0,0,0,0,0|2,0,0]=4 2926 B4R0.2 OBOCO Amb25136257 [2,0,0,0,0,0|2,0,0]=4 2927 B4R0.2 OC=C=CO Amb24412119 [2,0,0,0,0,0|0,0,2]=4 2928 B4R0.2 OCCC=O Amb24412391 [2,0,0,0,0,0|0,0,0]=2 2929 B4R0.2 OCCCO Amb22369724 [2,0,0,0,0,0|0,0,1]=3 2930 B4R0.2 OCCCO Amb22733136 [2,0,0,0,0,0|0,0,1]=3 2931 B4R0.2 OCCNO Amb24477455 [2,0,0,0,0,0|1,0,0]=3 2932 B4R0.2 OCCNS Amb24478081 [2,0,0,0,0,0|1,1,0]=4 2933 B4R0.2 OCCSO Amb25840750 [2,0,0,0,0,0|1,0,0]=3 2934 B4R0.2 OCCSS Amb25058419 [2,0,0,0,0,0|1,1,0]=4 2935 B4R0.2 OCOC=O Amb25694134 [2,0,0,0,0,0|1,0,0]=3 2936 B4R0.2 OCOCO Amb25024936 [2,0,0,0,0,0|1,0,1]=4 2937 B4R0.2 OC[13CH2]CO Amb22338655 [2,0,0,0,0,0|0,0,1]=3 2938 B4R0.2 OC\C=C/I Amb23539305 [2,0,0,0,0,0|1,0,1]=4 2939 B4R0.2 OC\C=C\I Amb24642752 [2,0,0,0,0,0|1,0,1]=4 2940 B4R0.2 ON=CC=O Amb25746308 [2,0,0,0,0,0|1,0,1]=4 2941 B4R0.2 O[13CH2][13CH2][13CH2]Br Amb22338924 [2,0,0,0,0,0|1,0,1]=4 2942 B4R0.2 O\C=C/C=O Amb24567056 [2,0,0,0,0,0|0,0,2]=4 2943 B4R0.2 O\C=C/CCl Amb22338049 [2,0,0,0,0,0|1,0,1]=4 2944 B4R0.2 [13CH3]O[13CH2][13CH2]O Amb22337754 [2,0,0,0,0,0|2,0,0]=4 2945 B6R0.1 C=C(CCO)C#N Amb18638998 [1,1,0,0,0,0|2,0,0]=4 2946 B6R0.1 C=C(CCO)C=O Amb25278289 [1,1,0,0,0,0|1,0,0]=3 2947 B6R0.1 C=C(CCO)CO Amb25825219 [1,1,0,0,0,0|1,0,0]=3 2948 B6R0.1 C=C(CF)CCO Amb25334760 [1,1,0,0,0,0|2,0,0]=4 2949 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|2,0,0]=4 2950 B6R0.1 C=CC(=C)CCO Amb25343305 [1,1,0,0,0,0|2,0,0]=4 2951 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 2952 B6R0.1 C=CS(=O)CCO Amb25745331 [1,1,0,0,0,0|2,0,0]=4 2953 B6R0.1 CC(CO)=CCO Amb25296164 [1,1,0,0,0,0|1,0,1]=4 2954 B6R0.1 CC=C(C)CCO Amb22229371 [1,1,0,0,0,0|2,0,0]=4 2955 B6R0.1 CCC(=C)CCO Amb25261191 [1,1,0,0,0,0|2,0,0]=4 2956 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|2,0,0]=4 2957 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|1,1,0]=4 2958 B6R0.1 CCC(=O)OCO Amb25080504 [1,1,0,0,0,0|2,0,0]=4 2959 B6R0.1 CCCC(=C)C=O Amb18639170 [1,1,0,0,0,0|2,0,0]=4 2960 B6R0.1 CCCC(=N)NO Amb10069022 [1,1,0,0,0,0|2,0,0]=4 2961 B6R0.1 CCCC(=O)C#C Amb25696103 [1,1,0,0,0,0|2,0,0]=4 2962 B6R0.1 CCCC(=O)C=O Amb18639569 [1,1,0,0,0,0|1,0,1]=4 2963 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|2,0,0]=4 2964 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|2,0,0]=4 2965 B6R0.1 CCCC(=O)CF Amb25370812 [1,1,0,0,0,0|2,0,0]=4 2966 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|2,0,0]=4 2967 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|1,0,0]=3 2968 B6R0.1 CCCC(=O)CS Amb24631668 [1,1,0,0,0,0|1,1,0]=4 2969 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|1,1,0]=4 2970 B6R0.1 CCCC(C)=NO Amb24693854 [1,1,0,0,0,0|2,0,0]=4 2971 B6R0.1 CCCC(O)C=O Amb24531721 [1,1,0,0,0,0|1,0,1]=4 2972 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [1,1,0,0,0,0|1,0,0]=3 2973 B6R0.1 CCC\C(\N)=N\O Amb19890174 [1,1,0,0,0,0|2,0,0]=4 2974 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|2,0,0]=4 2975 B6R0.1 CCNC(=O)ON Amb25108031 [1,1,0,0,0,0|2,0,0]=4 2976 B6R0.1 CN(CCO)C=O Amb25849655 [1,1,0,0,0,0|2,0,0]=4 2977 B6R0.1 CN(CCO)CO Amb24691618 [1,1,0,0,0,0|2,0,0]=4 2978 B6R0.1 CNC(=N)CCO Amb25114075 [1,1,0,0,0,0|2,0,0]=4 2979 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 2980 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 2981 B6R0.1 CNC(=O)CCI Amb25205915 [1,1,0,0,0,0|2,0,0]=4 2982 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|2,0,0]=4 2983 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|1,0,0]=3 2984 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|1,1,0]=4 2985 B6R0.1 CNC(=O)CNO Amb24654673 [1,1,0,0,0,0|2,0,0]=4 2986 B6R0.1 CNCC(=O)NO Amb24640961 [1,1,0,0,0,0|2,0,0]=4 2987 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|2,0,0]=4 2988 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|2,0,0]=4 2989 B6R0.1 COC(=C)CCO Amb25024469 [1,1,0,0,0,0|1,0,0]=3 2990 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 2991 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 2992 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|1,0,0]=3 2993 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|0,0,2]=4 2994 B6R0.1 COC(=O)CCF Amb22748635 [1,1,0,0,0,0|1,0,0]=3 2995 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 2996 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,0]=3 2997 B6R0.1 COC(=O)CCN Amb22489470 [1,1,0,0,0,0|1,0,0]=3 2998 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 2999 B6R0.1 COC(=O)NCCl Amb24479773 [1,1,0,0,0,0|2,0,0]=4 3000 B6R0.1 COC(=O)OCC Amb22732530 [1,1,0,0,0,0|2,0,0]=4 3001 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 3002 B6R0.1 COC(=S)CCCl Amb25758715 [1,1,0,0,0,0|1,1,0]=4 3003 B6R0.1 COC(=S)CCS Amb10795255 [1,1,0,0,0,0|0,2,0]=4 3004 B6R0.1 COCC(=O)CO Amb24364722 [1,1,0,0,0,0|2,0,0]=4 3005 B6R0.1 COCC(=O)O[Na] Amb2227682 [1,1,0,0,0,0|2,0,0]=4 3006 B6R0.1 COS(=O)CCCl Amb24635086 [1,1,0,0,0,0|2,0,0]=4 3007 B6R0.1 COS(=O)CCO Amb25713675 [1,1,0,0,0,0|1,0,0]=3 3008 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [1,1,0,0,0,0|2,0,0]=4 3009 B6R0.1 CSC(=C)CCO Amb24617472 [1,1,0,0,0,0|1,1,0]=4 3010 B6R0.1 CSC(=O)CCCl Amb24735675 [1,1,0,0,0,0|1,1,0]=4 3011 B6R0.1 C[C@@H](CCO)CO Amb19944691 [1,1,0,0,0,0|1,0,1]=4 3012 B6R0.1 C[C@H](CCO)CO Amb22225176 [1,1,0,0,0,0|1,0,1]=4 3013 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|2,0,0]=4 3014 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|2,0,0]=4 3015 B6R0.1 C\C(\C=O)=C\CO Amb18639610 [1,1,0,0,0,0|1,0,1]=4 3016 B6R0.1 C\C=C(/C)\CCO Amb24674649 [1,1,0,0,0,0|2,0,0]=4 3017 B6R0.1 N#CC(=O)CCO Amb25730943 [1,1,0,0,0,0|1,0,0]=3 3018 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|1,0,0]=3 3019 B6R0.1 NC(CCF)=NO Amb24540455 [1,1,0,0,0,0|2,0,0]=4 3020 B6R0.1 NC(CCO)C=O Amb25259176 [1,1,0,0,0,0|1,0,1]=4 3021 B6R0.1 NCC(=O)CCN Amb18121893 [1,1,0,0,0,0|2,0,0]=4 3022 B6R0.1 NCC(=O)CCN Amb22227739 [1,1,0,0,0,0|2,0,0]=4 3023 B6R0.1 NCC(=O)CCN Amb22360700 [1,1,0,0,0,0|2,0,0]=4 3024 B6R0.1 NCC(=O)OCO Amb22233222 [1,1,0,0,0,0|2,0,0]=4 3025 B6R0.1 NCC(O)CCO Amb22011571 [1,1,0,0,0,0|1,0,1]=4 3026 B6R0.1 NCCC(=O)CBr Amb24479170 [1,1,0,0,0,0|2,0,0]=4 3027 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|2,0,0]=4 3028 B6R0.1 NCCC(=O)NO Amb22751684 [1,1,0,0,0,0|1,0,0]=3 3029 B6R0.1 NCCC(N)=NO Amb24761482 [1,1,0,0,0,0|2,0,0]=4 3030 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|1,0,1]=4 3031 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|1,0,0]=3 3032 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|1,1,0]=4 3033 B6R0.1 O=C(CCCl)CCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 3034 B6R0.1 O=C(CCCl)NBr Amb24391501 [1,1,0,0,0,0|2,0,0]=4 3035 B6R0.1 O=C(CCCl)NCl Amb24427328 [1,1,0,0,0,0|2,0,0]=4 3036 B6R0.1 OCC(=O)CCO Amb24061314 [1,1,0,0,0,0|0,0,0]=2 3037 B6R0.1 OCC(=O)CCS Amb24332279 [1,1,0,0,0,0|0,1,0]=3 3038 B6R0.1 OCC(Cl)CCO Amb24441411 [1,1,0,0,0,0|1,0,1]=4 3039 B6R0.1 OCCC(=NO)N Amb13952693 [1,1,0,0,0,0|1,0,0]=3 3040 B6R0.1 OCCC(=O)CBr Amb25210851 [1,1,0,0,0,0|1,0,0]=3 3041 B6R0.1 OCCC(=O)CCl Amb24674169 [1,1,0,0,0,0|1,0,0]=3 3042 B6R0.1 OCCC(=O)CO Amb10603377 [1,1,0,0,0,0|0,0,0]=2 3043 B6R0.1 OCCC(O)CCl Amb25361069 [1,1,0,0,0,0|1,0,1]=4 3044 B6R0.1 OCCS(=O)CC Amb10669566 [1,1,0,0,0,0|2,0,0]=4 3045 B6R0.1 OCC[C@@H](O)C=O Amb24741761 [1,1,0,0,0,0|0,0,1]=3 3046 B6R0.1 OCC[C@H](CO)O Amb10071064 [1,1,0,0,0,0|0,0,2]=4 3047 B6R0.1 OCC[C@H](O)CCl Amb25714009 [1,1,0,0,0,0|1,0,1]=4 3048 B6R0.1 OCC\C(=N\O)\N Amb1113605 [1,1,0,0,0,0|1,0,0]=3 3049 B6R0.1 OCNC(=O)CBr Amb25286051 [1,1,0,0,0,0|2,0,0]=4 3050 B6R0.1 OCNC(=O)CCl Amb1153096 [1,1,0,0,0,0|2,0,0]=4 3051 B6R0.1 OCNC(=O)CI Amb24374693 [1,1,0,0,0,0|2,0,0]=4 3052 B6R0.1 OC[C@H](Br)CCO Amb25697346 [1,1,0,0,0,0|1,0,1]=4 3053 B6R0.1 OC\C(\F)=C/CO Amb25769384 [1,1,0,0,0,0|1,0,1]=4 3054 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,1,0,0,0,0|1,0,1]=4 3055 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,1,0,0,0,0|1,0,1]=4 3056 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [1,1,0,0,0,0|1,0,1]=4 3057 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [1,1,0,0,0,0|2,0,0]=4 3058 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,1,0,0,0,0|2,0,0]=4 3059 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,1,0,0,0,0|0,0,2]=4 3060 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,1,0,0,0,0|1,0,1]=4 3061 B6R0.2 CC(=O)CC(O)O Amb25273111 [1,1,0,0,0,0|1,0,0]=3 3062 B6R0.2 CC(Br)CC(N)=O Amb24635749 [1,1,0,0,0,0|2,0,0]=4 3063 B6R0.2 CC(C)CC([O-])=O Amb22732147 [1,1,0,0,0,0|1,0,1]=4 3064 B6R0.2 CC(C)CC([O-])=O Amb22732282 [1,1,0,0,0,0|1,0,1]=4 3065 B6R0.2 CC(C)CC([O-])=O Amb22734041 [1,1,0,0,0,0|1,0,1]=4 3066 B6R0.2 CC(C)CC([O-])=O Amb22734425 [1,1,0,0,0,0|1,0,1]=4 3067 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,1,0,0,0,0|1,0,0]=3 3068 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [1,1,0,0,0,0|1,0,1]=4 3069 B6R0.2 CC(CC(=C)C)O Amb17593083 [1,1,0,0,0,0|2,0,0]=4 3070 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [1,1,0,0,0,0|2,0,0]=4 3071 B6R0.2 CC(CC(=O)C)N Amb2583230 [1,1,0,0,0,0|2,0,0]=4 3072 B6R0.2 CC(CC(=O)C)O Amb17593091 [1,1,0,0,0,0|1,0,0]=3 3073 B6R0.2 CC(CC(O)C)O Amb10068523 [1,1,0,0,0,0|1,0,1]=4 3074 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,1,0,0,0,0|1,0,0]=3 3075 B6R0.2 CC(I)CC(N)=O Amb25783800 [1,1,0,0,0,0|2,0,0]=4 3076 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [1,1,0,0,0,0|2,0,0]=4 3077 B6R0.2 CC(N)CC(C)=O Amb22587050 [1,1,0,0,0,0|2,0,0]=4 3078 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,1,0,0,0,0|2,0,0]=4 3079 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,1,0,0,0,0|1,0,0]=3 3080 B6R0.2 CC(O)=CC(O)O Amb24431523 [1,1,0,0,0,0|1,0,1]=4 3081 B6R0.2 CC(O)CC(=C)Br Amb24618620 [1,1,0,0,0,0|2,0,0]=4 3082 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,1,0,0,0,0|1,1,0]=4 3083 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,1,0,0,0,0|0,0,0]=2 3084 B6R0.2 CC(O)CC(O)O Amb25716084 [1,1,0,0,0,0|0,0,2]=4 3085 B6R0.2 CC(O)CC(S)=S Amb25215114 [1,1,0,0,0,0|0,2,0]=4 3086 B6R0.2 CC(O)CP(O)=O Amb24406357 [1,1,0,0,0,0|1,0,0]=3 3087 B6R0.2 CC(O)NC(N)=O Amb25811550 [1,1,0,0,0,0|2,0,0]=4 3088 B6R0.2 CC(O)OC(N)=O Amb24669632 [1,1,0,0,0,0|2,0,0]=4 3089 B6R0.2 CC(O)SC(C)=O Amb24544015 [1,1,0,0,0,0|2,0,0]=4 3090 B6R0.2 CC(S)CC(C)=O Amb24600676 [1,1,0,0,0,0|1,1,0]=4 3091 B6R0.2 CC(S)CC(N)=O Amb24479823 [1,1,0,0,0,0|1,1,0]=4 3092 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,1,0,0,0,0|0,1,0]=3 3093 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,1,0,0,0,0|2,0,0]=4 3094 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,1,0,0,0,0|2,0,0]=4 3095 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,1,0,0,0,0|2,0,0]=4 3096 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,1,0,0,0,0|1,0,0]=3 3097 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,1,0,0,0,0|1,0,1]=4 3098 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [1,1,0,0,0,0|0,0,1]=3 3099 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,1,0,0,0,0|1,0,0]=3 3100 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [1,1,0,0,0,0|2,0,0]=4 3101 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [1,1,0,0,0,0|2,0,0]=4 3102 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [1,1,0,0,0,0|2,0,0]=4 3103 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [1,1,0,0,0,0|1,0,1]=4 3104 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [1,1,0,0,0,0|1,0,0]=3 3105 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,1,0,0,0,0|0,1,0]=3 3106 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,1,0,0,0,0|1,0,0]=3 3107 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,1,0,0,0,0|1,0,0]=3 3108 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [1,1,0,0,0,0|2,0,0]=4 3109 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,1,0,0,0,0|1,0,0]=3 3110 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,1,0,0,0,0|1,0,0]=3 3111 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [1,1,0,0,0,0|1,0,0]=3 3112 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [1,1,0,0,0,0|1,0,1]=4 3113 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,1,0,0,0,0|0,0,0]=2 3114 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,1,0,0,0,0|1,0,1]=4 3115 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,1,0,0,0,0|0,1,0]=3 3116 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,1,0,0,0,0|2,0,0]=4 3117 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,1,0,0,0,0|1,0,1]=4 3118 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [1,1,0,0,0,0|2,0,0]=4 3119 B6R0.2 NC(=O)CC(O)O Amb25810087 [1,1,0,0,0,0|1,0,0]=3 3120 B6R0.2 NC(F)CC(O)=O Amb24479804 [1,1,0,0,0,0|1,0,0]=3 3121 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [1,1,0,0,0,0|0,0,0]=2 3122 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [1,1,0,0,0,0|1,0,0]=3 3123 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [1,1,0,0,0,0|2,0,0]=4 3124 B6R0.2 OB(O)CC(O)=O Amb24053058 [1,1,0,0,0,0|1,0,0]=3 3125 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,1,0,0,0,0|0,1,1]=4 3126 B6R0.2 OC(=O)CC(F)Br Amb25336987 [1,1,0,0,0,0|1,0,0]=3 3127 B6R0.2 OC(=O)CC(F)F Amb22001551 [1,1,0,0,0,0|1,0,0]=3 3128 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,1,0,0,0,0|0,0,1]=3 3129 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,1,0,0,0,0|0,0,1]=3 3130 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,1,0,0,0,0|0,0,1]=3 3131 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [1,1,0,0,0,0|2,0,0]=4 3132 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,1,0,0,0,0|0,0,1]=3 3133 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,1,0,0,0,0|0,0,1]=3 3134 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,1,0,0,0,0|0,0,1]=3 3135 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [1,1,0,0,0,0|1,0,1]=4 3136 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [1,1,0,0,0,0|0,0,1]=3 3137 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,1,0,0,0,0|2,0,0]=4 3138 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [1,1,0,0,0,0|1,0,1]=4 3139 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [1,1,0,0,0,0|0,0,1]=3 3140 B6R0.4 BC(=O)OCCCl Amb25199831 [1,1,0,0,0,0|2,0,0]=4 3141 B6R0.4 C#CCCC(N)=O Amb18636026 [1,1,0,0,0,0|2,0,0]=4 3142 B6R0.4 C#CCCC([O-])=O Amb22232009 [1,1,0,0,0,0|1,0,1]=4 3143 B6R0.4 C=C(F)CCCO Amb25811029 [1,1,0,0,0,0|2,0,0]=4 3144 B6R0.4 C=NCCC(O)=O Amb24480865 [1,1,0,0,0,0|1,0,0]=3 3145 B6R0.4 CC#CCC(O)=O Amb17939740 [1,1,0,0,0,0|1,0,1]=4 3146 B6R0.4 CC(=C)CCCO Amb22886814 [1,1,0,0,0,0|2,0,0]=4 3147 B6R0.4 CC(=C)NCCO Amb25127040 [1,1,0,0,0,0|2,0,0]=4 3148 B6R0.4 CC(=O)CC=NO Amb25024487 [1,1,0,0,0,0|1,0,1]=4 3149 B6R0.4 CC(=O)CCC=O Amb18639597 [1,1,0,0,0,0|1,0,1]=4 3150 B6R0.4 CC(=O)CCC=S Amb25662155 [1,1,0,0,0,0|1,1,0]=4 3151 B6R0.4 CC(=O)CCCF Amb25068187 [1,1,0,0,0,0|2,0,0]=4 3152 B6R0.4 CC(=O)CCCI Amb25346994 [1,1,0,0,0,0|2,0,0]=4 3153 B6R0.4 CC(=O)CCCN Amb18121547 [1,1,0,0,0,0|2,0,0]=4 3154 B6R0.4 CC(=O)CCON Amb25186994 [1,1,0,0,0,0|1,0,0]=3 3155 B6R0.4 CC(=O)C\C=N/O Amb25066399 [1,1,0,0,0,0|1,0,1]=4 3156 B6R0.4 CC(=O)N=CCO Amb24420730 [1,1,0,0,0,0|1,0,1]=4 3157 B6R0.4 CC(=O)NCCF Amb25832238 [1,1,0,0,0,0|2,0,0]=4 3158 B6R0.4 CC(=O)NCCI Amb25761166 [1,1,0,0,0,0|2,0,0]=4 3159 B6R0.4 CC(=O)NCCN Amb1218225 [1,1,0,0,0,0|2,0,0]=4 3160 B6R0.4 CC(=O)NCCS Amb22230992 [1,1,0,0,0,0|1,1,0]=4 3161 B6R0.4 CC(=O)OCCF Amb25123333 [1,1,0,0,0,0|2,0,0]=4 3162 B6R0.4 CC(=O)OCCI Amb17673987 [1,1,0,0,0,0|2,0,0]=4 3163 B6R0.4 CC(=O)OCCN Amb18121947 [1,1,0,0,0,0|2,0,0]=4 3164 B6R0.4 CC(=O)OCCP Amb25810695 [1,1,0,0,0,0|2,0,0]=4 3165 B6R0.4 CC(=O)SCCBr Amb24608039 [1,1,0,0,0,0|2,0,0]=4 3166 B6R0.4 CC(=O)SCCCl Amb24746776 [1,1,0,0,0,0|2,0,0]=4 3167 B6R0.4 CC(=O)SCCN Amb21953963 [1,1,0,0,0,0|2,0,0]=4 3168 B6R0.4 CC(=O)SCCN Amb22011516 [1,1,0,0,0,0|2,0,0]=4 3169 B6R0.4 CC(=O)\C=C\CO Amb24414835 [1,1,0,0,0,0|1,0,1]=4 3170 B6R0.4 CC(=S)NCCO Amb25747406 [1,1,0,0,0,0|1,1,0]=4 3171 B6R0.4 CC(Br)=CCCO Amb24734140 [1,1,0,0,0,0|2,0,0]=4 3172 B6R0.4 CC(C)=CCCO Amb22002283 [1,1,0,0,0,0|2,0,0]=4 3173 B6R0.4 CC(N)=NCCO Amb25083393 [1,1,0,0,0,0|2,0,0]=4 3174 B6R0.4 CC(O)CCCO Amb22227752 [1,1,0,0,0,0|1,0,1]=4 3175 B6R0.4 CC(O)CNCO Amb25727260 [1,1,0,0,0,0|1,0,1]=4 3176 B6R0.4 CCCCC(=O)Br Amb22730323 [1,1,0,0,0,0|2,0,0]=4 3177 B6R0.4 CCCCC(O)=S Amb24682342 [1,1,0,0,0,0|1,1,0]=4 3178 B6R0.4 CCCCC([O-])=O Amb19879370 [1,1,0,0,0,0|1,0,1]=4 3179 B6R0.4 CCCCC([O-])=O Amb22056343 [1,1,0,0,0,0|1,0,1]=4 3180 B6R0.4 CCCCC([O-])=O Amb22729192 [1,1,0,0,0,0|1,0,1]=4 3181 B6R0.4 CCCCC([O-])=O Amb22731639 [1,1,0,0,0,0|1,0,1]=4 3182 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,1,0,0,0,0|1,0,0]=3 3183 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,1,0,0,0,0|2,0,0]=4 3184 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,1,0,0,0,0|2,0,0]=4 3185 B6R0.4 CCCNC(=O)N Amb1152241 [1,1,0,0,0,0|2,0,0]=4 3186 B6R0.4 CCCNC(O)=S Amb25302945 [1,1,0,0,0,0|1,1,0]=4 3187 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,1,0,0,0,0|2,0,0]=4 3188 B6R0.4 CCCOP(O)=O Amb25366595 [1,1,0,0,0,0|2,0,0]=4 3189 B6R0.4 CCCSC(C)=O Amb22043301 [1,1,0,0,0,0|2,0,0]=4 3190 B6R0.4 CCNCC(=O)N Amb1128676 [1,1,0,0,0,0|2,0,0]=4 3191 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|1,0,0]=3 3192 B6R0.4 CCNCC(C)=O Amb24545893 [1,1,0,0,0,0|2,0,0]=4 3193 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|1,0,0]=3 3194 B6R0.4 CCSCC(N)=O Amb24420234 [1,1,0,0,0,0|2,0,0]=4 3195 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,1,0,0,0,0|1,0,1]=4 3196 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|1,0,0]=3 3197 B6R0.4 CNCCC(C)=O Amb24560306 [1,1,0,0,0,0|2,0,0]=4 3198 B6R0.4 CNCCC(N)=O Amb19959913 [1,1,0,0,0,0|2,0,0]=4 3199 B6R0.4 CNNCC(O)=O Amb21929288 [1,1,0,0,0,0|2,0,0]=4 3200 B6R0.4 CNOCC(O)=O Amb25104714 [1,1,0,0,0,0|2,0,0]=4 3201 B6R0.4 COCCC(C)O Amb20621489 [1,1,0,0,0,0|1,0,1]=4 3202 B6R0.4 COCCC(N)O Amb25727188 [1,1,0,0,0,0|1,0,1]=4 3203 B6R0.4 COCCC(O)Br Amb20242943 [1,1,0,0,0,0|1,0,1]=4 3204 B6R0.4 COCCN(=O)=O Amb24126452 [1,1,0,0,0,0|1,0,1]=4 3205 B6R0.4 COCNC(C)=O Amb24659843 [1,1,0,0,0,0|2,0,0]=4 3206 B6R0.4 COCNC(N)=O Amb25744350 [1,1,0,0,0,0|2,0,0]=4 3207 B6R0.4 CON=CC(O)=O Amb25292253 [1,1,0,0,0,0|1,0,1]=4 3208 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,1,0,0,0,0|0,0,2]=4 3209 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,1]=4 3210 B6R0.4 CP(=O)OCCO Amb25221445 [1,1,0,0,0,0|2,0,0]=4 3211 B6R0.4 CS(=O)CCON Amb25368924 [1,1,0,0,0,0|2,0,0]=4 3212 B6R0.4 CSCCC(N)=O Amb24479809 [1,1,0,0,0,0|1,1,0]=4 3213 B6R0.4 CSSCC(O)=O Amb25378801 [1,1,0,0,0,0|1,1,0]=4 3214 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,1,0,0,0,0|1,0,1]=4 3215 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,1,0,0,0,0|1,0,1]=4 3216 B6R0.4 ClCCCC(=O)N Amb1138237 [1,1,0,0,0,0|2,0,0]=4 3217 B6R0.4 FCCCC(=O)O Amb17593104 [1,1,0,0,0,0|1,0,0]=3 3218 B6R0.4 N#CCCC(=O)C Amb17334046 [1,1,0,0,0,0|2,0,0]=4 3219 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,1,0,0,0,0|2,0,0]=4 3220 B6R0.4 N#CNCC(O)=O Amb25173813 [1,1,0,0,0,0|1,0,1]=4 3221 B6R0.4 N#CSCC(O)=O Amb24480976 [1,1,0,0,0,0|1,0,1]=4 3222 B6R0.4 N=CNCC(O)=O Amb24670244 [1,1,0,0,0,0|1,0,1]=4 3223 B6R0.4 NC(=N)NCCO Amb16231403 [1,1,0,0,0,0|2,0,0]=4 3224 B6R0.4 NC(=N)NCCO Amb24271072 [1,1,0,0,0,0|2,0,0]=4 3225 B6R0.4 NC(=N)OCCO Amb24764250 [1,1,0,0,0,0|2,0,0]=4 3226 B6R0.4 NC(=N)SCCO Amb1160204 [1,1,0,0,0,0|2,0,0]=4 3227 B6R0.4 NC(=O)CC=NO Amb24605273 [1,1,0,0,0,0|1,0,1]=4 3228 B6R0.4 NC(=O)CCCBr Amb25779163 [1,1,0,0,0,0|2,0,0]=4 3229 B6R0.4 NC(=O)CCCO Amb20623438 [1,1,0,0,0,0|1,0,0]=3 3230 B6R0.4 NC(=O)CSCCl Amb25135617 [1,1,0,0,0,0|2,0,0]=4 3231 B6R0.4 NC(=O)NCCO Amb1146041 [1,1,0,0,0,0|1,0,0]=3 3232 B6R0.4 NC(=O)OCCBr Amb25145573 [1,1,0,0,0,0|2,0,0]=4 3233 B6R0.4 NC(=O)OCCO Amb20623788 [1,1,0,0,0,0|1,0,0]=3 3234 B6R0.4 NC(=S)NCCO Amb19515723 [1,1,0,0,0,0|1,1,0]=4 3235 B6R0.4 NC(=S)OCCO Amb24581246 [1,1,0,0,0,0|1,1,0]=4 3236 B6R0.4 NC(N)=NCCO Amb19374418 [1,1,0,0,0,0|2,0,0]=4 3237 B6R0.4 NCC#CC(O)=O Amb25703096 [1,1,0,0,0,0|1,0,1]=4 3238 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,1,0,0,0,0|2,0,0]=4 3239 B6R0.4 NCCCC(=O)N Amb2099583 [1,1,0,0,0,0|2,0,0]=4 3240 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|1,0,0]=3 3241 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,1,0,0,0,0|2,0,0]=4 3242 B6R0.4 NCCCP(O)=O Amb22370049 [1,1,0,0,0,0|2,0,0]=4 3243 B6R0.4 NCCCS(O)=O Amb25185942 [1,1,0,0,0,0|2,0,0]=4 3244 B6R0.4 NCCNC(N)=O Amb19374121 [1,1,0,0,0,0|2,0,0]=4 3245 B6R0.4 NCCOC(N)=O Amb22059480 [1,1,0,0,0,0|2,0,0]=4 3246 B6R0.4 NCCOC(N)=O Amb24271076 [1,1,0,0,0,0|2,0,0]=4 3247 B6R0.4 NCCOS(O)=O Amb25843211 [1,1,0,0,0,0|2,0,0]=4 3248 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,1,0,0,0,0|1,0,1]=4 3249 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,1,0,0,0,0|1,0,1]=4 3250 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,1,0,0,0,0|1,0,1]=4 3251 B6R0.4 NNCCC(N)=O Amb24406769 [1,1,0,0,0,0|2,0,0]=4 3252 B6R0.4 NOCCC(=O)O Amb17569891 [1,1,0,0,0,0|0,0,0]=2 3253 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,1,0,0,0,0|2,0,0]=4 3254 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,1,0,0,0,0|2,0,0]=4 3255 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,1,0,0,0,0|2,0,0]=4 3256 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,1,0,0,0,0|2,0,0]=4 3257 B6R0.4 O=C(Cl)SCCCl Amb25272444 [1,1,0,0,0,0|2,0,0]=4 3258 B6R0.4 O=C(S)CCCCl Amb24683280 [1,1,0,0,0,0|1,1,0]=4 3259 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|0,0,2]=4 3260 B6R0.4 OC(=O)CCC=O Amb17673897 [1,1,0,0,0,0|0,0,1]=3 3261 B6R0.4 OC(=O)CCCI Amb22295911 [1,1,0,0,0,0|1,0,0]=3 3262 B6R0.4 OC(=O)CCCP Amb24717184 [1,1,0,0,0,0|1,0,0]=3 3263 B6R0.4 OC(=O)CCNCl Amb24437846 [1,1,0,0,0,0|1,0,0]=3 3264 B6R0.4 OC(=O)CN=C=S Amb25024397 [1,1,0,0,0,0|0,1,1]=4 3265 B6R0.4 OC(=O)CSN=O Amb24368923 [1,1,0,0,0,0|1,0,1]=4 3266 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,1,0,0,0,0|1,0,1]=4 3267 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|1,0,1]=4 3268 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,1,0,0,0,0|1,0,1]=4 3269 B6R0.4 OC(=O)\C=C/OI Amb24418427 [1,1,0,0,0,0|0,0,2]=4 3270 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|1,0,1]=4 3271 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|1,0,1]=4 3272 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,1,0,0,0,0|1,0,1]=4 3273 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,1,0,0,0,0|1,0,1]=4 3274 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,1,0,0,0,0|0,1,1]=4 3275 B6R0.4 OC(=O)\C=C\OI Amb24655000 [1,1,0,0,0,0|0,0,2]=4 3276 B6R0.4 OCC#CC(O)=O Amb22002375 [1,1,0,0,0,0|0,0,1]=3 3277 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [1,1,0,0,0,0|2,0,0]=4 3278 B6R0.4 OCCC=C(F)F Amb25325725 [1,1,0,0,0,0|2,0,0]=4 3279 B6R0.4 OCCCC(=O)O Amb17615189 [1,1,0,0,0,0|0,0,0]=2 3280 B6R0.4 OCCCC(O)=O Amb18640332 [1,1,0,0,0,0|0,0,0]=2 3281 B6R0.4 OCCCC(O)O Amb22802459 [1,1,0,0,0,0|0,0,2]=4 3282 B6R0.4 OCCNC(S)=S Amb24677548 [1,1,0,0,0,0|0,2,0]=4 3283 B6R0.4 OCCNS(O)=O Amb25283153 [1,1,0,0,0,0|1,0,0]=3 3284 B6R0.4 OCCOC(=O)S Amb25106059 [1,1,0,0,0,0|0,1,0]=3 3285 B6R0.4 OCCOC([S-])=S Amb25846944 [1,1,0,0,0,0|0,2,0]=4 3286 B6R0.4 OCCOP(O)=O Amb25739645 [1,1,0,0,0,0|1,0,0]=3 3287 B6R0.4 OCCOS(=O)=O Amb24686082 [1,1,0,0,0,0|1,0,1]=4 3288 B6R0.4 OCCOS(O)=O Amb17942859 [1,1,0,0,0,0|1,0,0]=3 3289 B6R0.4 OCCSC(S)=S Amb25762072 [1,1,0,0,0,0|0,2,0]=4 3290 B6R0.4 ON=NCC(O)=O Amb25204101 [1,1,0,0,0,0|1,0,0]=3 3291 B6R0.4 ON\C=C\C(O)=O Amb25058383 [1,1,0,0,0,0|0,0,2]=4 3292 B6R0.4 OP(=O)OCCCl Amb24479734 [1,1,0,0,0,0|2,0,0]=4 3293 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,1,0,0,0,0|0,0,0]=2 3294 B6R0.4 SCCCC(=O)O Amb16185429 [1,1,0,0,0,0|0,1,0]=3 3295 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [1,1,0,0,0,0|2,0,0]=4 3296 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,1,0,0,0,0|2,0,0]=4 3297 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [1,1,0,0,0,0|1,0,1]=4 3298 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [1,1,0,0,0,0|1,0,1]=4 3299 B6R0.4 [O-][N+](=O)NCCO Amb17618377 [1,1,0,0,0,0|1,0,1]=4 3300 B6R0.5 CCCP(O)(O)=O Amb22230045 [1,1,0,0,0,0|2,0,0]=4 3301 B6R0.5 CP(O)(=O)CCO Amb25085578 [1,1,0,0,0,0|1,0,0]=3 3302 B6R0.5 NP(O)(=O)NCO Amb24675238 [1,1,0,0,0,0|2,0,0]=4 3303 B6R0.5 OCCP(O)(O)=O Amb22388824 [1,1,0,0,0,0|1,0,0]=3 3304 B6R0.5 OCCS(=O)(=O)Cl Amb19148996 [1,1,0,0,0,0|1,0,1]=4 3305 B6R0.5 OCCS(=O)(=O)S Amb24735523 [1,1,0,0,0,0|1,0,1]=4 3306 B6R0.5 OCCS(O)(=O)=O Amb22274016 [1,1,0,0,0,0|1,0,0]=3 3307 B6R0.5 OCCS(O)(=O)=O Amb22360755 [1,1,0,0,0,0|1,0,0]=3 3308 B6R0.5 OCCS(O)(=O)=O Amb22751389 [1,1,0,0,0,0|1,0,0]=3 3309 B6R0.5 OCSS(O)(=O)=O Amb25745476 [1,1,0,0,0,0|2,0,0]=4 3310 B6R0.5 OS(=O)(=O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 3311 B6R0.5 OS(=O)(=O)CCS Amb22337599 [1,1,0,0,0,0|1,1,0]=4 3312 B6R0.5 OS(=O)(=O)CCS Amb22337676 [1,1,0,0,0,0|1,1,0]=4 3313 B6R0.5 [15NH2]CCS(O)(=O)=O Amb22363139 [1,1,0,0,0,0|2,0,0]=4 3314 B6R0.5 [O-]S(=O)(=O)CCO Amb22049492 [1,1,0,0,0,0|1,0,1]=4 3315 B6R0.8 C=CC(F)(F)CO Amb22008002 [1,1,0,0,0,0|2,0,0]=4 3316 B6R0.8 C=CC(N)(S)C=O Amb24649027 [1,1,0,0,0,0|1,0,1]=4 3317 B6R0.8 C=C[C@@](N)(O)C=O Amb25788594 [1,1,0,0,0,0|1,0,1]=4 3318 B6R0.8 CC(C)(CBr)C=O Amb18126378 [1,1,0,0,0,0|2,0,0]=4 3319 B6R0.8 CC(C)(CCl)C=O Amb18124283 [1,1,0,0,0,0|2,0,0]=4 3320 B6R0.8 CC(C)(CI)C=O Amb25746903 [1,1,0,0,0,0|2,0,0]=4 3321 B6R0.8 CC(C)(CO)C=C Amb22232102 [1,1,0,0,0,0|2,0,0]=4 3322 B6R0.8 CC(C)(CO)CO Amb22233192 [1,1,0,0,0,0|1,0,1]=4 3323 B6R0.8 CC(C)(CO)CO Amb22351290 [1,1,0,0,0,0|1,0,1]=4 3324 B6R0.8 CC(C)(CO)CO Amb22351928 [1,1,0,0,0,0|1,0,1]=4 3325 B6R0.8 CC(C)(CO)CO Amb22353226 [1,1,0,0,0,0|1,0,1]=4 3326 B6R0.8 CC(C)(CO)N=O Amb24333640 [1,1,0,0,0,0|2,0,0]=4 3327 B6R0.8 CC(F)(CO)C=C Amb25090890 [1,1,0,0,0,0|2,0,0]=4 3328 B6R0.8 CC(N)(C=O)C=O Amb25785258 [1,1,0,0,0,0|0,0,2]=4 3329 B6R0.8 CC(N)(CO)C#N Amb25810521 [1,1,0,0,0,0|1,0,1]=4 3330 B6R0.8 CC(N)(CO)C=C Amb19374999 [1,1,0,0,0,0|1,0,0]=3 3331 B6R0.8 CC(O)(CO)C=C Amb24431159 [1,1,0,0,0,0|2,0,0]=4 3332 B6R0.8 CC(O)(CO)C=O Amb18640356 [1,1,0,0,0,0|1,0,0]=3 3333 B6R0.8 CC(O)(CO)CO Amb24431597 [1,1,0,0,0,0|1,0,1]=4 3334 B6R0.8 CCC(Br)(Br)C=O Amb25095515 [1,1,0,0,0,0|2,0,0]=4 3335 B6R0.8 CCC(C)(Br)C=O Amb24757675 [1,1,0,0,0,0|2,0,0]=4 3336 B6R0.8 CCC(C)(C)C=O Amb19148820 [1,1,0,0,0,0|2,0,0]=4 3337 B6R0.8 CCC(C)(Cl)C=O Amb18641096 [1,1,0,0,0,0|2,0,0]=4 3338 B6R0.8 CCC(C)(N)C=C Amb24441335 [1,1,0,0,0,0|2,0,0]=4 3339 B6R0.8 CCC(C)(O)C=O Amb18639932 [1,1,0,0,0,0|2,0,0]=4 3340 B6R0.8 CCC(CO)(N)C Amb13951706 [1,1,0,0,0,0|1,0,1]=4 3341 B6R0.8 CCC(CO)(N)C Amb2236315 [1,1,0,0,0,0|1,0,1]=4 3342 B6R0.8 CCC(Cl)(Cl)C=O Amb25076475 [1,1,0,0,0,0|2,0,0]=4 3343 B6R0.8 CCC(F)(F)C=O Amb25714205 [1,1,0,0,0,0|2,0,0]=4 3344 B6R0.8 C[C@@](N)(CO)C=C Amb24595518 [1,1,0,0,0,0|1,0,0]=3 3345 B6R0.8 C[C@@](O)(CO)C=C Amb25115963 [1,1,0,0,0,0|2,0,0]=4 3346 B6R0.8 C[C@](N)(CO)C#C Amb24764245 [1,1,0,0,0,0|1,0,1]=4 3347 B6R0.8 O=CC(Br)(Br)CBr Amb20622046 [1,1,0,0,0,0|2,0,0]=4 3348 B6R0.8 O=CC(Cl)(Cl)CCl Amb24530244 [1,1,0,0,0,0|2,0,0]=4 3349 B6R0.8 OC(O)(CO)CO Amb25739646 [1,1,0,0,0,0|1,0,1]=4 3350 B6R0.8 OCC(F)(F)CO Amb20670754 [1,1,0,0,0,0|1,0,1]=4 3351 B6R0.9 C#CC(CO)CO Amb25079436 [1,1,0,0,0,0|1,0,1]=4 3352 B6R0.9 CCC(C=O)C=O Amb25798416 [1,1,0,0,0,0|2,0,0]=4 3353 B6R0.9 CCC(C=O)OC Amb18121854 [1,1,0,0,0,0|2,0,0]=4 3354 B6R0.9 CCC(C=O)SC Amb25123224 [1,1,0,0,0,0|2,0,0]=4 3355 B6R0.9 CCC(CI)C=O Amb24364376 [1,1,0,0,0,0|2,0,0]=4 3356 B6R0.9 CCC(CO)C=C Amb21858662 [1,1,0,0,0,0|2,0,0]=4 3357 B6R0.9 CCC(CO)CO Amb21520459 [1,1,0,0,0,0|1,0,1]=4 3358 B6R0.9 CCC(CO)NO Amb25781711 [1,1,0,0,0,0|1,0,1]=4 3359 B6R0.9 CCC(CO)ON Amb24662648 [1,1,0,0,0,0|1,0,1]=4 3360 B6R0.9 CCN(CO)C=O Amb25048371 [1,1,0,0,0,0|2,0,0]=4 3361 B6R0.9 CC[C@@H](CO)NC Amb24480613 [1,1,0,0,0,0|1,0,1]=4 3362 B6R0.9 CC[C@@H](CO)NO Amb24719568 [1,1,0,0,0,0|1,0,1]=4 3363 B6R0.9 CC[C@H](CO)C=C Amb25283278 [1,1,0,0,0,0|2,0,0]=4 3364 B6R0.9 CN[C@@H](CO)C=C Amb25044465 [1,1,0,0,0,0|1,0,0]=3 3365 B6R0.9 COC(CO)C=C Amb22228508 [1,1,0,0,0,0|2,0,0]=4 3366 B6R0.9 COC(CO)C=O Amb18640344 [1,1,0,0,0,0|1,0,0]=3 3367 B6R0.9 COC(CO)CO Amb24117539 [1,1,0,0,0,0|1,0,1]=4 3368 B6R0.9 CO[C@@H](CO)C=O Amb24639077 [1,1,0,0,0,0|1,0,0]=3 3369 B6R0.9 CO[C@H](CO)C=C Amb24397960 [1,1,0,0,0,0|2,0,0]=4 3370 B6R0.9 CSC(CO)C=C Amb25256720 [1,1,0,0,0,0|2,0,0]=4 3371 B6R0.9 NCC(CO)CF Amb24695461 [1,1,0,0,0,0|1,0,1]=4 3372 B6R0.9 NCC(CO)CO Amb18640484 [1,1,0,0,0,0|0,0,1]=3 3373 B6R0.9 NNC(CO)CO Amb24118054 [1,1,0,0,0,0|0,0,1]=3 3374 B6R0.9 NOC(CO)CO Amb24398073 [1,1,0,0,0,0|0,0,1]=3 3375 B6R0.9 O=CC(CF)CF Amb24515795 [1,1,0,0,0,0|2,0,0]=4 3376 B6R0.9 OCC(CI)CO Amb25124696 [1,1,0,0,0,0|1,0,1]=4 3377 B6R0.9 OCC(CO)CO Amb20240672 [1,1,0,0,0,0|1,0,1]=4 3378 B6R0.9 OCC(CO)P=O Amb24583729 [1,1,0,0,0,0|0,1,1]=4 3379 B6R0.7 CC(=O)C(Br)(C)C Amb2389573 [1,1,0,0,0,0|2,0,0]=4 3380 B6R0.7 CC(=O)C(C)(C)F Amb24479081 [1,1,0,0,0,0|2,0,0]=4 3381 B6R0.7 CC(=O)C(C)(C)N Amb22283888 [1,1,0,0,0,0|1,0,0]=3 3382 B6R0.7 CC(=O)C(C)(O)O Amb25237362 [1,1,0,0,0,0|2,0,0]=4 3383 B6R0.7 CC(=O)C(N)(C)C Amb1087903 [1,1,0,0,0,0|1,0,0]=3 3384 B6R0.7 CC(=O)C(O)(O)O Amb24569677 [1,1,0,0,0,0|2,0,0]=4 3385 B6R0.7 CC(C(N)(C)C)O Amb17470362 [1,1,0,0,0,0|1,0,1]=4 3386 B6R0.7 CC(C(O)(C)C)N Amb13951783 [1,1,0,0,0,0|1,0,1]=4 3387 B6R0.7 CC(C)(Br)C(=O)Cl Amb18090808 [1,1,0,0,0,0|2,0,0]=4 3388 B6R0.7 CC(C)(C)C(=O)Br Amb25684718 [1,1,0,0,0,0|2,0,0]=4 3389 B6R0.7 CC(C)(C)C(=O)S Amb20240548 [1,1,0,0,0,0|1,1,0]=4 3390 B6R0.7 CC(C)(C)C(O)=O Amb22360669 [1,1,0,0,0,0|1,0,0]=3 3391 B6R0.7 CC(C)(C)C([O-])=O Amb22523341 [1,1,0,0,0,0|1,0,1]=4 3392 B6R0.7 CC(C)(C)C([O-])=O Amb24325153 [1,1,0,0,0,0|1,0,1]=4 3393 B6R0.7 CC(C)(C)S(O)=O Amb25194337 [1,1,0,0,0,0|2,0,0]=4 3394 B6R0.7 CC(C)(Cl)C(=O)Cl Amb20668299 [1,1,0,0,0,0|2,0,0]=4 3395 B6R0.7 CC(C)(Cl)C(N)=O Amb24122839 [1,1,0,0,0,0|2,0,0]=4 3396 B6R0.7 CC(C)(F)C(=O)Cl Amb24055889 [1,1,0,0,0,0|2,0,0]=4 3397 B6R0.7 CC(C)(F)C(N)=O Amb20671475 [1,1,0,0,0,0|2,0,0]=4 3398 B6R0.7 CC(C)(I)C(N)=O Amb25186301 [1,1,0,0,0,0|2,0,0]=4 3399 B6R0.7 CC(C)(N)C(=O)Cl Amb24479876 [1,1,0,0,0,0|1,0,0]=3 3400 B6R0.7 CC(C)(N)C(N)=N Amb23596457 [1,1,0,0,0,0|2,0,0]=4 3401 B6R0.7 CC(C)(N)C(N)=S Amb19374913 [1,1,0,0,0,0|1,1,0]=4 3402 B6R0.7 CC(C)(N)P(O)=O Amb24479807 [1,1,0,0,0,0|1,0,0]=3 3403 B6R0.7 CC(C)(O)C([O-])=O Amb22343241 [1,1,0,0,0,0|1,0,1]=4 3404 B6R0.7 CC(C)(P)C(O)=O Amb25836244 [1,1,0,0,0,0|0,1,0]=3 3405 B6R0.7 CC(C)(S)C(N)=O Amb25366790 [1,1,0,0,0,0|2,0,0]=4 3406 B6R0.7 CC(C)([15NH2])C(O)=O Amb22367632 [1,1,0,0,0,0|0,0,0]=2 3407 B6R0.7 CC(Cl)(Br)C(O)=O Amb24739657 [1,1,0,0,0,0|1,0,0]=3 3408 B6R0.7 CC(Cl)(Cl)C(N)=O Amb22229722 [1,1,0,0,0,0|2,0,0]=4 3409 B6R0.7 CC(Cl)(Cl)C(O)=O Amb22352970 [1,1,0,0,0,0|1,0,0]=3 3410 B6R0.7 CC(Cl)(Cl)C([O-])=O Amb22524772 [1,1,0,0,0,0|1,0,1]=4 3411 B6R0.7 CC(Cl)P(O)(O)=O Amb25774503 [1,1,0,0,0,0|2,0,0]=4 3412 B6R0.7 CC(F)(Br)C(O)=O Amb19895446 [1,1,0,0,0,0|1,0,0]=3 3413 B6R0.7 CC(F)(Cl)C(O)=O Amb22011870 [1,1,0,0,0,0|1,0,0]=3 3414 B6R0.7 CC(F)(F)C(=O)Cl Amb25795425 [1,1,0,0,0,0|2,0,0]=4 3415 B6R0.7 CC(F)(F)C([O-])=O Amb22008197 [1,1,0,0,0,0|1,0,1]=4 3416 B6R0.7 CC(N)(Cl)C(O)=O Amb25040032 [1,1,0,0,0,0|0,0,0]=2 3417 B6R0.7 CC(N)(N)C(O)=O Amb24479882 [1,1,0,0,0,0|0,0,0]=2 3418 B6R0.7 CC(N)C(C)(C)O Amb19883757 [1,1,0,0,0,0|1,0,1]=4 3419 B6R0.7 CC(N)S(O)(=O)=O Amb24629730 [1,1,0,0,0,0|1,0,0]=3 3420 B6R0.7 CC(O)(O)C(N)=O Amb24746269 [1,1,0,0,0,0|2,0,0]=4 3421 B6R0.7 CC(O)(O)C(O)=O Amb25337924 [1,1,0,0,0,0|1,0,0]=3 3422 B6R0.7 CC(O)P(O)(O)=O Amb22832005 [1,1,0,0,0,0|2,0,0]=4 3423 B6R0.7 CC(P)(P)C(O)=O Amb25330045 [1,1,0,0,0,0|0,1,0]=3 3424 B6R0.7 CC(S)(S)C(O)=O Amb24687073 [1,1,0,0,0,0|1,0,0]=3 3425 B6R0.7 C[C@@H](N)C(C)(C)O Amb22747486 [1,1,0,0,0,0|1,0,1]=4 3426 B6R0.7 C[C@@](N)(Cl)C(O)=O Amb24479866 [1,1,0,0,0,0|0,0,0]=2 3427 B6R0.7 C[C@@](N)(F)C(O)=O Amb25810196 [1,1,0,0,0,0|0,0,0]=2 3428 B6R0.7 C[C@@](N)(S)C(O)=O Amb25108484 [1,1,0,0,0,0|0,0,0]=2 3429 B6R0.7 C[C@H](N)C(C)(C)O Amb22736077 [1,1,0,0,0,0|1,0,1]=4 3430 B6R0.7 C[C@](N)(F)C(O)=O Amb24333513 [1,1,0,0,0,0|0,0,0]=2 3431 B6R0.7 NC(=O)C(Br)(C)C Amb10071123 [1,1,0,0,0,0|2,0,0]=4 3432 B6R0.7 NC(=O)C(C)(C)C Amb1151239 [1,1,0,0,0,0|2,0,0]=4 3433 B6R0.7 NC(=O)C(F)(F)C Amb10838721 [1,1,0,0,0,0|2,0,0]=4 3434 B6R0.7 NC(=O)C(N)(C)C Amb10608162 [1,1,0,0,0,0|1,0,0]=3 3435 B6R0.7 NC(=O)C(N)(C)C Amb10609802 [1,1,0,0,0,0|1,0,0]=3 3436 B6R0.7 OC(=O)C(Br)(Br)F Amb10839150 [1,1,0,0,0,0|2,0,0]=4 3437 B6R0.7 OC(=O)C(Cl)(Br)Br Amb22732050 [1,1,0,0,0,0|2,0,0]=4 3438 B6R0.7 OC(=O)C(F)(Cl)Br Amb24528668 [1,1,0,0,0,0|2,0,0]=4 3439 B6R0.7 OC(=O)C(F)(Cl)Cl Amb22738911 [1,1,0,0,0,0|2,0,0]=4 3440 B6R0.7 OC(=O)C(F)(F)F Amb16231989 [1,1,0,0,0,0|2,0,0]=4 3441 B6R0.7 OC(=O)C(F)(F)F Amb17608071 [1,1,0,0,0,0|2,0,0]=4 3442 B6R0.7 OC(=O)C(F)(F)F Amb19883782 [1,1,0,0,0,0|2,0,0]=4 3443 B6R0.7 OC(=O)C(F)(F)F Amb22053635 [1,1,0,0,0,0|2,0,0]=4 3444 B6R0.7 OC(=O)C(F)(F)F Amb22353311 [1,1,0,0,0,0|2,0,0]=4 3445 B6R0.7 OC(=O)C(F)(F)F Amb22491943 [1,1,0,0,0,0|2,0,0]=4 3446 B6R0.7 OC(=O)C(F)(F)F Amb22737374 [1,1,0,0,0,0|2,0,0]=4 3447 B6R0.7 OC(=O)C(F)(F)F Amb22740169 [1,1,0,0,0,0|2,0,0]=4 3448 B6R0.7 OC(=O)C(F)(F)F Amb23439505 [1,1,0,0,0,0|2,0,0]=4 3449 B6R0.7 OC(=O)C(F)(F)F Amb25365165 [1,1,0,0,0,0|2,0,0]=4 3450 B6R0.7 OC(=O)C(F)(F)I Amb22738912 [1,1,0,0,0,0|2,0,0]=4 3451 B6R0.7 OC(=O)C(I)(I)I Amb17621003 [1,1,0,0,0,0|2,0,0]=4 3452 B6R0.7 OC(=O)C(O)(C)C Amb1159101 [1,1,0,0,0,0|1,0,0]=3 3453 B6R0.7 OC(=O)C(O)(F)F Amb22351389 [1,1,0,0,0,0|1,0,0]=3 3454 B6R0.7 OC(=O)C(S)(C)C Amb17501520 [1,1,0,0,0,0|1,0,0]=3 3455 B6R0.7 OC(O)P(O)(O)=O Amb24333815 [1,1,0,0,0,0|2,0,0]=4 3456 B6R0.7 O[13C](=O)C(Br)(Br)Br Amb22367415 [1,1,0,0,0,0|2,0,0]=4 3457 B6R0.7 O[13C](=O)C(Cl)(Br)Br Amb22367328 [1,1,0,0,0,0|2,0,0]=4 3458 B6R0.7 O[13C](=O)C(Cl)(Cl)Cl Amb22351251 [1,1,0,0,0,0|2,0,0]=4 3459 B6R0.7 O[13C](=O)[13C](Cl)(Cl)Cl Amb22056277 [1,1,0,0,0,0|2,0,0]=4 3460 B6R0.7 [2H]C(C)(N)C(O)=O Amb22353531 [1,1,0,0,0,0|0,0,0]=2 3461 B6R0.7 [2H]C(C)(N)[13C](O)=O Amb22367245 [1,1,0,0,0,0|0,0,0]=2 3462 B6R0.7 [2H]C([13CH3])(N)C(O)=O Amb22351832 [1,1,0,0,0,0|0,0,0]=2 3463 B6R0.7 [2H]C([2H])(C)C(O)=O Amb22366992 [1,1,0,0,0,0|1,0,0]=3 3464 B6R0.7 [2H]C([2H])(N)C(O)=O Amb22366882 [1,1,0,0,0,0|1,0,0]=3 3465 B6R0.7 [2H]C([2H])([2H])C(O)=O Amb22362628 [1,1,0,0,0,0|2,0,0]=4 3466 B6R0.7 [2H]C([2H])([2H])[13C](O)=O Amb22732622 [1,1,0,0,0,0|2,0,0]=4 3467 B6R0.7 [2H][13C](C)(N)C(O)=O Amb22367247 [1,1,0,0,0,0|0,0,0]=2 3468 B6R0.7 [2H][13C]([2H])(Br)[13C](O)=O Amb22338931 [1,1,0,0,0,0|2,0,0]=4 3469 B6R0.7 [2H][13C]([2H])([2H])C(O)=O Amb22351444 [1,1,0,0,0,0|2,0,0]=4 3470 B6R0.7 [2H][13C]([2H])([2H])[13C](O)=O Amb22733383 [1,1,0,0,0,0|2,0,0]=4 3471 B6R0.7 [2H][C@@](C)(N)C(O)=O Amb22800178 [1,1,0,0,0,0|0,0,0]=2 3472 B6R0.7 [O-]C(=O)C(C)(C)C Amb16192974 [1,1,0,0,0,0|1,0,1]=4 3473 B8R0.2 C=C(C(O)CO)C(O)=O Amb18642874 [0,1,0,0,0,1|1,0,0]=3 3474 B8R0.2 CC(=O)C(=C)C(C)CO Amb24588893 [0,1,0,0,0,1|2,0,0]=4 3475 B8R0.2 CC(=O)C(=C)[C@@H](C)CO Amb25064620 [0,1,0,0,0,1|2,0,0]=4 3476 B8R0.2 CC(=O)C(=O)C(O)CO Amb25830733 [0,1,0,0,0,1|2,0,0]=4 3477 B8R0.2 CC(=O)C(=O)[C@@H](O)CO Amb25697046 [0,1,0,0,0,1|2,0,0]=4 3478 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,1,0,0,0,1|2,0,0]=4 3479 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,1,0,0,0,1|2,0,0]=4 3480 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,1,0,0,0,1|2,0,0]=4 3481 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,1,0,0,0,1|1,0,0]=3 3482 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,1,0,0,0,1|1,0,0]=3 3483 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,1,0,0,0,1|2,0,0]=4 3484 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,1,0,0,0,1|2,0,0]=4 3485 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,1,0,0,0,1|2,0,0]=4 3486 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,1,0,0,0,1|2,0,0]=4 3487 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,1,0,0,0,1|2,0,0]=4 3488 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,1,0,0,0,1|2,0,0]=4 3489 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,1,0,0,0,1|2,0,0]=4 3490 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,1,0,0,0,1|2,0,0]=4 3491 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,1,0,0,0,1|2,0,0]=4 3492 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,1,0,0,0,1|2,0,0]=4 3493 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,1,0,0,0,1|2,0,0]=4 3494 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,1,0,0,0,1|1,0,1]=4 3495 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,1,0,0,0,1|1,0,1]=4 3496 B8R0.2 CC(CO)N(C)C(N)=O Amb24481821 [0,1,0,0,0,1|2,0,0]=4 3497 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,1,0,0,0,1|2,0,0]=4 3498 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,1,0,0,0,1|2,0,0]=4 3499 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,1,0,0,0,1|2,0,0]=4 3500 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,1,0,0,0,1|2,0,0]=4 3501 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,1,0,0,0,1|2,0,0]=4 3502 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,1,0,0,0,1|2,0,0]=4 3503 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,1,0,0,0,1|2,0,0]=4 3504 B8R0.2 CCC(N)C(=C)C(O)=O Amb24558624 [0,1,0,0,0,1|1,0,0]=3 3505 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,1,0,0,0,1|2,0,0]=4 3506 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,1,0,0,0,1|2,0,0]=4 3507 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,1,0,0,0,1|2,0,0]=4 3508 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,1,0,0,0,1|2,0,0]=4 3509 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,1,0,0,0,1|2,0,0]=4 3510 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,1,0,0,0,1|2,0,0]=4 3511 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,1,0,0,0,1|2,0,0]=4 3512 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,1,0,0,0,1|2,0,0]=4 3513 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,1,0,0,0,1|2,0,0]=4 3514 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,1,0,0,0,1|2,0,0]=4 3515 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,1,0,0,0,1|1,0,0]=3 3516 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,1,0,0,0,1|2,0,0]=4 3517 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,1,0,0,0,1|2,0,0]=4 3518 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,1,0,0,0,1|2,0,0]=4 3519 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,1,0,0,0,1|2,0,0]=4 3520 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,1,0,0,0,1|2,0,0]=4 3521 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,1,0,0,0,1|2,0,0]=4 3522 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,1,0,0,0,1|2,0,0]=4 3523 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,1,0,0,0,1|2,0,0]=4 3524 B8R0.2 CC[C@H](N)C(=C)C(O)=O Amb24468573 [0,1,0,0,0,1|1,0,0]=3 3525 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,1,0,0,0,1|1,0,0]=3 3526 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,1,0,0,0,1|1,0,0]=3 3527 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,1,0,0,0,1|2,0,0]=4 3528 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,1,0,0,0,1|2,0,0]=4 3529 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,1,0,0,0,1|2,0,0]=4 3530 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,1,0,0,0,1|2,0,0]=4 3531 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,1,0,0,0,1|2,0,0]=4 3532 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,1,0,0,0,1|2,0,0]=4 3533 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,1,0,0,0,1|2,0,0]=4 3534 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,1,0,0,0,1|2,0,0]=4 3535 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,1,0,0,0,1|2,0,0]=4 3536 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,1,0,0,0,1|1,0,0]=3 3537 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,1,0,0,0,1|1,0,0]=3 3538 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,1,0,0,0,1|1,0,0]=3 3539 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,1,0,0,0,1|2,0,0]=4 3540 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,1,0,0,0,1|1,0,0]=3 3541 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,1,0,0,0,1|2,0,0]=4 3542 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,1,0,0,0,1|2,0,0]=4 3543 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,1,0,0,0,1|2,0,0]=4 3544 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,1,0,0,0,1|2,0,0]=4 3545 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,1,0,0,0,1|2,0,0]=4 3546 B8R0.2 C[C@H](CO)N(C)C(C)=O Amb24553314 [0,1,0,0,0,1|2,0,0]=4 3547 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,1,0,0,0,1|1,0,0]=3 3548 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,1,0,0,0,1|2,0,0]=4 3549 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,1,0,0,0,1|2,0,0]=4 3550 B8R0.2 NC(=O)[C@@H](O)[C@@H](O)CO Amb24533413 [0,1,0,0,0,1|2,0,0]=4 3551 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO Amb25146059 [0,1,0,0,0,1|2,0,0]=4 3552 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,1,0,0,0,1|1,0,0]=3 3553 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,1,0,0,0,1|1,0,0]=3 3554 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,1,0,0,0,1|0,0,0]=2 3555 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,1,0,0,0,1|2,0,0]=4 3556 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,1,0,0,0,1|2,0,0]=4 3557 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,1,0,0,0,1|2,0,0]=4 3558 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,1,0,0,0,1|2,0,0]=4 3559 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,1,0,0,0,1|2,0,0]=4 3560 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,1,0,0,0,1|2,0,0]=4 3561 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,1,0,0,0,1|0,0,0]=2 3562 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,1,0,0,0,1|2,0,0]=4 3563 B8R0.2 N[C@@H]([C@@H](O)CO)C(N)=O Amb24717733 [0,1,0,0,0,1|2,0,0]=4 3564 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,1,0,0,0,1|1,0,0]=3 3565 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,1,0,0,0,1|0,0,0]=2 3566 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,1,0,0,0,1|2,0,0]=4 3567 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,1,0,0,0,1|1,0,0]=3 3568 B8R0.2 N[C@H](CO)[C@H](O)C(N)=O Amb24677605 [0,1,0,0,0,1|1,0,0]=3 3569 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,1,0,0,0,1|0,0,0]=2 3570 B8R0.2 N[C@H]([C@@H](O)CO)C(=O)Cl Amb25707913 [0,1,0,0,0,1|2,0,0]=4 3571 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,1,0,0,0,1|1,0,0]=3 3572 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,1,0,0,0,1|1,0,0]=3 3573 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,1|2,0,0]=4 3574 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,1,0,0,0,1|2,0,0]=4 3575 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,1,0,0,0,1|2,0,0]=4 3576 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,1,0,0,0,1|1,0,0]=3 3577 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,1,0,0,0,1|1,0,0]=3 3578 B8R0.2 OC[C@H](O)[C@@H](O)C([O-])=O Amb17943095 [0,1,0,0,0,1|1,0,1]=4 3579 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,1,0,0,0,1|1,0,0]=3 3580 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,1,0,0,0,1|2,0,0]=4 3581 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,1,0,0,0,1|2,0,0]=4 3582 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,1,0,0,0,1|1,1,0]=4 3583 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,1,0,0,0,1|2,0,0]=4 3584 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22552521 [0,1,0,0,0,1|1,0,1]=4 3585 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22733096 [0,1,0,0,0,1|1,0,1]=4 3586 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22734344 [0,1,0,0,0,1|1,0,1]=4 3587 B8R0.2 [O-]C(=O)[C@@H](O)[C@H](O)CO Amb22744783 [0,1,0,0,0,1|1,0,1]=4 3588 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,1,0,0,0,1|1,0,0]=3 3589 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,1,0,0,0,1|1,0,0]=3 3590 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,1,0,0,0,1|1,0,0]=3 3591 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,1,0,0,0,1|1,0,0]=3 3592 B8R0.5 C=C=CC(N)CC(O)=O Amb24476615 [0,1,0,0,0,1|1,0,1]=4 3593 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,1,0,0,0,1|1,0,0]=3 3594 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,1,0,0,0,1|2,0,0]=4 3595 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,1,0,0,0,1|2,0,0]=4 3596 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,1,0,0,0,1|1,0,0]=3 3597 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,1,0,0,0,1|2,0,0]=4 3598 B8R0.5 CC(=O)C=C(N)COC Amb24540259 [0,1,0,0,0,1|1,0,1]=4 3599 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,1,0,0,0,1|2,0,0]=4 3600 B8R0.5 CC(=O)\C=C(/N)\COC Amb24340140 [0,1,0,0,0,1|1,0,1]=4 3601 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,1,0,0,0,1|2,0,0]=4 3602 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,1,0,0,0,1|2,0,0]=4 3603 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,1,0,0,0,1|2,0,0]=4 3604 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,1,0,0,0,1|2,0,0]=4 3605 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,1,0,0,0,1|2,0,0]=4 3606 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,1,0,0,0,1|1,0,1]=4 3607 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,1,0,0,0,1|2,0,0]=4 3608 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,1,0,0,0,1|1,0,0]=3 3609 B8R0.5 CC(CCO)NC(N)=O Amb25043087 [0,1,0,0,0,1|2,0,0]=4 3610 B8R0.5 CC(CCO)OC(N)=O Amb25090414 [0,1,0,0,0,1|2,0,0]=4 3611 B8R0.5 CC(CNO)=CC(O)=O Amb25702672 [0,1,0,0,0,1|1,0,1]=4 3612 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,1,0,0,0,1|1,0,1]=4 3613 B8R0.5 CC(NC(=O)C)CON Amb17138376 [0,1,0,0,0,1|2,0,0]=4 3614 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,1,0,0,0,1|2,0,0]=4 3615 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,1,0,0,0,1|2,0,0]=4 3616 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,1,0,0,0,1|1,0,0]=3 3617 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,1,0,0,0,1|2,0,0]=4 3618 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,1,0,0,0,1|1,0,0]=3 3619 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [0,1,0,0,0,1|2,0,0]=4 3620 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,1,0,0,0,1|2,0,0]=4 3621 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,1,0,0,0,1|2,0,0]=4 3622 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,1,0,0,0,1|1,0,0]=3 3623 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,1,0,0,0,1|1,0,0]=3 3624 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,1,0,0,0,1|2,0,0]=4 3625 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,1,0,0,0,1|1,0,0]=3 3626 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,1,0,0,0,1|2,0,0]=4 3627 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,1,0,0,0,1|2,0,0]=4 3628 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,1,0,0,0,1|2,0,0]=4 3629 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,1,0,0,0,1|1,0,1]=4 3630 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,1,0,0,0,1|1,0,0]=3 3631 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,1,0,0,0,1|2,0,0]=4 3632 B8R0.5 COCC(Cl)CC(=O)Cl Amb25059197 [0,1,0,0,0,1|2,0,0]=4 3633 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,1,0,0,0,1|1,0,0]=3 3634 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,1,0,0,0,1|1,0,0]=3 3635 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,1,0,0,0,1|1,0,0]=3 3636 B8R0.5 COC[C@@H](C)NC(C)=O Amb24477698 [0,1,0,0,0,1|2,0,0]=4 3637 B8R0.5 COC[C@@H](C)NC(N)=O Amb24718117 [0,1,0,0,0,1|2,0,0]=4 3638 B8R0.5 COC[C@H](C)NC(C)=O Amb24477723 [0,1,0,0,0,1|2,0,0]=4 3639 B8R0.5 CS(=O)CC(N)CCO Amb25711601 [0,1,0,0,0,1|2,0,0]=4 3640 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,1,0,0,0,1|1,1,0]=4 3641 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [0,1,0,0,0,1|1,1,0]=4 3642 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,1,0,0,0,1|1,1,0]=4 3643 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,1,0,0,0,1|2,0,0]=4 3644 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,1,0,0,0,1|1,0,0]=3 3645 B8R0.5 C[C@@H](CCO)NC(C)=O Amb25140356 [0,1,0,0,0,1|2,0,0]=4 3646 B8R0.5 C[C@@H](CCO)NC(N)=O Amb24676501 [0,1,0,0,0,1|2,0,0]=4 3647 B8R0.5 C[C@H](CCO)NC(N)=O Amb24690086 [0,1,0,0,0,1|2,0,0]=4 3648 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,1,0,0,0,1|2,0,0]=4 3649 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,1,0,0,0,1|2,0,0]=4 3650 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,1,0,0,0,1|1,0,0]=3 3651 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,1,0,0,0,1|1,0,0]=3 3652 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,1,0,0,0,1|0,0,0]=2 3653 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,1,0,0,0,1|1,0,0]=3 3654 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,1,0,0,0,1|1,0,0]=3 3655 B8R0.16 CC(=O)NC(CO)C#N Amb25146145 [0,1,0,0,0,1|1,0,1]=4 3656 B8R0.16 CC(=O)NC(CO)CO Amb25127062 [0,1,0,0,0,1|2,0,0]=4 3657 B8R0.16 CC(=O)NC(CO)CS Amb25685905 [0,1,0,0,0,1|2,0,0]=4 3658 B8R0.16 CC(=O)N[C@@H](CO)C=O Amb24761306 [0,1,0,0,0,1|2,0,0]=4 3659 B8R0.16 CC(=O)N[C@H](CO)C=O Amb25145985 [0,1,0,0,0,1|2,0,0]=4 3660 B8R0.16 CC(=O)OC(CN)CO Amb25663259 [0,1,0,0,0,1|1,0,0]=3 3661 B8R0.16 CC(=O)OC(CO)CO Amb24479923 [0,1,0,0,0,1|2,0,0]=4 3662 B8R0.16 CC(=O)O[C@H](CO)C=C Amb25098569 [0,1,0,0,0,1|2,0,0]=4 3663 B8R0.16 CC(=O)SC(CN)CN Amb24117511 [0,1,0,0,0,1|2,0,0]=4 3664 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,1,0,0,0,1|2,0,0]=4 3665 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,1,0,0,0,1|2,0,0]=4 3666 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,1,0,0,0,1|1,0,0]=3 3667 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,1,0,0,0,1|1,0,0]=3 3668 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,1,0,0,0,1|2,0,0]=4 3669 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,1,0,0,0,1|2,0,0]=4 3670 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,1,0,0,0,1|1,0,0]=3 3671 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,1,0,0,0,1|1,0,0]=3 3672 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,1,0,0,0,1|2,0,0]=4 3673 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,1,0,0,0,1|2,0,0]=4 3674 B8R0.16 CC[C@H](CO)NC(C)=O Amb24444629 [0,1,0,0,0,1|2,0,0]=4 3675 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,1,0,0,0,1|1,0,0]=3 3676 B8R0.16 NC(=O)OC(CO)CO Amb25789555 [0,1,0,0,0,1|2,0,0]=4 3677 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [0,1,0,0,0,1|0,0,0]=2 3678 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [0,1,0,0,0,1|0,1,0]=3 3679 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [0,1,0,0,0,1|0,1,0]=3 3680 B8R0.16 OC(=O)C=C(CO)CO Amb25112732 [0,1,0,0,0,1|1,0,1]=4 3681 B8R0.16 OCC(CCl)OP(O)=O Amb24480240 [0,1,0,0,0,1|2,0,0]=4 3682 B8R0.19 CC(CC(N)CO)=CN Amb24655084 [0,1,0,0,0,1|2,0,0]=4 3683 B8R0.19 CC(CF)NC(=O)CO Amb24481944 [0,1,0,0,0,1|2,0,0]=4 3684 B8R0.19 CC(CO)CC(=O)NN Amb25692312 [0,1,0,0,0,1|2,0,0]=4 3685 B8R0.19 CC(CO)NC(=O)CBr Amb25765598 [0,1,0,0,0,1|2,0,0]=4 3686 B8R0.19 CC(CO)NC(=O)CCl Amb18791488 [0,1,0,0,0,1|2,0,0]=4 3687 B8R0.19 CC(CO)\C=C(/C)\C=O Amb25758939 [0,1,0,0,0,1|2,0,0]=4 3688 B8R0.19 CC(CO)\C=C(\C)/CO Amb24719589 [0,1,0,0,0,1|2,0,0]=4 3689 B8R0.19 CCC(=C)CC(N)CO Amb25071226 [0,1,0,0,0,1|2,0,0]=4 3690 B8R0.19 CCC(=O)CC(C)CO Amb25050722 [0,1,0,0,0,1|2,0,0]=4 3691 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [0,1,0,0,0,1|2,0,0]=4 3692 B8R0.19 CCC(=O)OC(C)CO Amb25077934 [0,1,0,0,0,1|2,0,0]=4 3693 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,1,0,0,0,1|2,0,0]=4 3694 B8R0.19 CCC(N)CC(=O)C#C Amb24388579 [0,1,0,0,0,1|2,0,0]=4 3695 B8R0.19 CCC(N)CC(=O)C=C Amb25108966 [0,1,0,0,0,1|2,0,0]=4 3696 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,1,0,0,0,1|1,0,0]=3 3697 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,1,0,0,0,1|1,0,0]=3 3698 B8R0.19 CCC(N)CC(N)=NO Amb24379538 [0,1,0,0,0,1|2,0,0]=4 3699 B8R0.19 CCC(NC(=O)OC)C Amb10568221 [0,1,0,0,0,1|2,0,0]=4 3700 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,1,0,0,0,1|2,0,0]=4 3701 B8R0.19 CC[C@@H](C)NC(=O)OC Amb25368349 [0,1,0,0,0,1|2,0,0]=4 3702 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,1,0,0,0,1|1,0,0]=3 3703 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,1,0,0,0,1|2,0,0]=4 3704 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [0,1,0,0,0,1|2,0,0]=4 3705 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,1,0,0,0,1|2,0,0]=4 3706 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,1,0,0,0,1|1,0,1]=4 3707 B8R0.19 CNC(=O)NC(C)CO Amb24423704 [0,1,0,0,0,1|2,0,0]=4 3708 B8R0.19 CNC(=O)N[C@@H](C)CO Amb24523142 [0,1,0,0,0,1|2,0,0]=4 3709 B8R0.19 CNC(=O)OC(C)CO Amb24477700 [0,1,0,0,0,1|2,0,0]=4 3710 B8R0.19 COC(=O)CC(Br)CF Amb24627105 [0,1,0,0,0,1|2,0,0]=4 3711 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,1,0,0,0,1|2,0,0]=4 3712 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,1,0,0,0,1|2,0,0]=4 3713 B8R0.19 COC(=O)CC(C)CO Amb24729571 [0,1,0,0,0,1|1,0,0]=3 3714 B8R0.19 COC(=O)CC(C)NO Amb25032324 [0,1,0,0,0,1|2,0,0]=4 3715 B8R0.19 COC(=O)CC(N)C=C Amb25380673 [0,1,0,0,0,1|1,0,1]=4 3716 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,1,0,0,0,1|1,0,0]=3 3717 B8R0.19 COC(=O)CC(N)CN Amb25766036 [0,1,0,0,0,1|1,0,0]=3 3718 B8R0.19 COC(=O)CC(N)CO Amb24366077 [0,1,0,0,0,1|0,0,0]=2 3719 B8R0.19 COC(=O)CC(O)CBr Amb25201054 [0,1,0,0,0,1|2,0,0]=4 3720 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,1,0,0,0,1|2,0,0]=4 3721 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,1,0,0,0,1|2,0,0]=4 3722 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,1,0,0,0,1|1,0,1]=4 3723 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,1,0,0,0,1|1,0,0]=3 3724 B8R0.19 COC(=O)C[C@@H](CO)O Amb13883661 [0,1,0,0,0,1|1,0,0]=3 3725 B8R0.19 COC(=O)C[C@@H](N)C=C Amb25704281 [0,1,0,0,0,1|1,0,1]=4 3726 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,1,0,0,0,1|2,0,0]=4 3727 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,1,0,0,0,1|2,0,0]=4 3728 B8R0.19 COC(=O)C[C@H](C)CBr Amb25249104 [0,1,0,0,0,1|2,0,0]=4 3729 B8R0.19 COC(=O)C[C@H](N)CN Amb24360537 [0,1,0,0,0,1|1,0,0]=3 3730 B8R0.19 COC(=O)C[C@H](N)CO Amb24561636 [0,1,0,0,0,1|0,0,0]=2 3731 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,1,0,0,0,1|2,0,0]=4 3732 B8R0.19 COC(=O)NC(N)OC Amb24562342 [0,1,0,0,0,1|2,0,0]=4 3733 B8R0.19 COC(=O)NC(N)SC Amb24340152 [0,1,0,0,0,1|2,0,0]=4 3734 B8R0.19 COC(=O)N[C@@H](C)CN Amb22747138 [0,1,0,0,0,1|2,0,0]=4 3735 B8R0.19 COC(=O)N[C@H](C)CO Amb24478791 [0,1,0,0,0,1|1,0,0]=3 3736 B8R0.19 COC(=O)\C=C(\N)/CF Amb25368302 [0,1,0,0,0,1|1,0,1]=4 3737 B8R0.19 C[C@@H](CO)NC(=O)CBr Amb25794836 [0,1,0,0,0,1|2,0,0]=4 3738 B8R0.19 C[C@@H](CO)NC(=O)CCl Amb22831873 [0,1,0,0,0,1|2,0,0]=4 3739 B8R0.19 C[C@@H](CO)NC(=O)CN Amb25071829 [0,1,0,0,0,1|2,0,0]=4 3740 B8R0.19 C[C@@H](CO)\C=C(\C)/CO Amb24644328 [0,1,0,0,0,1|2,0,0]=4 3741 B8R0.19 C[C@H](CO)NC(=O)C=C Amb24478792 [0,1,0,0,0,1|2,0,0]=4 3742 B8R0.19 C[C@H](CO)NC(=O)CCl Amb25823305 [0,1,0,0,0,1|2,0,0]=4 3743 B8R0.19 C[C@H](CO)\C=C(\C)/CO Amb24645855 [0,1,0,0,0,1|2,0,0]=4 3744 B8R0.19 NC(C[C@H](O)CO)CO Amb25230608 [0,1,0,0,0,1|0,0,2]=4 3745 B8R0.19 NCC(O)CC(=O)NO Amb25203640 [0,1,0,0,0,1|2,0,0]=4 3746 B8R0.19 NNC(=O)OC(O)CO Amb24644296 [0,1,0,0,0,1|2,0,0]=4 3747 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,1,0,0,0,1|1,0,1]=4 3748 B8R0.19 OCC(O)CC(O)C=O Amb22731319 [0,1,0,0,0,1|1,0,1]=4 3749 B8R0.19 OC[C@@H](O)CC(=O)C=O Amb24468249 [0,1,0,0,0,1|1,0,1]=4 3750 B8R0.19 OC[C@@H](O)C[C@@H](O)C=O Amb25340462 [0,1,0,0,0,1|1,0,1]=4 3751 B8R0.19 OC[C@H](O)C[C@@H](O)C=O Amb24441617 [0,1,0,0,0,1|1,0,1]=4 3752 B8R0.19 O[C@@H](CC(=O)CO)CO Amb24387900 [0,1,0,0,0,1|1,0,0]=3 3753 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,1,0,0,0,1|2,0,0]=4 3754 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,1,0,0,0,1|1,0,1]=4 3755 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,1,0,0,0,1|1,0,1]=4 3756 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,1,0,0,0,1|1,0,1]=4 3757 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,1|0,0,2]=4 3758 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,1|2,0,0]=4 3759 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,1,0,0,0,1|2,0,0]=4 3760 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,1,0,0,0,1|1,0,1]=4 3761 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,1,0,0,0,1|2,0,0]=4 3762 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,1,0,0,0,1|1,1,0]=4 3763 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,1|2,0,0]=4 3764 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,1,0,0,0,1|1,0,0]=3 3765 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,1,0,0,0,1|2,0,0]=4 3766 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,1|2,0,0]=4 3767 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,1,0,0,0,1|1,0,0]=3 3768 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,1,0,0,0,1|2,0,0]=4 3769 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,1,0,0,0,1|2,0,0]=4 3770 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,1|2,0,0]=4 3771 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,1,0,0,0,1|2,0,0]=4 3772 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,1|1,0,0]=3 3773 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,1,0,0,0,1|2,0,0]=4 3774 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,1|2,0,0]=4 3775 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,1,0,0,0,1|2,0,0]=4 3776 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,1,0,0,0,1|1,0,1]=4 3777 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,1,0,0,0,1|2,0,0]=4 3778 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,1,0,0,0,1|1,0,0]=3 3779 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,1,0,0,0,1|0,0,0]=2 3780 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,1,0,0,0,1|0,0,0]=2 3781 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,1,0,0,0,1|2,0,0]=4 3782 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,1,0,0,0,1|1,0,1]=4 3783 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,1,0,0,0,1|2,0,0]=4 3784 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,1,0,0,0,1|2,0,0]=4 3785 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,1,0,0,0,1|2,0,0]=4 3786 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,1,0,0,0,1|2,0,0]=4 3787 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,1,0,0,0,1|1,0,1]=4 3788 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,1,0,0,0,1|0,0,2]=4 3789 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,1,0,0,0,1|1,0,1]=4 3790 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,1,0,0,0,1|1,0,1]=4 3791 B8R0.23 NC(=O)NC(N)C(O)=O Amb24418886 [0,1,0,0,0,1|1,0,1]=4 3792 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,1,0,0,0,1|0,0,2]=4 3793 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,1,0,0,0,1|1,0,0]=3 3794 B8R0.23 NC(CC(N)=O)C(Cl)Cl Amb25227960 [0,1,0,0,0,1|2,0,0]=4 3795 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,1,0,0,0,1|1,0,0]=3 3796 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,1,0,0,0,1|0,0,1]=3 3797 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,1,0,0,0,1|0,0,2]=4 3798 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,1,0,0,0,1|0,0,2]=4 3799 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,1,0,0,0,1|0,0,2]=4 3800 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,1,0,0,0,1|0,0,2]=4 3801 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,1,0,0,0,1|0,0,2]=4 3802 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,1,0,0,0,1|0,0,1]=3 3803 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,1,0,0,0,1|0,0,2]=4 3804 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,1,0,0,0,1|1,0,1]=4 3805 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,1,0,0,0,1|0,0,1]=3 3806 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,1,0,0,0,1|0,0,1]=3 3807 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,1,0,0,0,1|0,0,1]=3 3808 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,1,0,0,0,1|0,0,1]=3 3809 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,1,0,0,0,1|1,0,1]=4 3810 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,1,0,0,0,1|1,0,0]=3 3811 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,1,0,0,0,1|0,0,2]=4 3812 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,1,0,0,0,1|0,0,2]=4 3813 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,1,0,0,0,1|0,0,2]=4 3814 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,1,0,0,0,1|0,0,2]=4 3815 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,1,0,0,0,1|0,0,2]=4 3816 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,1,0,0,0,1|0,0,2]=4 3817 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,1,0,0,0,1|0,0,2]=4 3818 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,1,0,0,0,1|1,0,1]=4 3819 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,1,0,0,0,1|0,0,1]=3 3820 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,1,0,0,0,1|1,0,0]=3 3821 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,1,0,0,0,1|1,0,1]=4 3822 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,1,0,0,0,1|1,0,0]=3 3823 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,1,0,0,0,1|1,0,1]=4 3824 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,1,0,0,0,1|1,0,1]=4 3825 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,1,0,0,0,1|1,0,1]=4 3826 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,1,0,0,0,1|1,0,1]=4 3827 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,1,0,0,0,1|1,0,1]=4 3828 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,1,0,0,0,1|1,0,1]=4 3829 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,1,0,0,0,1|0,0,1]=3 3830 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,1,0,0,0,1|0,0,0]=2 3831 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,1,0,0,0,1|1,0,1]=4 3832 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,1,0,0,0,1|1,0,1]=4 3833 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,1,0,0,0,1|1,0,1]=4 3834 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,1,0,0,0,1|1,0,1]=4 3835 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,1,0,0,0,1|1,0,1]=4 3836 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,1,0,0,0,1|1,0,1]=4 3837 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,1,0,0,0,1|2,0,0]=4 3838 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,1,0,0,0,1|1,0,1]=4 3839 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,1,0,0,0,1|1,0,1]=4 3840 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,1,0,0,0,1|1,0,1]=4 3841 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,1,0,0,0,1|0,0,1]=3 3842 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,1,0,0,0,1|0,0,1]=3 3843 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,1,0,0,0,1|0,0,1]=3 3844 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,1,0,0,0,1|1,0,1]=4 3845 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,1,0,0,0,1|0,0,1]=3 3846 B8R0.24 CC(C)(O)CC(N)CO Amb24392215 [0,1,0,0,0,1|1,0,1]=4 3847 B8R0.24 CC(CO)OP(O)(O)=O Amb25121032 [0,1,0,0,0,1|2,0,0]=4 3848 B8R0.24 CC[C@@H](N)CS(O)(=O)=O Amb24495132 [0,1,0,0,0,1|2,0,0]=4 3849 B8R0.24 CC[C@H](N)CS(O)(=O)=O Amb25146380 [0,1,0,0,0,1|2,0,0]=4 3850 B8R0.24 N[C@@H](CS(O)(=O)=O)CO Amb25083500 [0,1,0,0,0,1|1,0,0]=3 3851 B8R0.24 OCC(O)CS(O)(=O)=O Amb25802047 [0,1,0,0,0,1|2,0,0]=4 3852 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,1,0,0,0,1|2,0,0]=4 3853 B8R0.34 CC(C)(CBr)CC(O)=O Amb24480039 [0,1,0,0,0,1|2,0,0]=4 3854 B8R0.34 CC(C)(CC(O)=O)CO Amb24116870 [0,1,0,0,0,1|1,0,0]=3 3855 B8R0.34 CC(C)(CO)CC(N)=O Amb25063938 [0,1,0,0,0,1|2,0,0]=4 3856 B8R0.34 CC(C)(CO)CC([O-])=O Amb24178915 [0,1,0,0,0,1|1,0,1]=4 3857 B8R0.34 CC(F)(CN)CC(O)=O Amb24481603 [0,1,0,0,0,1|2,0,0]=4 3858 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,1,0,0,0,1|1,0,1]=4 3859 B8R0.34 CC(N)(CCl)CC(O)=O Amb22641961 [0,1,0,0,0,1|1,0,0]=3 3860 B8R0.34 CC(O)(CN)CC(O)=O Amb25188898 [0,1,0,0,0,1|2,0,0]=4 3861 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,1,0,0,0,1|2,0,0]=4 3862 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,1,0,0,0,1|1,0,0]=3 3863 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,1,0,0,0,1|2,0,0]=4 3864 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,1,0,0,0,1|2,0,0]=4 3865 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,1,0,0,0,1|1,0,0]=3 3866 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,1,0,0,0,1|2,0,0]=4 3867 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,1,0,0,0,1|2,0,0]=4 3868 B8R0.34 C[C@@](N)(CC(O)=O)CO Amb25715205 [0,1,0,0,0,1|0,0,0]=2 3869 B8R0.34 C[C@@](O)(CN)CC(O)=O Amb24745092 [0,1,0,0,0,1|2,0,0]=4 3870 B8R0.34 NCC(F)(F)CC(O)=O Amb19148532 [0,1,0,0,0,1|2,0,0]=4 3871 B8R0.34 OCC(OC(=O)C)(C)C Amb17607378 [0,1,0,0,0,1|2,0,0]=4 3872 B8R0.3 C#CCC(N)C(=O)NN Amb24737524 [0,2,0,0,0,0|2,0,0]=4 3873 B8R0.3 C=CC(=O)C(N)CC=C Amb25736446 [0,2,0,0,0,0|2,0,0]=4 3874 B8R0.3 C=CCC(N)C(=O)NN Amb25298561 [0,2,0,0,0,0|2,0,0]=4 3875 B8R0.3 C=CC[C@H](O)[C@@H](N)CO Amb25843822 [0,2,0,0,0,0|1,0,1]=4 3876 B8R0.3 CC#CC(O)[C@H](N)CO Amb24385152 [0,2,0,0,0,0|1,0,1]=4 3877 B8R0.3 CC(C(=O)OC)CC#N Amb17334094 [0,2,0,0,0,0|2,0,0]=4 3878 B8R0.3 CC(C(=O)OC)CCCl Amb16230918 [0,2,0,0,0,0|2,0,0]=4 3879 B8R0.3 CC(CC=C)C(=O)CO Amb25662371 [0,2,0,0,0,0|2,0,0]=4 3880 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|2,0,0]=4 3881 B8R0.3 CC(CCN)C(=O)NO Amb24387287 [0,2,0,0,0,0|2,0,0]=4 3882 B8R0.3 CC(CCO)C(=O)NN Amb25084889 [0,2,0,0,0,0|2,0,0]=4 3883 B8R0.3 CC(CO)C(C)=CCO Amb25265627 [0,2,0,0,0,0|2,0,0]=4 3884 B8R0.3 CCC(=O)C(N)CCC Amb18203222 [0,2,0,0,0,0|2,0,0]=4 3885 B8R0.3 CCC(=O)N(N)CCO Amb18124355 [0,2,0,0,0,0|2,0,0]=4 3886 B8R0.3 CCC(C)C(=O)NOC Amb24709831 [0,2,0,0,0,0|2,0,0]=4 3887 B8R0.3 CCC(C)C(=O)\C=N\O Amb25768458 [0,2,0,0,0,0|2,0,0]=4 3888 B8R0.3 CCC(Cl)C(=O)CCO Amb24409195 [0,2,0,0,0,0|2,0,0]=4 3889 B8R0.3 CCC(Cl)C(=O)OCCl Amb25297436 [0,2,0,0,0,0|2,0,0]=4 3890 B8R0.3 CCC(N)C(=C)COC Amb25242050 [0,2,0,0,0,0|2,0,0]=4 3891 B8R0.3 CCC(N)C(=O)CC#C Amb25808209 [0,2,0,0,0,0|2,0,0]=4 3892 B8R0.3 CCC(N)C(=O)COC Amb18832529 [0,2,0,0,0,0|1,0,0]=3 3893 B8R0.3 CCC(O)C(=O)COC Amb25040361 [0,2,0,0,0,0|2,0,0]=4 3894 B8R0.3 CCC(O)C(=O)NOC Amb25331603 [0,2,0,0,0,0|2,0,0]=4 3895 B8R0.3 CCC(S)C(=O)OCC Amb20623543 [0,2,0,0,0,0|2,0,0]=4 3896 B8R0.3 CCCC(=O)C(N)CO Amb24710738 [0,2,0,0,0,0|1,0,0]=3 3897 B8R0.3 CCCC(Br)C(=O)OC Amb20621576 [0,2,0,0,0,0|2,0,0]=4 3898 B8R0.3 CCCC(C)C(=O)CO Amb25134141 [0,2,0,0,0,0|2,0,0]=4 3899 B8R0.3 CCCC(Cl)C(=O)OC Amb18182712 [0,2,0,0,0,0|2,0,0]=4 3900 B8R0.3 CCCC(N)C(=O)C#C Amb24376925 [0,2,0,0,0,0|2,0,0]=4 3901 B8R0.3 CCCC(N)C(=O)NN Amb24472604 [0,2,0,0,0,0|2,0,0]=4 3902 B8R0.3 CCCC(N)C(=O)NO Amb22059373 [0,2,0,0,0,0|1,0,0]=3 3903 B8R0.3 CCCC(N)C(=O)OC Amb21959980 [0,2,0,0,0,0|1,0,0]=3 3904 B8R0.3 CCCC(N)C(N)=NO Amb24749079 [0,2,0,0,0,0|2,0,0]=4 3905 B8R0.3 CCCC(N)C(O)=NO Amb20669260 [0,2,0,0,0,0|1,0,1]=4 3906 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [0,2,0,0,0,0|2,0,0]=4 3907 B8R0.3 CCCC(O)C(=O)O[Na] Amb22360645 [0,2,0,0,0,0|2,0,0]=4 3908 B8R0.3 CCCC(O)C(N)CO Amb24478778 [0,2,0,0,0,0|1,0,1]=4 3909 B8R0.3 CCCC(O)[C@H](N)CO Amb24476676 [0,2,0,0,0,0|1,0,1]=4 3910 B8R0.3 CCC[C@@H](C(=O)OC)N Amb10844887 [0,2,0,0,0,0|1,0,0]=3 3911 B8R0.3 CCC[C@@H](N)C(=O)NC Amb25348827 [0,2,0,0,0,0|2,0,0]=4 3912 B8R0.3 CCC[C@@H](N)C(=O)OC Amb25146086 [0,2,0,0,0,0|1,0,0]=3 3913 B8R0.3 CCC[C@@H](O)[C@@H](N)CO Amb24120428 [0,2,0,0,0,0|1,0,1]=4 3914 B8R0.3 CCC[C@@H](O)[C@H](N)CO Amb24561952 [0,2,0,0,0,0|1,0,1]=4 3915 B8R0.3 CCC[C@H](Cl)C(=O)OC Amb24480069 [0,2,0,0,0,0|2,0,0]=4 3916 B8R0.3 CCC[C@H](N)C(=O)C=C Amb25200130 [0,2,0,0,0,0|2,0,0]=4 3917 B8R0.3 CCC[C@H](N)C(=O)NN Amb24465179 [0,2,0,0,0,0|2,0,0]=4 3918 B8R0.3 CCC[C@H](N)C(=O)NO Amb24460770 [0,2,0,0,0,0|1,0,0]=3 3919 B8R0.3 CCC[C@H](N)C(=O)OC Amb17942871 [0,2,0,0,0,0|1,0,0]=3 3920 B8R0.3 CCC[C@H](O)C(=O)OC Amb25318183 [0,2,0,0,0,0|2,0,0]=4 3921 B8R0.3 CCC[C@H](O)[C@H](N)CO Amb25113696 [0,2,0,0,0,0|1,0,1]=4 3922 B8R0.3 CCNC(=O)C(N)CO Amb25120983 [0,2,0,0,0,0|1,0,0]=3 3923 B8R0.3 CCNC(=O)C(N)CS Amb24587137 [0,2,0,0,0,0|1,1,0]=4 3924 B8R0.3 CCNC(=O)C(O)CO Amb24505193 [0,2,0,0,0,0|2,0,0]=4 3925 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|2,0,0]=4 3926 B8R0.3 CCOC(=O)C(=C)CO Amb17614080 [0,2,0,0,0,0|1,0,1]=4 3927 B8R0.3 CCOC(=O)C(=O)CO Amb25333851 [0,2,0,0,0,0|1,0,1]=4 3928 B8R0.3 CCOC(=O)C(Br)CF Amb25768929 [0,2,0,0,0,0|2,0,0]=4 3929 B8R0.3 CCOC(=O)C(C#N)N Amb10549349 [0,2,0,0,0,0|1,0,1]=4 3930 B8R0.3 CCOC(=O)C(C#N)N Amb1980774 [0,2,0,0,0,0|1,0,1]=4 3931 B8R0.3 CCOC(=O)C(C)CBr Amb19375560 [0,2,0,0,0,0|2,0,0]=4 3932 B8R0.3 CCOC(=O)C(C)CCl Amb22549464 [0,2,0,0,0,0|2,0,0]=4 3933 B8R0.3 CCOC(=O)C(C)CO Amb20623263 [0,2,0,0,0,0|1,0,0]=3 3934 B8R0.3 CCOC(=O)C(C)NO Amb24437840 [0,2,0,0,0,0|2,0,0]=4 3935 B8R0.3 CCOC(=O)C(CO)O Amb17593407 [0,2,0,0,0,0|1,0,0]=3 3936 B8R0.3 CCOC(=O)C(Cl)CCl Amb22169781 [0,2,0,0,0,0|2,0,0]=4 3937 B8R0.3 CCOC(=O)C(Cl)CF Amb25299040 [0,2,0,0,0,0|2,0,0]=4 3938 B8R0.3 CCOC(=O)C(Cl)CN Amb24480135 [0,2,0,0,0,0|2,0,0]=4 3939 B8R0.3 CCOC(=O)C(Cl)CO Amb25180457 [0,2,0,0,0,0|1,0,0]=3 3940 B8R0.3 CCOC(=O)C(Cl)NO Amb24480107 [0,2,0,0,0,0|2,0,0]=4 3941 B8R0.3 CCOC(=O)C(F)CBr Amb25690055 [0,2,0,0,0,0|2,0,0]=4 3942 B8R0.3 CCOC(=O)C(N)C=C Amb18642705 [0,2,0,0,0,0|1,0,1]=4 3943 B8R0.3 CCOC(=O)C(N)C=O Amb25143671 [0,2,0,0,0,0|0,0,2]=4 3944 B8R0.3 CCOC(=O)C(N)CCl Amb24117929 [0,2,0,0,0,0|1,0,0]=3 3945 B8R0.3 CCOC(=O)C(N)CCl Amb25727695 [0,2,0,0,0,0|1,0,0]=3 3946 B8R0.3 CCOC(=O)C(O)CBr Amb24480251 [0,2,0,0,0,0|2,0,0]=4 3947 B8R0.3 CCOC(=O)C(O)CCl Amb22055205 [0,2,0,0,0,0|2,0,0]=4 3948 B8R0.3 CCOC(=O)C(O)CF Amb25225387 [0,2,0,0,0,0|2,0,0]=4 3949 B8R0.3 CCOC(=O)C(O)CN Amb25805599 [0,2,0,0,0,0|2,0,0]=4 3950 B8R0.3 CCOC(=O)N(F)CO Amb24534694 [0,2,0,0,0,0|2,0,0]=4 3951 B8R0.3 CCOC(=O)[C@@H](C)CBr Amb25718806 [0,2,0,0,0,0|2,0,0]=4 3952 B8R0.3 CCOC(=O)[C@@H](C)CN Amb24394624 [0,2,0,0,0,0|2,0,0]=4 3953 B8R0.3 CCOC(=O)[C@H](C)CBr Amb25257981 [0,2,0,0,0,0|2,0,0]=4 3954 B8R0.3 CCOC(=O)[C@H](C)CN Amb25077065 [0,2,0,0,0,0|2,0,0]=4 3955 B8R0.3 CCOC(=O)[C@H](F)CN Amb25084408 [0,2,0,0,0,0|2,0,0]=4 3956 B8R0.3 CCOC(=O)[C@H](N)CCl Amb25146997 [0,2,0,0,0,0|1,0,0]=3 3957 B8R0.3 CCOC(=O)[C@H](N)CF Amb24532124 [0,2,0,0,0,0|1,0,0]=3 3958 B8R0.3 CCOC(=O)[C@H](N)CO Amb22169869 [0,2,0,0,0,0|0,0,0]=2 3959 B8R0.3 CCOC(=O)[C@H](N)CO Amb24524167 [0,2,0,0,0,0|0,0,0]=2 3960 B8R0.3 CCOC(=O)[C@H](N)CS Amb25146088 [0,2,0,0,0,0|0,1,0]=3 3961 B8R0.3 CCOC(=O)\C(\N)=N\O Amb21858685 [0,2,0,0,0,0|1,0,1]=4 3962 B8R0.3 CCSC(=O)C(Cl)CO Amb24552859 [0,2,0,0,0,0|1,1,0]=4 3963 B8R0.3 CCSC(C)C(=O)OC Amb24457258 [0,2,0,0,0,0|2,0,0]=4 3964 B8R0.3 CC[C@@H](Br)C(=O)OCC Amb25188936 [0,2,0,0,0,0|2,0,0]=4 3965 B8R0.3 CC[C@@H](N)C(=O)NOC Amb25040382 [0,2,0,0,0,0|1,0,0]=3 3966 B8R0.3 CC[C@@H](N)C(=O)OCC Amb22745247 [0,2,0,0,0,0|1,0,0]=3 3967 B8R0.3 CC[C@H](Br)C(=O)OCC Amb24480229 [0,2,0,0,0,0|2,0,0]=4 3968 B8R0.3 CC[C@H](N)C(=O)NCC Amb25732232 [0,2,0,0,0,0|2,0,0]=4 3969 B8R0.3 CC\C=C(/N)\C(=O)OC Amb24447011 [0,2,0,0,0,0|1,0,1]=4 3970 B8R0.3 CN(CO)C(=O)NCO Amb25146178 [0,2,0,0,0,0|2,0,0]=4 3971 B8R0.3 CNC(=O)C(C)COC Amb25059266 [0,2,0,0,0,0|2,0,0]=4 3972 B8R0.3 CNC(=O)C(Cl)COC Amb25276792 [0,2,0,0,0,0|2,0,0]=4 3973 B8R0.3 CNC(=O)C(N)CC=C Amb25265243 [0,2,0,0,0,0|2,0,0]=4 3974 B8R0.3 CNC(=O)C(N)COC Amb24466424 [0,2,0,0,0,0|1,0,0]=3 3975 B8R0.3 CNC(=O)C(O)CCO Amb24417912 [0,2,0,0,0,0|2,0,0]=4 3976 B8R0.3 CNC(=O)C(O)COC Amb24419361 [0,2,0,0,0,0|2,0,0]=4 3977 B8R0.3 CNC(=O)[C@@H](O)CCO Amb25272705 [0,2,0,0,0,0|2,0,0]=4 3978 B8R0.3 CNCC(Br)C(=O)OC Amb25711547 [0,2,0,0,0,0|2,0,0]=4 3979 B8R0.3 CNCC(Cl)C(=O)OC Amb25804470 [0,2,0,0,0,0|2,0,0]=4 3980 B8R0.3 CNCC(F)C(=O)OC Amb25365321 [0,2,0,0,0,0|2,0,0]=4 3981 B8R0.3 CNCC(I)C(=O)OC Amb25247168 [0,2,0,0,0,0|2,0,0]=4 3982 B8R0.3 COC(=N)C(C)COC Amb25102135 [0,2,0,0,0,0|2,0,0]=4 3983 B8R0.3 COC(=O)C(Br)CC=C Amb24529042 [0,2,0,0,0,0|2,0,0]=4 3984 B8R0.3 COC(=O)C(Br)CCO Amb25708416 [0,2,0,0,0,0|1,0,0]=3 3985 B8R0.3 COC(=O)C(C)CC#C Amb18115942 [0,2,0,0,0,0|2,0,0]=4 3986 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 3987 B8R0.3 COC(=O)C(C)CNO Amb25698628 [0,2,0,0,0,0|1,0,0]=3 3988 B8R0.3 COC(=O)C(Cl)CC=C Amb25365264 [0,2,0,0,0,0|2,0,0]=4 3989 B8R0.3 COC(=O)C(Cl)CCN Amb25799672 [0,2,0,0,0,0|2,0,0]=4 3990 B8R0.3 COC(=O)C(Cl)CCO Amb25300346 [0,2,0,0,0,0|1,0,0]=3 3991 B8R0.3 COC(=O)C(Cl)CSC Amb25858109 [0,2,0,0,0,0|1,1,0]=4 3992 B8R0.3 COC(=O)C(Cl)CSCl Amb25690063 [0,2,0,0,0,0|1,1,0]=4 3993 B8R0.3 COC(=O)C(Cl)SCCl Amb24479992 [0,2,0,0,0,0|2,0,0]=4 3994 B8R0.3 COC(=O)C(F)CCN Amb22388532 [0,2,0,0,0,0|2,0,0]=4 3995 B8R0.3 COC(=O)C(N)CC#C Amb24426865 [0,2,0,0,0,0|1,0,0]=3 3996 B8R0.3 COC(=O)C(N)CC=C Amb18642703 [0,2,0,0,0,0|1,0,0]=3 3997 B8R0.3 COC(=O)C(N)CC=C Amb22757544 [0,2,0,0,0,0|1,0,0]=3 3998 B8R0.3 COC(=O)C(N)CCF Amb25066743 [0,2,0,0,0,0|1,0,0]=3 3999 B8R0.3 COC(=O)C(N)CCI Amb24689288 [0,2,0,0,0,0|1,0,0]=3 4000 B8R0.3 COC(=O)C(N)CCN Amb24113143 [0,2,0,0,0,0|1,0,0]=3 4001 B8R0.3 COC(=O)C(N)CCN Amb25733368 [0,2,0,0,0,0|1,0,0]=3 4002 B8R0.3 COC(=O)C(N)CCO Amb18305497 [0,2,0,0,0,0|0,0,0]=2 4003 B8R0.3 COC(=O)C(N)CCS Amb18304164 [0,2,0,0,0,0|0,1,0]=3 4004 B8R0.3 COC(=O)C(N)CNN Amb24469433 [0,2,0,0,0,0|1,0,0]=3 4005 B8R0.3 COC(=O)C(N)COC Amb23454660 [0,2,0,0,0,0|0,0,0]=2 4006 B8R0.3 COC(=O)C(N)CSC Amb19878256 [0,2,0,0,0,0|0,1,0]=3 4007 B8R0.3 COC(=O)C(N)CSC Amb22052594 [0,2,0,0,0,0|0,1,0]=3 4008 B8R0.3 COC(=O)C(N)CSCl Amb24629536 [0,2,0,0,0,0|0,1,0]=3 4009 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [0,2,0,0,0,0|2,0,0]=4 4010 B8R0.3 COC(=O)C(O)CC=O Amb25357382 [0,2,0,0,0,0|1,0,1]=4 4011 B8R0.3 COC(=O)C(O)CCF Amb25114455 [0,2,0,0,0,0|2,0,0]=4 4012 B8R0.3 COC(=O)C(O)CCO Amb25846187 [0,2,0,0,0,0|1,0,0]=3 4013 B8R0.3 COC(=O)C(O)COC Amb23596463 [0,2,0,0,0,0|1,0,0]=3 4014 B8R0.3 COC(=O)C(O)CON Amb24360318 [0,2,0,0,0,0|1,0,0]=3 4015 B8R0.3 COC(=O)[C@@H](C)CC=O Amb25683366 [0,2,0,0,0,0|1,0,1]=4 4016 B8R0.3 COC(=O)[C@@H](C)C[Zn]Br Amb22336632 [0,2,0,0,0,0|2,0,0]=4 4017 B8R0.3 COC(=O)[C@@H](C)OCC Amb25113653 [0,2,0,0,0,0|2,0,0]=4 4018 B8R0.3 COC(=O)[C@@H](N)C=C=C Amb24476681 [0,2,0,0,0,0|1,0,1]=4 4019 B8R0.3 COC(=O)[C@@H](N)CC#C Amb22746034 [0,2,0,0,0,0|1,0,0]=3 4020 B8R0.3 COC(=O)[C@@H](N)CC#N Amb25292167 [0,2,0,0,0,0|1,0,0]=3 4021 B8R0.3 COC(=O)[C@@H](N)CC=C Amb22750599 [0,2,0,0,0,0|1,0,0]=3 4022 B8R0.3 COC(=O)[C@@H](N)CC=C Amb24120340 [0,2,0,0,0,0|1,0,0]=3 4023 B8R0.3 COC(=O)[C@@H](N)CCN Amb25727598 [0,2,0,0,0,0|1,0,0]=3 4024 B8R0.3 COC(=O)[C@@H](N)CCO Amb24183815 [0,2,0,0,0,0|0,0,0]=2 4025 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [0,2,0,0,0,0|0,0,0]=2 4026 B8R0.3 COC(=O)[C@@H](N)CCS Amb25679147 [0,2,0,0,0,0|0,1,0]=3 4027 B8R0.3 COC(=O)[C@@H](N)COC Amb24183609 [0,2,0,0,0,0|0,0,0]=2 4028 B8R0.3 COC(=O)[C@@H](O)CC=C Amb25146218 [0,2,0,0,0,0|2,0,0]=4 4029 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [0,2,0,0,0,0|2,0,0]=4 4030 B8R0.3 COC(=O)[C@H](C)CON Amb24604757 [0,2,0,0,0,0|1,0,0]=3 4031 B8R0.3 COC(=O)[C@H](C)C[Zn]Br Amb22336304 [0,2,0,0,0,0|2,0,0]=4 4032 B8R0.3 COC(=O)[C@H](Cl)CCN Amb24595014 [0,2,0,0,0,0|2,0,0]=4 4033 B8R0.3 COC(=O)[C@H](N)CC#N Amb24627258 [0,2,0,0,0,0|1,0,0]=3 4034 B8R0.3 COC(=O)[C@H](N)CC=C Amb24635550 [0,2,0,0,0,0|1,0,0]=3 4035 B8R0.3 COC(=O)[C@H](N)COC Amb24476668 [0,2,0,0,0,0|0,0,0]=2 4036 B8R0.3 COC(=O)[C@H](O)CC#C Amb24674438 [0,2,0,0,0,0|2,0,0]=4 4037 B8R0.3 COC(=O)[C@H](O)CCN Amb24476659 [0,2,0,0,0,0|2,0,0]=4 4038 B8R0.3 COCC(C(=O)OC)Br Amb10070673 [0,2,0,0,0,0|1,0,0]=3 4039 B8R0.3 COCC(C)C(=O)NN Amb25189246 [0,2,0,0,0,0|2,0,0]=4 4040 B8R0.3 COCC(C)C(Cl)=NO Amb25276568 [0,2,0,0,0,0|2,0,0]=4 4041 B8R0.3 COCC(N)C(=O)C#C Amb25264147 [0,2,0,0,0,0|1,0,0]=3 4042 B8R0.3 COCC(N)C(=O)C=C Amb24698409 [0,2,0,0,0,0|1,0,0]=3 4043 B8R0.3 COCC(N)C(=O)NN Amb24368965 [0,2,0,0,0,0|1,0,0]=3 4044 B8R0.3 COCC(O)C(=O)CO Amb25286582 [0,2,0,0,0,0|1,0,0]=3 4045 B8R0.3 COCC(O)C(=O)NN Amb24610375 [0,2,0,0,0,0|2,0,0]=4 4046 B8R0.3 COCC(O)C(O)C=O Amb25093758 [0,2,0,0,0,0|1,0,1]=4 4047 B8R0.3 COC[C@@H](O)[C@@H](O)C=O Amb24678218 [0,2,0,0,0,0|1,0,1]=4 4048 B8R0.3 COC[C@H](O)C(=O)CO Amb24422234 [0,2,0,0,0,0|1,0,0]=3 4049 B8R0.3 CONC(=O)C(C)CCl Amb25258204 [0,2,0,0,0,0|2,0,0]=4 4050 B8R0.3 CSC(=O)N(N)CCO Amb24466274 [0,2,0,0,0,0|1,1,0]=4 4051 B8R0.3 CSC[C@@H](C(=O)OC)N Amb15701265 [0,2,0,0,0,0|0,1,0]=3 4052 B8R0.3 CSC[C@@H](C(=O)OC)N Amb17322841 [0,2,0,0,0,0|0,1,0]=3 4053 B8R0.3 CSC[C@H](O)[C@@H](N)CO Amb24399288 [0,2,0,0,0,0|0,1,1]=4 4054 B8R0.3 C[C@@H](CCO)C(=O)NN Amb25215392 [0,2,0,0,0,0|2,0,0]=4 4055 B8R0.3 C[C@H](CCO)C(=O)NN Amb25741170 [0,2,0,0,0,0|2,0,0]=4 4056 B8R0.3 C[C@H](NCC)C(=O)NO Amb24700450 [0,2,0,0,0,0|2,0,0]=4 4057 B8R0.3 C\C=C/[C@@H](N)C(=O)OC Amb24744726 [0,2,0,0,0,0|1,0,1]=4 4058 B8R0.3 NC(CO)C(O)CCO Amb25240694 [0,2,0,0,0,0|0,0,2]=4 4059 B8R0.3 NCCC(=O)C(N)CF Amb25785007 [0,2,0,0,0,0|2,0,0]=4 4060 B8R0.3 NCCC(=O)C(N)CO Amb24598991 [0,2,0,0,0,0|1,0,0]=3 4061 B8R0.3 NCCC(=O)C(N)CS Amb24476624 [0,2,0,0,0,0|1,1,0]=4 4062 B8R0.3 N[C@H](CCO)[C@@H](O)C=O Amb24409981 [0,2,0,0,0,0|0,0,1]=3 4063 B8R0.3 OC([C@H](CO)O)CC=O Amb10838108 [0,2,0,0,0,0|1,0,1]=4 4064 B8R0.3 OCC(=O)C(O)CC=O Amb25350826 [0,2,0,0,0,0|1,0,1]=4 4065 B8R0.3 OCC(=O)C(O)CCO Amb24364093 [0,2,0,0,0,0|1,0,0]=3 4066 B8R0.3 OCC(=O)[C@@H](O)CCO Amb25718359 [0,2,0,0,0,0|1,0,0]=3 4067 B8R0.3 OCCC(O)C(O)C=O Amb25694394 [0,2,0,0,0,0|1,0,1]=4 4068 B8R0.3 OCC[C@H](O)[C@H](O)C=O Amb25300385 [0,2,0,0,0,0|1,0,1]=4 4069 B8R0.3 OCN(Cl)C(=O)NCO Amb25210955 [0,2,0,0,0,0|2,0,0]=4 4070 B8R0.3 OC[C@H](O)[C@H](O)CC=O Amb17943012 [0,2,0,0,0,0|1,0,1]=4 4071 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,2,0,0,0,0|2,0,0]=4 4072 B8R0.8 C#CCC[C@@H](N)C(N)=O Amb25368154 [0,2,0,0,0,0|2,0,0]=4 4073 B8R0.8 C#CCC[C@@H](N)C(O)=O Amb24088809 [0,2,0,0,0,0|1,0,0]=3 4074 B8R0.8 C#CCC[C@H](N)C(O)=O Amb24088866 [0,2,0,0,0,0|1,0,0]=3 4075 B8R0.8 C=C(CCON)C(O)=O Amb25859256 [0,2,0,0,0,0|1,0,1]=4 4076 B8R0.8 C=C=CCC(N)C(N)=O Amb24381912 [0,2,0,0,0,0|2,0,0]=4 4077 B8R0.8 C=C=CCC(N)C(O)=O Amb25843448 [0,2,0,0,0,0|1,0,0]=3 4078 B8R0.8 C=C=CC[C@H](N)C(O)=O Amb24355608 [0,2,0,0,0,0|1,0,0]=3 4079 B8R0.8 C=CCCC(Cl)C(O)=O Amb25041973 [0,2,0,0,0,0|2,0,0]=4 4080 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,2,0,0,0,0|2,0,0]=4 4081 B8R0.8 C=CCCC(N)C(O)=O Amb24383848 [0,2,0,0,0,0|1,0,0]=3 4082 B8R0.8 C=CCC[C@@H](N)C(O)=O Amb23439045 [0,2,0,0,0,0|1,0,0]=3 4083 B8R0.8 C=CCOC(F)C(O)=O Amb24478688 [0,2,0,0,0,0|2,0,0]=4 4084 B8R0.8 C=C\C=C\C(N)C(O)=O Amb24476635 [0,2,0,0,0,0|1,0,1]=4 4085 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,2,0,0,0,0|2,0,0]=4 4086 B8R0.8 CC#CCC(N)C(O)=O Amb18988250 [0,2,0,0,0,0|1,0,0]=3 4087 B8R0.8 CC#CCC(O)C(O)=O Amb25213344 [0,2,0,0,0,0|2,0,0]=4 4088 B8R0.8 CC#CC[C@@H](C)C(O)=O Amb24589724 [0,2,0,0,0,0|2,0,0]=4 4089 B8R0.8 CC#CC[C@@H](N)C(N)=O Amb25324867 [0,2,0,0,0,0|2,0,0]=4 4090 B8R0.8 CC#CC[C@@H](N)C(O)=O Amb22746783 [0,2,0,0,0,0|1,0,0]=3 4091 B8R0.8 CC(=O)C(Br)CCCO Amb25146214 [0,2,0,0,0,0|2,0,0]=4 4092 B8R0.8 CC(=O)C(Cl)OCCO Amb25696998 [0,2,0,0,0,0|2,0,0]=4 4093 B8R0.8 CC(=O)C(O)CCCO Amb24364072 [0,2,0,0,0,0|2,0,0]=4 4094 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [0,2,0,0,0,0|2,0,0]=4 4095 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [0,2,0,0,0,0|2,0,0]=4 4096 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [0,2,0,0,0,0|2,0,0]=4 4097 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [0,2,0,0,0,0|2,0,0]=4 4098 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [0,2,0,0,0,0|1,0,1]=4 4099 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [0,2,0,0,0,0|2,0,0]=4 4100 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [0,2,0,0,0,0|2,0,0]=4 4101 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [0,2,0,0,0,0|2,0,0]=4 4102 B8R0.8 CC(CCCO)C(=O)S Amb25221473 [0,2,0,0,0,0|1,1,0]=4 4103 B8R0.8 CC(CN=[N+]=[N-])C(O)=O Amb25786485 [0,2,0,0,0,0|2,0,0]=4 4104 B8R0.8 CC(CNC=O)C(O)=O Amb18299693 [0,2,0,0,0,0|1,0,1]=4 4105 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [0,2,0,0,0,0|2,0,0]=4 4106 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [0,2,0,0,0,0|2,0,0]=4 4107 B8R0.8 CC(NCCO)C(C)=O Amb18627404 [0,2,0,0,0,0|2,0,0]=4 4108 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [0,2,0,0,0,0|2,0,0]=4 4109 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [0,2,0,0,0,0|2,0,0]=4 4110 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [0,2,0,0,0,0|2,0,0]=4 4111 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [0,2,0,0,0,0|2,0,0]=4 4112 B8R0.8 CCC#CC(O)C(O)=O Amb25245439 [0,2,0,0,0,0|2,0,0]=4 4113 B8R0.8 CCCCC(C(=O)C)N Amb1099238 [0,2,0,0,0,0|2,0,0]=4 4114 B8R0.8 CCCCC(C(=O)O)Cl Amb17593750 [0,2,0,0,0,0|2,0,0]=4 4115 B8R0.8 CCCCC(F)C(O)=O Amb25238781 [0,2,0,0,0,0|2,0,0]=4 4116 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,2,0,0,0,0|2,0,0]=4 4117 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,2,0,0,0,0|2,0,0]=4 4118 B8R0.8 CCCCC(S)C(O)=O Amb25323873 [0,2,0,0,0,0|2,0,0]=4 4119 B8R0.8 CCCC[C@@H](Br)C(O)=O Amb24377169 [0,2,0,0,0,0|2,0,0]=4 4120 B8R0.8 CCCC[C@@H](C(=O)O)N Amb1995007 [0,2,0,0,0,0|1,0,0]=3 4121 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [0,2,0,0,0,0|2,0,0]=4 4122 B8R0.8 CCCC[C@@H](N)C(N)=O Amb23438981 [0,2,0,0,0,0|2,0,0]=4 4123 B8R0.8 CCCC[C@@H](S)C(O)=O Amb24478188 [0,2,0,0,0,0|2,0,0]=4 4124 B8R0.8 CCCC[C@H](C(=O)O)N Amb1995006 [0,2,0,0,0,0|1,0,0]=3 4125 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [0,2,0,0,0,0|2,0,0]=4 4126 B8R0.8 CCCC[C@H](N)C(N)=O Amb25361837 [0,2,0,0,0,0|2,0,0]=4 4127 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [0,2,0,0,0,0|2,0,0]=4 4128 B8R0.8 CCNCC(N)C(N)=O Amb25841908 [0,2,0,0,0,0|2,0,0]=4 4129 B8R0.8 CCOCC(C)C(C)=O Amb24621069 [0,2,0,0,0,0|2,0,0]=4 4130 B8R0.8 CCOCC(Cl)C(O)=O Amb24481790 [0,2,0,0,0,0|1,0,0]=3 4131 B8R0.8 CCOCC(O)C(O)=O Amb25804394 [0,2,0,0,0,0|1,0,0]=3 4132 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [0,2,0,0,0,0|1,0,0]=3 4133 B8R0.8 CCOC[C@H](N)C(O)=O Amb22737184 [0,2,0,0,0,0|0,0,0]=2 4134 B8R0.8 CCOC[C@H](N)C(O)=O Amb24478577 [0,2,0,0,0,0|0,0,0]=2 4135 B8R0.8 CCOC[C@H](O)C(O)=O Amb24340099 [0,2,0,0,0,0|1,0,0]=3 4136 B8R0.8 CCSCC(N)C(N)=O Amb24761235 [0,2,0,0,0,0|1,1,0]=4 4137 B8R0.8 CCSC[C@@H](N)C(O)=O Amb22800347 [0,2,0,0,0,0|0,1,0]=3 4138 B8R0.8 CCSC[C@H](N)C(N)=O Amb24393154 [0,2,0,0,0,0|1,1,0]=4 4139 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [0,2,0,0,0,0|2,0,0]=4 4140 B8R0.8 CC\C=C\C(N)C(O)=O Amb18642708 [0,2,0,0,0,0|1,0,0]=3 4141 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [0,2,0,0,0,0|2,0,0]=4 4142 B8R0.8 CNCCC(O)C(O)=O Amb24540612 [0,2,0,0,0,0|2,0,0]=4 4143 B8R0.8 CNCC[C@H](N)C(O)=O Amb24427654 [0,2,0,0,0,0|1,0,0]=3 4144 B8R0.8 COCCC(C)C(N)=O Amb24760323 [0,2,0,0,0,0|2,0,0]=4 4145 B8R0.8 COCCC(C)C(O)=O Amb18523823 [0,2,0,0,0,0|1,0,0]=3 4146 B8R0.8 COCCC(Cl)C(C)=O Amb25707829 [0,2,0,0,0,0|2,0,0]=4 4147 B8R0.8 COCCC(N)C(C)=C Amb24532850 [0,2,0,0,0,0|2,0,0]=4 4148 B8R0.8 COCCC(N)C(C)=O Amb24496676 [0,2,0,0,0,0|1,0,0]=3 4149 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,2,0,0,0,0|1,0,0]=3 4150 B8R0.8 COCCC(O)C(=O)Cl Amb25781911 [0,2,0,0,0,0|2,0,0]=4 4151 B8R0.8 COCC[C@@H](C(=O)O)N Amb16183872 [0,2,0,0,0,0|0,0,0]=2 4152 B8R0.8 COCC[C@H](C(=O)O)N Amb16183870 [0,2,0,0,0,0|0,0,0]=2 4153 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [0,2,0,0,0,0|1,0,0]=3 4154 B8R0.8 COCC[C@H](N)C(O)=O Amb24054991 [0,2,0,0,0,0|0,0,0]=2 4155 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,2,0,0,0,0|2,0,0]=4 4156 B8R0.8 COCO[C@@H](C)C(C)=O Amb25096675 [0,2,0,0,0,0|2,0,0]=4 4157 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [0,2,0,0,0,0|1,0,0]=3 4158 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [0,2,0,0,0,0|1,0,0]=3 4159 B8R0.8 COC\C=C(\Br)/C(O)=O Amb24580462 [0,2,0,0,0,0|1,0,1]=4 4160 B8R0.8 CONCC(C)C(N)=O Amb24440524 [0,2,0,0,0,0|2,0,0]=4 4161 B8R0.8 CONCC(N)C(O)=O Amb24392137 [0,2,0,0,0,0|0,0,0]=2 4162 B8R0.8 CONC[C@H](N)C(O)=O Amb25376688 [0,2,0,0,0,0|0,0,0]=2 4163 B8R0.8 CO\C=C/C(C)C(O)=O Amb18642780 [0,2,0,0,0,0|1,0,1]=4 4164 B8R0.8 CO\C=C\C(C)C(O)=O Amb25188040 [0,2,0,0,0,0|1,0,1]=4 4165 B8R0.8 CO\C=C\C(N)C(O)=O Amb18642835 [0,2,0,0,0,0|0,0,1]=3 4166 B8R0.8 CO\C=C\[C@H](N)C(O)=O Amb24478831 [0,2,0,0,0,0|0,0,1]=3 4167 B8R0.8 CPOCC(N)C(O)=O Amb24423934 [0,2,0,0,0,0|0,0,0]=2 4168 B8R0.8 CSCCC(Br)C(O)=O Amb24682715 [0,2,0,0,0,0|1,1,0]=4 4169 B8R0.8 CSCCC(C(=O)Cl)N Amb17142908 [0,2,0,0,0,0|1,1,0]=4 4170 B8R0.8 CSCCC(C(=O)N)N Amb17142872 [0,2,0,0,0,0|1,1,0]=4 4171 B8R0.8 CSCCC(C(=O)O)N Amb1154122 [0,2,0,0,0,0|0,1,0]=3 4172 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [0,2,0,0,0,0|1,1,0]=4 4173 B8R0.8 CSCCC(N)C(=O)S Amb24407336 [0,2,0,0,0,0|0,2,0]=4 4174 B8R0.8 CSCCC(N)C(O)=O Amb22168296 [0,2,0,0,0,0|0,1,0]=3 4175 B8R0.8 CSCCC(N)C(O)=O Amb22732346 [0,2,0,0,0,0|0,1,0]=3 4176 B8R0.8 CSCCC(N)P(O)=O Amb25362071 [0,2,0,0,0,0|1,1,0]=4 4177 B8R0.8 CSCCC(N)[13C](O)=O Amb22336208 [0,2,0,0,0,0|0,1,0]=3 4178 B8R0.8 CSCCC(O)C(O)=O Amb18304609 [0,2,0,0,0,0|1,1,0]=4 4179 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,2,0,0,0,0|1,1,0]=4 4180 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,2,0,0,0,0|1,1,0]=4 4181 B8R0.8 CSCC[C@@H](O)C(O)=O Amb25124092 [0,2,0,0,0,0|1,1,0]=4 4182 B8R0.8 CSCC[C@@H](S)C(O)=O Amb24340077 [0,2,0,0,0,0|1,1,0]=4 4183 B8R0.8 CSCC[C@H](Br)C(O)=O Amb25239326 [0,2,0,0,0,0|1,1,0]=4 4184 B8R0.8 CSCC[C@H](N)C(O)=O Amb17942996 [0,2,0,0,0,0|0,1,0]=3 4185 B8R0.8 CSCC[C@H](N)C(O)=O Amb22351191 [0,2,0,0,0,0|0,1,0]=3 4186 B8R0.8 CSCC[C@H](N)P(O)=O Amb25826489 [0,2,0,0,0,0|1,1,0]=4 4187 B8R0.8 CSCC[C@H]([15NH2])C(O)=O Amb22353588 [0,2,0,0,0,0|0,1,0]=3 4188 B8R0.8 CSOC[C@H](N)C(O)=O Amb24428229 [0,2,0,0,0,0|0,0,0]=2 4189 B8R0.8 CS[13CH2][13CH2][13CH]([13C](=O)O)O Amb17615592 [0,2,0,0,0,0|1,1,0]=4 4190 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [0,2,0,0,0,0|2,0,0]=4 4191 B8R0.8 C[C@@H](NCC#N)C(O)=O Amb24481672 [0,2,0,0,0,0|2,0,0]=4 4192 B8R0.8 C[C@@H](NCC=C)C(O)=O Amb24481671 [0,2,0,0,0,0|2,0,0]=4 4193 B8R0.8 C[C@@H](OCC#N)C(O)=O Amb25050099 [0,2,0,0,0,0|2,0,0]=4 4194 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [0,2,0,0,0,0|1,1,0]=4 4195 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [0,2,0,0,0,0|2,0,0]=4 4196 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [0,2,0,0,0,0|2,0,0]=4 4197 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [0,2,0,0,0,0|2,0,0]=4 4198 B8R0.8 C[C@H](CN=[N+]=[N-])C(O)=O Amb24399279 [0,2,0,0,0,0|2,0,0]=4 4199 B8R0.8 C[C@H](NCC#C)C(O)=O Amb25697652 [0,2,0,0,0,0|2,0,0]=4 4200 B8R0.8 C[C@H](OCC#C)C(O)=O Amb25852095 [0,2,0,0,0,0|2,0,0]=4 4201 B8R0.8 C[Se]CCC(N)C(O)=O Amb20619393 [0,2,0,0,0,0|0,1,0]=3 4202 B8R0.8 C[Se]CC[C@H](C(=O)O)N Amb10601590 [0,2,0,0,0,0|0,1,0]=3 4203 B8R0.8 C\C=C/C[C@H](N)C(O)=O Amb24713154 [0,2,0,0,0,0|1,0,0]=3 4204 B8R0.8 C\C=C\CC(C)C(O)=O Amb18642630 [0,2,0,0,0,0|2,0,0]=4 4205 B8R0.8 C\C=C\CC(O)C(O)=O Amb18642742 [0,2,0,0,0,0|2,0,0]=4 4206 B8R0.8 C\C=C\C[C@@H](N)C(O)=O Amb24632390 [0,2,0,0,0,0|1,0,0]=3 4207 B8R0.8 N=C(NCCO)C(O)=O Amb18124348 [0,2,0,0,0,0|0,0,2]=4 4208 B8R0.8 NC(=O)C(O)CCCO Amb25104583 [0,2,0,0,0,0|2,0,0]=4 4209 B8R0.8 NC(=O)[C@@H](O)CCCO Amb25804971 [0,2,0,0,0,0|2,0,0]=4 4210 B8R0.8 NC(C#CCO)C(O)=O Amb24585112 [0,2,0,0,0,0|0,0,0]=2 4211 B8R0.8 NC(C(=O)O)CCON Amb17593409 [0,2,0,0,0,0|0,0,0]=2 4212 B8R0.8 NC(C(=O)O)CSC#N Amb17593655 [0,2,0,0,0,0|0,1,0]=3 4213 B8R0.8 NC(CCC#N)C(O)=O Amb18642589 [0,2,0,0,0,0|1,0,0]=3 4214 B8R0.8 NC(CCC=O)C(O)=O Amb24340141 [0,2,0,0,0,0|0,0,1]=3 4215 B8R0.8 NC(CCCBr)C(O)=O Amb24480263 [0,2,0,0,0,0|1,0,0]=3 4216 B8R0.8 NC(CCCBr)P(O)=O Amb24377501 [0,2,0,0,0,0|2,0,0]=4 4217 B8R0.8 NC(CCCCl)C(O)=O Amb24472387 [0,2,0,0,0,0|1,0,0]=3 4218 B8R0.8 NC(CCCF)C(O)=O Amb25366994 [0,2,0,0,0,0|1,0,0]=3 4219 B8R0.8 NC(CCCO)C(O)=O Amb18642915 [0,2,0,0,0,0|0,0,0]=2 4220 B8R0.8 NC(CCCO)C(O)=O Amb22900028 [0,2,0,0,0,0|0,0,0]=2 4221 B8R0.8 NC(CCCO)P(O)=O Amb25726221 [0,2,0,0,0,0|1,0,0]=3 4222 B8R0.8 NC(CN=C=O)C(O)=O Amb24423805 [0,2,0,0,0,0|0,0,1]=3 4223 B8R0.8 NC(COCO)C(O)=O Amb24731952 [0,2,0,0,0,0|0,0,0]=2 4224 B8R0.8 NC(CSC=O)C(O)=O Amb24670042 [0,2,0,0,0,0|0,0,1]=3 4225 B8R0.8 NC(\C=C\CO)C(O)=O Amb24586215 [0,2,0,0,0,0|0,0,0]=2 4226 B8R0.8 NC(\C=C\CP)C(O)=O Amb24351617 [0,2,0,0,0,0|1,0,0]=3 4227 B8R0.8 NCCCC(C(=O)O)Br Amb17595166 [0,2,0,0,0,0|2,0,0]=4 4228 B8R0.8 NCCCC(Cl)C(O)=O Amb24626933 [0,2,0,0,0,0|2,0,0]=4 4229 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,2,0,0,0,0|2,0,0]=4 4230 B8R0.8 NCCCC(N)C(O)=O Amb22489477 [0,2,0,0,0,0|1,0,0]=3 4231 B8R0.8 NCCCC(N)C(O)=O Amb22492665 [0,2,0,0,0,0|1,0,0]=3 4232 B8R0.8 NCCCC(O)C(O)=O Amb18124377 [0,2,0,0,0,0|2,0,0]=4 4233 B8R0.8 NCCC[C@@H](N)C(O)=O Amb22801212 [0,2,0,0,0,0|1,0,0]=3 4234 B8R0.8 NCCC[C@@H](O)C(O)=O Amb24459740 [0,2,0,0,0,0|2,0,0]=4 4235 B8R0.8 NCCC[C@@H]([NH3+])C(=O)O Amb10807472 [0,2,0,0,0,0|1,0,1]=4 4236 B8R0.8 NCCC[C@H](N)C(N)=O Amb24658293 [0,2,0,0,0,0|2,0,0]=4 4237 B8R0.8 NCCC[C@H](N)C(O)=O Amb20240598 [0,2,0,0,0,0|1,0,0]=3 4238 B8R0.8 NCCSC(F)C(O)=O Amb24478685 [0,2,0,0,0,0|2,0,0]=4 4239 B8R0.8 NC\C=C\C(N)C(O)=O Amb18642793 [0,2,0,0,0,0|1,0,0]=3 4240 B8R0.8 NC\C=C\[C@H](N)C(O)=O Amb24580033 [0,2,0,0,0,0|1,0,0]=3 4241 B8R0.8 NOCCC(N)C(O)=O Amb21858490 [0,2,0,0,0,0|0,0,0]=2 4242 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22745427 [0,2,0,0,0,0|0,0,0]=2 4243 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22751695 [0,2,0,0,0,0|0,0,0]=2 4244 B8R0.8 N[C@@H](CCC=O)C(O)=O Amb25378080 [0,2,0,0,0,0|0,0,1]=3 4245 B8R0.8 N[C@@H](CCCN)C(O)=O Amb22746434 [0,2,0,0,0,0|1,0,0]=3 4246 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24117852 [0,2,0,0,0,0|0,0,0]=2 4247 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24666196 [0,2,0,0,0,0|0,0,0]=2 4248 B8R0.8 N[C@@H](CN=C=S)C(O)=O Amb24473247 [0,2,0,0,0,0|0,1,0]=3 4249 B8R0.8 N[C@@H](CNC#N)C(O)=O Amb24551015 [0,2,0,0,0,0|1,0,0]=3 4250 B8R0.8 N[C@@H](C\C=C\Cl)C(O)=O Amb25774032 [0,2,0,0,0,0|1,0,0]=3 4251 B8R0.8 N[C@H](C(=O)O)CCC#N Amb16183912 [0,2,0,0,0,0|1,0,0]=3 4252 B8R0.8 N[C@H](CCC#N)C(O)=O Amb25063958 [0,2,0,0,0,0|1,0,0]=3 4253 B8R0.8 N[C@H](CCC=O)C(O)=O Amb24477812 [0,2,0,0,0,0|0,0,1]=3 4254 B8R0.8 N[C@H](C\C=C\Cl)C(O)=O Amb25114338 [0,2,0,0,0,0|1,0,0]=3 4255 B8R0.8 OC(=O)C(=O)NCCO Amb24117944 [0,2,0,0,0,0|1,0,1]=4 4256 B8R0.8 OC(=O)C(Br)CCCBr Amb22001929 [0,2,0,0,0,0|2,0,0]=4 4257 B8R0.8 OC(=O)C(CCCCl)Br Amb17595866 [0,2,0,0,0,0|2,0,0]=4 4258 B8R0.8 OC(=O)C(F)CCCCl Amb24683810 [0,2,0,0,0,0|2,0,0]=4 4259 B8R0.8 OC(CNC=O)C(O)=O Amb25126146 [0,2,0,0,0,0|1,0,1]=4 4260 B8R0.8 OCCCC(Cl)C(O)=O Amb25760339 [0,2,0,0,0,0|1,0,0]=3 4261 B8R0.8 OCCCC(O)C(O)=O Amb18642939 [0,2,0,0,0,0|1,0,0]=3 4262 B8R0.8 OCCC[C@@H](C(=O)O)N Amb16183887 [0,2,0,0,0,0|0,0,0]=2 4263 B8R0.8 OCCC[C@H](O)C(O)=O Amb24744314 [0,2,0,0,0,0|1,0,0]=3 4264 B8R0.8 O[C@@H](CNC=O)C(O)=O Amb24453193 [0,2,0,0,0,0|1,0,1]=4 4265 B8R0.8 [13CH3]SCCC(N)C(O)=O Amb22351494 [0,2,0,0,0,0|0,1,0]=3 4266 B8R0.8 [13CH3][Se]CCC(N)C(O)=O Amb22367237 [0,2,0,0,0,0|0,1,0]=3 4267 B8R0.8 [N-]=[N+]=NC[C@H](N)C(O)=O Amb25072668 [0,2,0,0,0,0|1,0,0]=3 4268 B8R0.12 C=CCC(C(=O)O)(C)C Amb10603495 [0,2,0,0,0,0|2,0,0]=4 4269 B8R0.12 C=CCC(C(=O)O)(F)F Amb10982503 [0,2,0,0,0,0|2,0,0]=4 4270 B8R0.12 C=CCC(Cl)(Cl)C(O)=O Amb24479939 [0,2,0,0,0,0|2,0,0]=4 4271 B8R0.12 C=CCC(F)(Cl)C(O)=O Amb24373901 [0,2,0,0,0,0|2,0,0]=4 4272 B8R0.12 CC(=O)C(C)(O)CCO Amb25710178 [0,2,0,0,0,0|2,0,0]=4 4273 B8R0.12 CC(C(=O)O)(CCC)Cl Amb17593751 [0,2,0,0,0,0|2,0,0]=4 4274 B8R0.12 CC(C)(CC#C)C(O)=O Amb18636154 [0,2,0,0,0,0|2,0,0]=4 4275 B8R0.12 CC(C)(CC=O)C(O)=O Amb24340256 [0,2,0,0,0,0|1,0,1]=4 4276 B8R0.12 CC(C)(CCBr)C(O)=O Amb24739595 [0,2,0,0,0,0|2,0,0]=4 4277 B8R0.12 CC(C)(CCO)C(O)=O Amb24763728 [0,2,0,0,0,0|1,0,0]=3 4278 B8R0.12 CC(C)(CNO)C(O)=O Amb25204097 [0,2,0,0,0,0|1,0,0]=3 4279 B8R0.12 CC(C)(CON)C(O)=O Amb25188999 [0,2,0,0,0,0|1,0,0]=3 4280 B8R0.12 CC(N)(C=C=O)C(O)=O Amb25245392 [0,2,0,0,0,0|0,0,2]=4 4281 B8R0.12 CC(N)(CC=C)C(N)=O Amb24382677 [0,2,0,0,0,0|2,0,0]=4 4282 B8R0.12 CC(N)(CC=C)C(O)=O Amb22733281 [0,2,0,0,0,0|1,0,0]=3 4283 B8R0.12 CC(N)(CC=C)C(O)=O Amb22898994 [0,2,0,0,0,0|1,0,0]=3 4284 B8R0.12 CC(N)(CCN)C(O)=O Amb24060975 [0,2,0,0,0,0|1,0,0]=3 4285 B8R0.12 CC(N)(CCO)C(O)=O Amb24340273 [0,2,0,0,0,0|0,0,0]=2 4286 B8R0.12 CC(N)(\C=C\I)C(O)=O Amb25234592 [0,2,0,0,0,0|1,0,1]=4 4287 B8R0.12 CC(O)(CC#C)C(O)=O Amb24680889 [0,2,0,0,0,0|2,0,0]=4 4288 B8R0.12 CC(O)(CC=C)C(O)=O Amb25077172 [0,2,0,0,0,0|2,0,0]=4 4289 B8R0.12 CC(O)(CCO)C(O)=O Amb25250520 [0,2,0,0,0,0|1,0,0]=3 4290 B8R0.12 CC(O)(CNO)C(O)=O Amb25032323 [0,2,0,0,0,0|1,0,0]=3 4291 B8R0.12 CC(O)(CON)C(O)=O Amb25853079 [0,2,0,0,0,0|1,0,0]=3 4292 B8R0.12 CCCC(C)(Br)C(O)=O Amb25772819 [0,2,0,0,0,0|2,0,0]=4 4293 B8R0.12 CCCC(C)(N)C(C)=O Amb25340167 [0,2,0,0,0,0|2,0,0]=4 4294 B8R0.12 CCCC(C)(N)C(N)=O Amb18288983 [0,2,0,0,0,0|2,0,0]=4 4295 B8R0.12 CCCC(C)(O)C(O)=O Amb18288835 [0,2,0,0,0,0|2,0,0]=4 4296 B8R0.12 CCCC(F)(F)C(O)=O Amb19929277 [0,2,0,0,0,0|2,0,0]=4 4297 B8R0.12 CCC[C@](C)(F)C(O)=O Amb24579970 [0,2,0,0,0,0|2,0,0]=4 4298 B8R0.12 CCC[C@](C)(O)C(O)=O Amb25114242 [0,2,0,0,0,0|2,0,0]=4 4299 B8R0.12 CCNC(C(=O)O)(C)C Amb13952777 [0,2,0,0,0,0|2,0,0]=4 4300 B8R0.12 CCOC(C)(C)C(O)=O Amb18976723 [0,2,0,0,0,0|2,0,0]=4 4301 B8R0.12 CCSC(C(=O)O)(C)C Amb17501487 [0,2,0,0,0,0|2,0,0]=4 4302 B8R0.12 CNCC(C)(N)C(O)=O Amb24061057 [0,2,0,0,0,0|1,0,0]=3 4303 B8R0.12 CNCC(F)(F)C(O)=O Amb22497225 [0,2,0,0,0,0|2,0,0]=4 4304 B8R0.12 CNCC(F)(F)C(O)=O Amb22523480 [0,2,0,0,0,0|2,0,0]=4 4305 B8R0.12 COCC(C(=O)O)(C)C Amb10608195 [0,2,0,0,0,0|1,0,0]=3 4306 B8R0.12 COCC(C)(Cl)C(C)=O Amb25833577 [0,2,0,0,0,0|2,0,0]=4 4307 B8R0.12 COCC(C)(Cl)C(O)=O Amb24692925 [0,2,0,0,0,0|1,0,0]=3 4308 B8R0.12 COCC(C)(N)C(C)=O Amb24376983 [0,2,0,0,0,0|1,0,0]=3 4309 B8R0.12 COCC(C)(N)C(N)=O Amb18298766 [0,2,0,0,0,0|1,0,0]=3 4310 B8R0.12 COCC(C)(N)C(N)=O Amb19515079 [0,2,0,0,0,0|1,0,0]=3 4311 B8R0.12 COCC(C)(N)C(O)=O Amb18990135 [0,2,0,0,0,0|0,0,0]=2 4312 B8R0.12 COCC(C)(N)C(O)=O Amb20622455 [0,2,0,0,0,0|0,0,0]=2 4313 B8R0.12 COCC(C)(O)C(O)=O Amb18992608 [0,2,0,0,0,0|1,0,0]=3 4314 B8R0.12 COCC(F)(F)C(O)=O Amb24518571 [0,2,0,0,0,0|1,0,0]=3 4315 B8R0.12 COC[C@](C)(N)C(O)=O Amb24568285 [0,2,0,0,0,0|0,0,0]=2 4316 B8R0.12 CSCC(C)(C)C(O)=O Amb18124874 [0,2,0,0,0,0|1,1,0]=4 4317 B8R0.12 CSCC(C)(N)C(N)=O Amb18294540 [0,2,0,0,0,0|1,1,0]=4 4318 B8R0.12 CSCC(C)(N)C(O)=O Amb18294541 [0,2,0,0,0,0|0,1,0]=3 4319 B8R0.12 CSCC(C)(O)C(O)=O Amb18644426 [0,2,0,0,0,0|1,1,0]=4 4320 B8R0.12 CSCC(F)(F)C(O)=O Amb23590987 [0,2,0,0,0,0|1,1,0]=4 4321 B8R0.12 C[C@@](C(=O)O)(CC#C)N Amb16183909 [0,2,0,0,0,0|1,0,0]=3 4322 B8R0.12 C[C@@](C(=O)O)(CCC)N Amb16232632 [0,2,0,0,0,0|1,0,0]=3 4323 B8R0.12 C[C@@](F)(CC=C)C(O)=O Amb25032094 [0,2,0,0,0,0|2,0,0]=4 4324 B8R0.12 C[C@@](N)(CC=C)C(O)=O Amb23402145 [0,2,0,0,0,0|1,0,0]=3 4325 B8R0.12 C[C@@](N)(CCF)C(O)=O Amb25146094 [0,2,0,0,0,0|1,0,0]=3 4326 B8R0.12 C[C@](C(=O)O)(CC#C)N Amb16183908 [0,2,0,0,0,0|1,0,0]=3 4327 B8R0.12 C[C@](F)(CC=C)C(O)=O Amb25251491 [0,2,0,0,0,0|2,0,0]=4 4328 B8R0.12 C[C@](N)(CC#N)C(O)=O Amb25078617 [0,2,0,0,0,0|1,0,0]=3 4329 B8R0.12 C[C@](N)(CC=C)C(N)=O Amb24385115 [0,2,0,0,0,0|2,0,0]=4 4330 B8R0.12 C[C@](N)(CCF)C(O)=O Amb24383347 [0,2,0,0,0,0|1,0,0]=3 4331 B8R0.12 C[C@](N)(CCN)C(O)=O Amb25348479 [0,2,0,0,0,0|1,0,0]=3 4332 B8R0.12 C[C@](N)(CCO)C(O)=O Amb24720458 [0,2,0,0,0,0|0,0,0]=2 4333 B8R0.12 C\C=C\C(C)(N)C(O)=O Amb24671255 [0,2,0,0,0,0|1,0,1]=4 4334 B8R0.12 N#CCC(C(=O)O)(C)C Amb17334096 [0,2,0,0,0,0|2,0,0]=4 4335 B8R0.12 OCCC(Cl)(Cl)C(O)=O Amb24692691 [0,2,0,0,0,0|1,0,0]=3 4336 B8R0.14 C#CCC(N)P(O)(O)=O Amb25731687 [0,2,0,0,0,0|2,0,0]=4 4337 B8R0.14 C=CCC(N)P(O)(O)=O Amb24480031 [0,2,0,0,0,0|2,0,0]=4 4338 B8R0.14 CC(C)(O)C(N)CCO Amb24402148 [0,2,0,0,0,0|1,0,1]=4 4339 B8R0.14 CCC[C@@H](N)P(O)(O)=O Amb25097147 [0,2,0,0,0,0|2,0,0]=4 4340 B8R0.14 CNCC(N)P(O)(O)=O Amb25829146 [0,2,0,0,0,0|2,0,0]=4 4341 B8R0.14 CNC[C@@H](N)P(O)(O)=O Amb25118760 [0,2,0,0,0,0|2,0,0]=4 4342 B8R0.14 COCC(N)P(O)(O)=O Amb25682729 [0,2,0,0,0,0|1,0,0]=3 4343 B8R0.14 CSCC(N)S(O)(=O)=O Amb25111012 [0,2,0,0,0,0|1,1,0]=4 4344 B8R0.14 NC(CCS)P(O)(O)=O Amb25088296 [0,2,0,0,0,0|1,1,0]=4 4345 B8R0.14 N[C@H](CCO)P(O)(O)=O Amb24443042 [0,2,0,0,0,0|1,0,0]=3 4346 B8R0.14 OCCC(Cl)P(O)(O)=O Amb24528737 [0,2,0,0,0,0|2,0,0]=4 4347 B8R0.15 C=CC(CC#N)C(O)=O Amb25047315 [0,2,0,0,0,0|2,0,0]=4 4348 B8R0.15 C=CCC(CO)C(O)=O Amb24763754 [0,2,0,0,0,0|1,0,0]=3 4349 B8R0.15 C=CC[C@@H](NO)C(O)=O Amb25328715 [0,2,0,0,0,0|1,0,0]=3 4350 B8R0.15 C=CC[C@H](CN)C(O)=O Amb24679707 [0,2,0,0,0,0|1,0,0]=3 4351 B8R0.15 CC#CC(CC)C(O)=O Amb25119285 [0,2,0,0,0,0|2,0,0]=4 4352 B8R0.15 CC(O)C(CO)NCC Amb24644555 [0,2,0,0,0,0|1,0,1]=4 4353 B8R0.15 CC=NC(CO)C(O)=O Amb24740970 [0,2,0,0,0,0|0,0,1]=3 4354 B8R0.15 CCC(=CCN)C(O)=O Amb24393918 [0,2,0,0,0,0|1,0,1]=4 4355 B8R0.15 CCC(=CCO)C(O)=O Amb24478695 [0,2,0,0,0,0|1,0,1]=4 4356 B8R0.15 CCC(CC#C)C(O)=O Amb18115864 [0,2,0,0,0,0|2,0,0]=4 4357 B8R0.15 CCC(CC#N)C(O)=O Amb25760267 [0,2,0,0,0,0|1,0,1]=4 4358 B8R0.15 CCC(CC=C)C(O)=O Amb18642632 [0,2,0,0,0,0|2,0,0]=4 4359 B8R0.15 CCC(CCC)C(O)=O Amb19009626 [0,2,0,0,0,0|2,0,0]=4 4360 B8R0.15 CCC(CCN)C(O)=O Amb24699884 [0,2,0,0,0,0|1,0,0]=3 4361 B8R0.15 CCC(CCN)P(O)=O Amb24478799 [0,2,0,0,0,0|2,0,0]=4 4362 B8R0.15 CCC(CCO)C(O)=O Amb18642884 [0,2,0,0,0,0|1,0,0]=3 4363 B8R0.15 CCC(COC)C(O)=O Amb18124352 [0,2,0,0,0,0|1,0,0]=3 4364 B8R0.15 CCC(N=[N+]=[N-])C(O)=O Amb18632940 [0,2,0,0,0,0|1,0,1]=4 4365 B8R0.15 CCC(NC#N)C(N)=O Amb25751160 [0,2,0,0,0,0|2,0,0]=4 4366 B8R0.15 CCC(NC=O)C(N)=O Amb25768069 [0,2,0,0,0,0|2,0,0]=4 4367 B8R0.15 CCC(NCC)C(N)=O Amb19006590 [0,2,0,0,0,0|2,0,0]=4 4368 B8R0.15 CCC(NN=O)C(O)=O Amb25219995 [0,2,0,0,0,0|1,0,0]=3 4369 B8R0.15 CCC(NOC)C(N)=O Amb25138520 [0,2,0,0,0,0|2,0,0]=4 4370 B8R0.15 CCCC(C#C)C(O)=O Amb25280471 [0,2,0,0,0,0|2,0,0]=4 4371 B8R0.15 CCCC(CN)C(C)=O Amb25756244 [0,2,0,0,0,0|2,0,0]=4 4372 B8R0.15 CCCC(CN)C(O)=O Amb19373497 [0,2,0,0,0,0|1,0,0]=3 4373 B8R0.15 CCCC(NBr)C(O)=O Amb24634034 [0,2,0,0,0,0|1,0,0]=3 4374 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,2,0,0,0,0|2,0,0]=4 4375 B8R0.15 CCCC(NC)C(O)=O Amb21961534 [0,2,0,0,0,0|1,0,0]=3 4376 B8R0.15 CCCC(NC)C(O)=O Amb22587444 [0,2,0,0,0,0|1,0,0]=3 4377 B8R0.15 CCCC(NCl)C(O)=O Amb25032132 [0,2,0,0,0,0|1,0,0]=3 4378 B8R0.15 CCCC(NO)C(O)=O Amb22372057 [0,2,0,0,0,0|1,0,0]=3 4379 B8R0.15 CCC[C@@H](CO)C(O)=O Amb24571859 [0,2,0,0,0,0|1,0,0]=3 4380 B8R0.15 CCC[C@@H](NC)C(O)=O Amb25771939 [0,2,0,0,0,0|1,0,0]=3 4381 B8R0.15 CCC[C@H](CO)C(O)=O Amb25063310 [0,2,0,0,0,0|1,0,0]=3 4382 B8R0.15 CCC[C@H](NC)C(O)=O Amb25062610 [0,2,0,0,0,0|1,0,0]=3 4383 B8R0.15 CCC[C@H](NO)C(O)=O Amb25744829 [0,2,0,0,0,0|1,0,0]=3 4384 B8R0.15 CCNC(C=C)C(O)=O Amb25346510 [0,2,0,0,0,0|1,0,1]=4 4385 B8R0.15 CCNC(CN)C(O)=O Amb25825729 [0,2,0,0,0,0|1,0,0]=3 4386 B8R0.15 CCNC(CO)C(N)=O Amb25075770 [0,2,0,0,0,0|1,0,0]=3 4387 B8R0.15 CCNC(CO)C(O)=O Amb24477808 [0,2,0,0,0,0|0,0,0]=2 4388 B8R0.15 CCNC(CS)C(O)=O Amb25694444 [0,2,0,0,0,0|0,1,0]=3 4389 B8R0.15 CCN[C@@H](CO)C(O)=O Amb24477673 [0,2,0,0,0,0|0,0,0]=2 4390 B8R0.15 CCN[C@@H](CS)C(O)=O Amb25801938 [0,2,0,0,0,0|0,1,0]=3 4391 B8R0.15 CCN[C@H](CO)C(O)=O Amb25328424 [0,2,0,0,0,0|0,0,0]=2 4392 B8R0.15 CCN[C@H](CS)C(O)=O Amb24692505 [0,2,0,0,0,0|0,1,0]=3 4393 B8R0.15 CCOC(C=C)C(O)=O Amb18642775 [0,2,0,0,0,0|2,0,0]=4 4394 B8R0.15 CCOC(CO)C(O)=O Amb18316294 [0,2,0,0,0,0|1,0,0]=3 4395 B8R0.15 CCOC(CS)C(O)=O Amb19037339 [0,2,0,0,0,0|1,1,0]=4 4396 B8R0.15 CCSC(CCl)C(O)=O Amb25837308 [0,2,0,0,0,0|2,0,0]=4 4397 B8R0.15 CCSC(CN)C(N)=O Amb25801244 [0,2,0,0,0,0|2,0,0]=4 4398 B8R0.15 CCSC(CN)C(O)=O Amb25808987 [0,2,0,0,0,0|1,0,0]=3 4399 B8R0.15 CCSC(CO)C(O)=O Amb25803319 [0,2,0,0,0,0|1,0,0]=3 4400 B8R0.15 CC[C@@H](CCC)C(O)=O Amb24529114 [0,2,0,0,0,0|2,0,0]=4 4401 B8R0.15 CC[C@@H](NC=O)C(N)=O Amb25750944 [0,2,0,0,0,0|2,0,0]=4 4402 B8R0.15 CC[C@@H](NC=O)C(O)=O Amb24700206 [0,2,0,0,0,0|1,0,0]=3 4403 B8R0.15 CC[C@H](CC#N)C(O)=O Amb24358365 [0,2,0,0,0,0|1,0,1]=4 4404 B8R0.15 CC[C@H](CC=C)C(O)=O Amb25145662 [0,2,0,0,0,0|2,0,0]=4 4405 B8R0.15 CC[C@H](CCC)C(O)=O Amb24376457 [0,2,0,0,0,0|2,0,0]=4 4406 B8R0.15 CC[C@H](N=[N+]=[N-])C(O)=O Amb25378654 [0,2,0,0,0,0|1,0,1]=4 4407 B8R0.15 CNC(CNC)C(O)=O Amb25066748 [0,2,0,0,0,0|1,0,0]=3 4408 B8R0.15 CNC(COC)C(C)=C Amb25368000 [0,2,0,0,0,0|2,0,0]=4 4409 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,2,0,0,0,0|1,0,0]=3 4410 B8R0.15 CNC(COC)C(O)=O Amb19304133 [0,2,0,0,0,0|0,0,0]=2 4411 B8R0.15 CNC(COC)C(O)=O Amb22059040 [0,2,0,0,0,0|0,0,0]=2 4412 B8R0.15 CNCC(C#N)C(O)=O Amb25756304 [0,2,0,0,0,0|1,0,1]=4 4413 B8R0.15 CNCC(OC)C(O)=O Amb25744334 [0,2,0,0,0,0|2,0,0]=4 4414 B8R0.15 CN[C@@H](CCS)C(O)=O Amb24533728 [0,2,0,0,0,0|0,1,0]=3 4415 B8R0.15 CN[C@@H](CNC)C(O)=O Amb24361748 [0,2,0,0,0,0|1,0,0]=3 4416 B8R0.15 CN[C@@H](COC)C(O)=O Amb25075397 [0,2,0,0,0,0|0,0,0]=2 4417 B8R0.15 CN[C@@H](CSC)C(O)=O Amb24377120 [0,2,0,0,0,0|0,1,0]=3 4418 B8R0.15 COC(CC=C)C(O)=O Amb24428233 [0,2,0,0,0,0|2,0,0]=4 4419 B8R0.15 COC(CCO)C([O-])=O Amb24362009 [0,2,0,0,0,0|1,0,1]=4 4420 B8R0.15 COC(CSC)C(O)=O Amb25309562 [0,2,0,0,0,0|1,1,0]=4 4421 B8R0.15 COC(OCC)C(O)=O Amb25367206 [0,2,0,0,0,0|2,0,0]=4 4422 B8R0.15 COCC(C#N)C(O)=O Amb24382899 [0,2,0,0,0,0|0,0,1]=3 4423 B8R0.15 COCC(C=O)C(O)=O Amb24640433 [0,2,0,0,0,0|1,0,0]=3 4424 B8R0.15 COCC(CN)S(C)=O Amb24696132 [0,2,0,0,0,0|2,0,0]=4 4425 B8R0.15 COCC(NN)C(C)=C Amb24623319 [0,2,0,0,0,0|2,0,0]=4 4426 B8R0.15 COC[C@H](NO)C(O)=O Amb24671375 [0,2,0,0,0,0|0,0,0]=2 4427 B8R0.15 CONC(C=C)C(O)=O Amb25705766 [0,2,0,0,0,0|1,0,1]=4 4428 B8R0.15 CONC(CN)C(O)=O Amb25688022 [0,2,0,0,0,0|1,0,0]=3 4429 B8R0.15 CONC(CO)C(C)=C Amb24747756 [0,2,0,0,0,0|2,0,0]=4 4430 B8R0.15 CO[C@@H](CCN)C(O)=O Amb25146111 [0,2,0,0,0,0|2,0,0]=4 4431 B8R0.15 CO[C@@H](CCO)C([O-])=O Amb24421624 [0,2,0,0,0,0|1,0,1]=4 4432 B8R0.15 CO[C@H](COC)C(N)=O Amb25338210 [0,2,0,0,0,0|2,0,0]=4 4433 B8R0.15 CO[C@H](COC)C(O)=O Amb25122791 [0,2,0,0,0,0|1,0,0]=3 4434 B8R0.15 CSC(CC=C)C(O)=O Amb18644287 [0,2,0,0,0,0|2,0,0]=4 4435 B8R0.15 CSC(CSC)C(O)=O Amb24595007 [0,2,0,0,0,0|1,1,0]=4 4436 B8R0.15 CSC(NC=O)C(O)=O Amb24654838 [0,2,0,0,0,0|2,0,0]=4 4437 B8R0.15 C[C@@H](O)[C@@H](CCO)NC Amb24459756 [0,2,0,0,0,0|1,0,1]=4 4438 B8R0.15 C[C@@H](O)[C@@H](CO)NC#N Amb24626158 [0,2,0,0,0,0|1,0,1]=4 4439 B8R0.15 C[C@@H](O)[C@@H](CO)NC=O Amb24528718 [0,2,0,0,0,0|1,0,1]=4 4440 B8R0.15 C\C=C(/CCO)\C(O)=O Amb18642783 [0,2,0,0,0,0|1,0,1]=4 4441 B8R0.15 C\C=C(\CCO)/C(O)=O Amb24568883 [0,2,0,0,0,0|1,0,1]=4 4442 B8R0.15 C\C=C\C(CC)C(O)=O Amb18642657 [0,2,0,0,0,0|2,0,0]=4 4443 B8R0.15 NCCC(=NO)C(O)=O Amb25174966 [0,2,0,0,0,0|1,0,1]=4 4444 B8R0.15 NCCC(CF)C(N)=O Amb24559123 [0,2,0,0,0,0|2,0,0]=4 4445 B8R0.15 NCCC(CF)C(O)=O Amb25174518 [0,2,0,0,0,0|1,0,0]=3 4446 B8R0.15 NC\C=C(\CCl)/C(O)=O Amb24760314 [0,2,0,0,0,0|1,0,1]=4 4447 B8R0.15 NC\C=C(\CF)/C(O)=O Amb25174859 [0,2,0,0,0,0|1,0,1]=4 4448 B8R0.15 OC(=O)C(CS)NC=O Amb20093366 [0,2,0,0,0,0|0,1,0]=3 4449 B8R0.15 OC(=O)[C@H](CS)NC=O Amb24727230 [0,2,0,0,0,0|0,1,0]=3 4450 B8R0.15 OC(=O)[C@H](CS)NN=O Amb25675857 [0,2,0,0,0,0|0,1,0]=3 4451 B8R0.15 OC(=O)\C(\CCO)=N/O Amb25104712 [0,2,0,0,0,0|0,0,2]=4 4452 B8R0.15 OCC(NC=O)C(O)=O Amb18290435 [0,2,0,0,0,0|0,0,0]=2 4453 B8R0.15 OCNC(CS)C(O)=O Amb24369164 [0,2,0,0,0,0|0,1,0]=3 4454 B8R0.15 OC[C@H](NC=O)C(O)=O Amb24362974 [0,2,0,0,0,0|0,0,0]=2 4455 B8R0.15 OSNC(CS)C(O)=O Amb25774937 [0,2,0,0,0,0|0,1,0]=3 4456 B8R0.13 CC(C)(CN)C(=O)NO Amb25829684 [0,2,0,0,0,0|2,0,0]=4 4457 B8R0.13 CC(C)(CO)C(=O)CBr Amb25295442 [0,2,0,0,0,0|2,0,0]=4 4458 B8R0.13 CC(C)(CO)C(=O)CCl Amb25368330 [0,2,0,0,0,0|2,0,0]=4 4459 B8R0.13 CC(C)(CO)C(=O)CO Amb24524650 [0,2,0,0,0,0|1,0,0]=3 4460 B8R0.13 CC(C)(CO)C(O)C=O Amb25309619 [0,2,0,0,0,0|1,0,1]=4 4461 B8R0.13 CC(C)(CO)[C@@H](O)C=O Amb25224406 [0,2,0,0,0,0|1,0,1]=4 4462 B8R0.13 CC(O)(CO)C(O)C=O Amb25759637 [0,2,0,0,0,0|1,0,1]=4 4463 B8R0.13 CCC(C)(Br)C(=O)OC Amb24643650 [0,2,0,0,0,0|2,0,0]=4 4464 B8R0.13 CCC(C)(N)C(=O)CCl Amb24697911 [0,2,0,0,0,0|2,0,0]=4 4465 B8R0.13 CCC(C)(N)C(=O)OC Amb18288973 [0,2,0,0,0,0|1,0,0]=3 4466 B8R0.13 CCC(C)(N)C(=O)OC Amb19514608 [0,2,0,0,0,0|1,0,0]=3 4467 B8R0.13 CCC(C)(N)C(N)=NO Amb25147191 [0,2,0,0,0,0|2,0,0]=4 4468 B8R0.13 CCC(C)(N)\C(\C)=N/O Amb24634727 [0,2,0,0,0,0|2,0,0]=4 4469 B8R0.13 CCC(C)(N)\C(\C)=N\O Amb25145995 [0,2,0,0,0,0|2,0,0]=4 4470 B8R0.13 CCC(C)(O)C(=O)OC Amb24116777 [0,2,0,0,0,0|2,0,0]=4 4471 B8R0.13 CCC(F)(F)C(=O)OC Amb25682454 [0,2,0,0,0,0|2,0,0]=4 4472 B8R0.13 CC[C@](C)(N)C(=O)OC Amb19888376 [0,2,0,0,0,0|1,0,0]=3 4473 B8R0.13 COC(=O)C(C)(Br)CCl Amb24459877 [0,2,0,0,0,0|2,0,0]=4 4474 B8R0.13 COC(=O)C(C)(C)CCl Amb18090829 [0,2,0,0,0,0|2,0,0]=4 4475 B8R0.13 COC(=O)C(C)(C)CI Amb22232804 [0,2,0,0,0,0|2,0,0]=4 4476 B8R0.13 COC(=O)C(C)(C)CN Amb18993084 [0,2,0,0,0,0|2,0,0]=4 4477 B8R0.13 COC(=O)C(C)(C)NO Amb24417546 [0,2,0,0,0,0|2,0,0]=4 4478 B8R0.13 COC(=O)C(C)(F)CBr Amb19149270 [0,2,0,0,0,0|2,0,0]=4 4479 B8R0.13 COC(=O)C(C)(F)CO Amb25125462 [0,2,0,0,0,0|1,0,0]=3 4480 B8R0.13 COC(=O)C(C)(N)C#C Amb25258840 [0,2,0,0,0,0|1,0,1]=4 4481 B8R0.13 COC(=O)C(C)(N)CF Amb24628794 [0,2,0,0,0,0|1,0,0]=3 4482 B8R0.13 COC(=O)C(C)(N)CN Amb24060923 [0,2,0,0,0,0|1,0,0]=3 4483 B8R0.13 COC(=O)C(C)(N)CO Amb18642913 [0,2,0,0,0,0|0,0,0]=2 4484 B8R0.13 COC(=O)C(C)(O)CBr Amb24563843 [0,2,0,0,0,0|2,0,0]=4 4485 B8R0.13 COC(=O)C(C)(O)CCl Amb19373528 [0,2,0,0,0,0|2,0,0]=4 4486 B8R0.13 COC(=O)C(C)(O)CO Amb25032259 [0,2,0,0,0,0|1,0,0]=3 4487 B8R0.13 COC(=O)C(C)(S)CCl Amb25265379 [0,2,0,0,0,0|2,0,0]=4 4488 B8R0.13 COC(=O)C(Cl)(Br)CCl Amb24066639 [0,2,0,0,0,0|2,0,0]=4 4489 B8R0.13 COC(=O)C(Cl)(Cl)CCl Amb25109142 [0,2,0,0,0,0|2,0,0]=4 4490 B8R0.13 COC(=O)C(F)(F)CBr Amb25300769 [0,2,0,0,0,0|2,0,0]=4 4491 B8R0.13 COC(=O)C(F)(F)CCl Amb25839007 [0,2,0,0,0,0|2,0,0]=4 4492 B8R0.13 COC(=O)C(F)(F)CF Amb24596188 [0,2,0,0,0,0|2,0,0]=4 4493 B8R0.13 COC(=O)C(F)(F)CO Amb25781282 [0,2,0,0,0,0|1,0,0]=3 4494 B8R0.13 COC(=O)[C@@](C)(N)CO Amb25146070 [0,2,0,0,0,0|0,0,0]=2 4495 B8R0.13 COC(=O)[C@@](C)(N)CS Amb24481990 [0,2,0,0,0,0|0,1,0]=3 4496 B8R0.13 COC(=O)[C@](C)(N)C#C Amb24681952 [0,2,0,0,0,0|1,0,1]=4 4497 B8R0.13 COC(=O)[C@](C)(N)CO Amb25260307 [0,2,0,0,0,0|0,0,0]=2 4498 B8R0.13 COC(C)(C)C(N)CO Amb24340168 [0,2,0,0,0,0|1,0,1]=4 4499 B8R0.13 COC(C)(C)[C@@H](N)CO Amb25736225 [0,2,0,0,0,0|1,0,1]=4 4500 B8R0.13 C[C@@](C(=O)OC)(CO)O Amb17613070 [0,2,0,0,0,0|1,0,0]=3 4501 B8R0.13 C[C@@](O)(C#C)[C@H](N)CO Amb24604390 [0,2,0,0,0,0|1,0,1]=4 4502 B8R0.13 C[C@@](O)(CO)[C@H](O)C=O Amb24669049 [0,2,0,0,0,0|1,0,1]=4 4503 B8R0.13 N[C@H](CO)C(F)(F)CO Amb24703200 [0,2,0,0,0,0|1,0,1]=4 4504 B8R0.13 O=C(OF)C(Cl)(Cl)CCl Amb24340173 [0,2,0,0,0,0|2,0,0]=4 4505 B8R0.20 CC(=NO)C(CN)CN Amb25187826 [0,2,0,0,0,0|2,0,0]=4 4506 B8R0.20 CC=C(CO)C(=O)OC Amb24367431 [0,2,0,0,0,0|1,0,1]=4 4507 B8R0.20 CCC(=O)C(CN)CC Amb24334019 [0,2,0,0,0,0|2,0,0]=4 4508 B8R0.20 CCC(=O)C(CO)CO Amb25233739 [0,2,0,0,0,0|2,0,0]=4 4509 B8R0.20 CCC(C(=O)OC)C#N Amb17210514 [0,2,0,0,0,0|1,0,1]=4 4510 B8R0.20 CCC(C=O)C(=O)OC Amb18642787 [0,2,0,0,0,0|2,0,0]=4 4511 B8R0.20 CCC(CCl)C(=O)OC Amb24648796 [0,2,0,0,0,0|2,0,0]=4 4512 B8R0.20 CCC(CN)C(=O)C#C Amb25329112 [0,2,0,0,0,0|2,0,0]=4 4513 B8R0.20 CCC(CN)C(=O)C=C Amb25849136 [0,2,0,0,0,0|2,0,0]=4 4514 B8R0.20 CCC(CN)C(=O)NC Amb18983425 [0,2,0,0,0,0|2,0,0]=4 4515 B8R0.20 CCC(CN)C(=O)NO Amb25203915 [0,2,0,0,0,0|1,0,0]=3 4516 B8R0.20 CCC(CN)C(=O)OC Amb24698179 [0,2,0,0,0,0|1,0,0]=3 4517 B8R0.20 CCC(CN)C(O)C=O Amb25225405 [0,2,0,0,0,0|1,0,1]=4 4518 B8R0.20 CCC(CO)C(=O)NC Amb25239242 [0,2,0,0,0,0|2,0,0]=4 4519 B8R0.20 CCC(NC)C(=O)OC Amb19516943 [0,2,0,0,0,0|1,0,0]=3 4520 B8R0.20 CCC(NC)C(=O)OC Amb21961536 [0,2,0,0,0,0|1,0,0]=3 4521 B8R0.20 CCC(SC)C(=O)OC Amb22043324 [0,2,0,0,0,0|2,0,0]=4 4522 B8R0.20 CC[C@@H](CN)C(=O)OC Amb25046723 [0,2,0,0,0,0|1,0,0]=3 4523 B8R0.20 CC[C@H](CO)C(=O)OC Amb25084318 [0,2,0,0,0,0|1,0,0]=3 4524 B8R0.20 CNC(=O)C(CC)NO Amb24580635 [0,2,0,0,0,0|2,0,0]=4 4525 B8R0.20 CNC(C#N)C(=O)OC Amb25841331 [0,2,0,0,0,0|1,0,1]=4 4526 B8R0.20 CNC(C=O)C(=O)OC Amb25228103 [0,2,0,0,0,0|0,0,2]=4 4527 B8R0.20 CNC(CO)C(=O)OC Amb25809607 [0,2,0,0,0,0|0,0,0]=2 4528 B8R0.20 CN[C@@H](CO)C(=O)OC Amb24116973 [0,2,0,0,0,0|0,0,0]=2 4529 B8R0.20 CN[C@H](C=C)C(=O)OC Amb25745930 [0,2,0,0,0,0|1,0,1]=4 4530 B8R0.20 COC(=O)C(C=C)ON Amb25306682 [0,2,0,0,0,0|1,0,1]=4 4531 B8R0.20 COC(=O)C(CCl)OC Amb25757010 [0,2,0,0,0,0|2,0,0]=4 4532 B8R0.20 COC(=O)C(CN)CF Amb24663335 [0,2,0,0,0,0|1,0,0]=3 4533 B8R0.20 COC(=O)C(CN)CN Amb19959298 [0,2,0,0,0,0|1,0,0]=3 4534 B8R0.20 COC(=O)C(CN)CN Amb22436786 [0,2,0,0,0,0|1,0,0]=3 4535 B8R0.20 COC(=O)C(CN)NO Amb25058737 [0,2,0,0,0,0|1,0,0]=3 4536 B8R0.20 COC(=O)C(CN)OC Amb24440902 [0,2,0,0,0,0|2,0,0]=4 4537 B8R0.20 COC(=O)C(CN)SC Amb24481948 [0,2,0,0,0,0|2,0,0]=4 4538 B8R0.20 COC(=O)C(CO)C=C Amb25358272 [0,2,0,0,0,0|1,0,0]=3 4539 B8R0.20 COC(=O)C(CO)CO Amb25178574 [0,2,0,0,0,0|1,0,0]=3 4540 B8R0.20 COC(=O)[C@@H](CO)OC Amb25058561 [0,2,0,0,0,0|1,0,0]=3 4541 B8R0.20 COC(=O)[C@H](CO)OC Amb25721195 [0,2,0,0,0,0|1,0,0]=3 4542 B8R0.20 COC(CO)C(O)C=O Amb25718445 [0,2,0,0,0,0|1,0,1]=4 4543 B8R0.20 CO[C@@H](C=O)[C@@H](O)CO Amb24357236 [0,2,0,0,0,0|1,0,1]=4 4544 B8R0.20 CO[C@@H](CO)C(=O)CO Amb24456628 [0,2,0,0,0,0|1,0,0]=3 4545 B8R0.20 C\C(=N/O)\C(CN)CN Amb24460812 [0,2,0,0,0,0|2,0,0]=4 4546 B8R0.20 OC(C=O)C(CO)CO Amb24334537 [0,2,0,0,0,0|1,0,1]=4 4547 B8R0.20 O[C@@H](C=O)C(CO)CO Amb25074421 [0,2,0,0,0,0|1,0,1]=4 4548 B8R0.20 O[C@H](CO)C(CO)C=O Amb25338057 [0,2,0,0,0,0|1,0,1]=4 4549 B8R0.20 [C-]#[N+]C(CO)C(=O)OC Amb24477843 [0,2,0,0,0,0|0,0,1]=3 4550 B8R0.17 CC(C)(O)[C@@](C)(N)CO Amb24477739 [0,2,0,0,0,0|1,0,1]=4 4551 B8R0.17 CC(C)(O)[C@](C)(N)CO Amb24618001 [0,2,0,0,0,0|1,0,1]=4 4552 B8R0.17 CC(N)(CO)P(O)(O)=O Amb25055174 [0,2,0,0,0,0|1,0,0]=3 4553 B8R0.17 CC(N)(CO)S(O)(=O)=O Amb24381550 [0,2,0,0,0,0|1,0,0]=3 4554 B8R0.17 CC(N)(CS)S(O)(=O)=O Amb25731944 [0,2,0,0,0,0|1,1,0]=4 4555 B8R0.17 CC(S)(CO)P(O)(O)=O Amb24532915 [0,2,0,0,0,0|2,0,0]=4 4556 B8R0.17 CCC(C)(N)P(O)(O)=O Amb22734487 [0,2,0,0,0,0|2,0,0]=4 4557 B8R0.17 CCC(N)(N)S(O)(=O)=O Amb24478782 [0,2,0,0,0,0|2,0,0]=4 4558 B8R0.17 CC[C@](C)(N)P(O)(O)=O Amb24727195 [0,2,0,0,0,0|2,0,0]=4 4559 B8R0.36 C=CC(N)(CO)C(O)=O Amb18642831 [0,2,0,0,0,0|0,0,0]=2 4560 B8R0.36 C=CC(O)(CN)C(O)=O Amb18642832 [0,2,0,0,0,0|1,0,1]=4 4561 B8R0.36 CC(=O)C(C)(CO)C#N Amb24333965 [0,2,0,0,0,0|1,0,1]=4 4562 B8R0.36 CC(CCl)(CO)C(O)=O Amb24409579 [0,2,0,0,0,0|1,0,0]=3 4563 B8R0.36 CC(CF)(CF)C(O)=O Amb22497450 [0,2,0,0,0,0|2,0,0]=4 4564 B8R0.36 CC(CN)(C#N)C(O)=O Amb24740971 [0,2,0,0,0,0|1,0,1]=4 4565 B8R0.36 CC(CO)(C=C)C(O)=O Amb18642777 [0,2,0,0,0,0|1,0,0]=3 4566 B8R0.36 CC(CO)(CO)C(N)=O Amb24669571 [0,2,0,0,0,0|2,0,0]=4 4567 B8R0.36 CC(CS)(NCl)C(O)=O Amb24630350 [0,2,0,0,0,0|0,1,0]=3 4568 B8R0.36 CC(O)C(C)(CN)CO Amb25230479 [0,2,0,0,0,0|1,0,1]=4 4569 B8R0.36 CCC(Br)(CC)C(O)=O Amb18127183 [0,2,0,0,0,0|2,0,0]=4 4570 B8R0.36 CCC(C(=O)N)(CC)N Amb13952025 [0,2,0,0,0,0|2,0,0]=4 4571 B8R0.36 CCC(C(=O)O)(CC)C Amb16232089 [0,2,0,0,0,0|2,0,0]=4 4572 B8R0.36 CCC(C(=O)O)(CC)S Amb17504415 [0,2,0,0,0,0|2,0,0]=4 4573 B8R0.36 CCC(C)(C#N)C(O)=O Amb18642501 [0,2,0,0,0,0|1,0,1]=4 4574 B8R0.36 CCC(C)(CN)C(C)=O Amb25696565 [0,2,0,0,0,0|2,0,0]=4 4575 B8R0.36 CCC(C)(CN)C(N)=O Amb25065665 [0,2,0,0,0,0|2,0,0]=4 4576 B8R0.36 CCC(C)(CN)C(O)=O Amb22157184 [0,2,0,0,0,0|1,0,0]=3 4577 B8R0.36 CCC(C)(CO)C(O)=O Amb25367931 [0,2,0,0,0,0|1,0,0]=3 4578 B8R0.36 CCC(C)(NC)C(N)=O Amb18289682 [0,2,0,0,0,0|2,0,0]=4 4579 B8R0.36 CCC(C)(NO)C(O)=O Amb25340502 [0,2,0,0,0,0|1,0,0]=3 4580 B8R0.36 CCC(Cl)(C#N)C(O)=O Amb24445594 [0,2,0,0,0,0|1,0,1]=4 4581 B8R0.36 CCC(F)(CC)C(O)=O Amb24120633 [0,2,0,0,0,0|2,0,0]=4 4582 B8R0.36 CCC(F)(CN)C(O)=O Amb25127619 [0,2,0,0,0,0|1,0,0]=3 4583 B8R0.36 CCC(N)(CC)C(N)=O Amb18288980 [0,2,0,0,0,0|2,0,0]=4 4584 B8R0.36 CCC(N)(CO)C(O)=O Amb18642917 [0,2,0,0,0,0|0,0,0]=2 4585 B8R0.36 CC[C@@](C)(CN)C(O)=O Amb24761388 [0,2,0,0,0,0|1,0,0]=3 4586 B8R0.36 CC[C@@](C)(CO)C(O)=O Amb25678633 [0,2,0,0,0,0|1,0,0]=3 4587 B8R0.36 CC[C@@](N)(CN)C(O)=O Amb25145998 [0,2,0,0,0,0|1,0,0]=3 4588 B8R0.36 CC[C@@](N)(CO)C(O)=O Amb24534463 [0,2,0,0,0,0|0,0,0]=2 4589 B8R0.36 CC[C@@](O)(CBr)C(O)=O Amb25337727 [0,2,0,0,0,0|2,0,0]=4 4590 B8R0.36 CC[C@](C(=O)O)(OC)C Amb10603236 [0,2,0,0,0,0|2,0,0]=4 4591 B8R0.36 CC[C@](N)(CN)C(O)=O Amb25188914 [0,2,0,0,0,0|1,0,0]=3 4592 B8R0.36 CC[C@](N)(CO)C(O)=O Amb25339948 [0,2,0,0,0,0|0,0,0]=2 4593 B8R0.36 CC[C@](O)(CN)C(O)=O Amb24657235 [0,2,0,0,0,0|1,0,0]=3 4594 B8R0.36 CC[C@](O)(CO)C(O)=O Amb24669128 [0,2,0,0,0,0|1,0,0]=3 4595 B8R0.36 CNC(C)(CF)C(O)=O Amb25287223 [0,2,0,0,0,0|1,0,0]=3 4596 B8R0.36 CN[C@@](C)(CF)C(O)=O Amb24477045 [0,2,0,0,0,0|1,0,0]=3 4597 B8R0.36 CN[C@](C)(CF)C(O)=O Amb25840877 [0,2,0,0,0,0|1,0,0]=3 4598 B8R0.36 COC(C)(CN)C(O)=O Amb24697658 [0,2,0,0,0,0|2,0,0]=4 4599 B8R0.36 COC(C)(CO)C(C)=O Amb25831567 [0,2,0,0,0,0|2,0,0]=4 4600 B8R0.36 CSC(C)(CCl)C(O)=O Amb18126501 [0,2,0,0,0,0|2,0,0]=4 4601 B8R0.36 CS[C@@](C)(CN)C(O)=O Amb24476638 [0,2,0,0,0,0|2,0,0]=4 4602 B8R0.36 C[C@@](CN)(C#N)C(O)=O Amb24642049 [0,2,0,0,0,0|1,0,1]=4 4603 B8R0.36 NC(=O)C(O)(CO)CO Amb25731993 [0,2,0,0,0,0|2,0,0]=4 4604 B8R0.36 NC(CF)(CF)C(O)=O Amb24117510 [0,2,0,0,0,0|1,0,0]=3 4605 B8R0.36 NC(CF)(CF)C(O)=O Amb25116338 [0,2,0,0,0,0|1,0,0]=3 4606 B8R0.36 NC(CS)(CS)C(O)=O Amb25144487 [0,2,0,0,0,0|0,1,0]=3 4607 B8R0.36 OC(=O)C(O)(CS)CS Amb25701523 [0,2,0,0,0,0|1,1,0]=4 4608 B8R0.37 CC(=O)C(C)(O)C(O)O Amb25833528 [0,2,0,0,0,0|2,0,0]=4 4609 B8R0.37 CC(Br)(C(O)=O)C(O)=O Amb24429036 [0,2,0,0,0,0|1,0,1]=4 4610 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,2,0,0,0,0|2,0,0]=4 4611 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,2,0,0,0,0|2,0,0]=4 4612 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,2,0,0,0,0|2,0,0]=4 4613 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,2,0,0,0,0|2,0,0]=4 4614 B8R0.37 CC(C)C(C)(N)P(O)=O Amb24567571 [0,2,0,0,0,0|2,0,0]=4 4615 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,2,0,0,0,0|2,0,0]=4 4616 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,2,0,0,0,0|2,0,0]=4 4617 B8R0.37 CC(C)C(Cl)(Cl)C(O)=O Amb25188935 [0,2,0,0,0,0|2,0,0]=4 4618 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,2,0,0,0,0|2,0,0]=4 4619 B8R0.37 CC(Cl)C(Cl)(Cl)C(O)=O Amb22168920 [0,2,0,0,0,0|2,0,0]=4 4620 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,2,0,0,0,0|2,0,0]=4 4621 B8R0.37 CC(F)C(C)(N)C(N)=O Amb25791580 [0,2,0,0,0,0|2,0,0]=4 4622 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,2,0,0,0,0|1,0,0]=3 4623 B8R0.37 CC(N)(C(C)O)C(C)O Amb25328983 [0,2,0,0,0,0|1,0,1]=4 4624 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,2,0,0,0,0|2,0,0]=4 4625 B8R0.37 CC(N)C(F)(F)C(O)=O Amb25188946 [0,2,0,0,0,0|2,0,0]=4 4626 B8R0.37 CC(O)(C(F)F)C(O)=O Amb25842016 [0,2,0,0,0,0|2,0,0]=4 4627 B8R0.37 CC(O)(C(O)=O)C(O)=O Amb18124398 [0,2,0,0,0,0|1,0,1]=4 4628 B8R0.37 CC(O)C(C)(C)C(C)=O Amb25282830 [0,2,0,0,0,0|2,0,0]=4 4629 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,2,0,0,0,0|1,0,0]=3 4630 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,2,0,0,0,0|1,0,0]=3 4631 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,2,0,0,0,0|1,0,0]=3 4632 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,2,0,0,0,0|2,0,0]=4 4633 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,2,0,0,0,0|1,0,0]=3 4634 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,2,0,0,0,0|2,0,0]=4 4635 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,2,0,0,0,0|1,0,0]=3 4636 B8R0.37 C[C@@H](O)[C@@](C)(O)C(C)=O Amb25662408 [0,2,0,0,0,0|2,0,0]=4 4637 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,2,0,0,0,0|1,0,0]=3 4638 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=O Amb25767044 [0,2,0,0,0,0|2,0,0]=4 4639 B8R0.37 C[C@@](N)(C(F)F)C(O)=O Amb25329065 [0,2,0,0,0,0|1,0,0]=3 4640 B8R0.37 C[C@@](N)(C(O)=O)C(N)=O Amb25077574 [0,2,0,0,0,0|0,0,2]=4 4641 B8R0.37 C[C@H](O)C(C)(C)C(C)=O Amb24725317 [0,2,0,0,0,0|2,0,0]=4 4642 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,2,0,0,0,0|1,0,0]=3 4643 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,2,0,0,0,0|0,0,0]=2 4644 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,2,0,0,0,0|1,0,0]=3 4645 B8R0.37 C[C@](N)(C(F)F)C(O)=O Amb25107781 [0,2,0,0,0,0|1,0,0]=3 4646 B8R0.37 FC(C(C(=O)O)(F)F)Br Amb10839241 [0,2,0,0,0,0|2,0,0]=4 4647 B8R0.37 FC(C(C(=O)O)(F)F)Cl Amb17594051 [0,2,0,0,0,0|2,0,0]=4 4648 B8R0.37 OC(=O)C(Br)(Br)C(O)=O Amb24707409 [0,2,0,0,0,0|1,0,1]=4 4649 B8R0.37 OC(=O)C(C(=O)O)(Cl)Cl Amb17594338 [0,2,0,0,0,0|1,0,1]=4 4650 B8R0.37 OC(=O)C(Cl)(Br)C(O)=O Amb25827170 [0,2,0,0,0,0|1,0,1]=4 4651 B8R0.37 OC(=O)C(Cl)(Cl)C(Cl)Cl Amb25377180 [0,2,0,0,0,0|2,0,0]=4 4652 B8R0.37 OC(=O)C(F)(Cl)C(Cl)Cl Amb25190584 [0,2,0,0,0,0|2,0,0]=4 4653 B8R0.37 OC(=O)C(F)(Cl)C(F)Cl Amb24444909 [0,2,0,0,0,0|2,0,0]=4 4654 B8R0.37 OC(=O)C(F)(F)C(O)=O Amb24088375 [0,2,0,0,0,0|1,0,1]=4 4655 B8R0.37 OC(O)(C(O)=O)C(O)=O Amb22002022 [0,2,0,0,0,0|1,0,1]=4 4656 B8R0.37 [2H]C(N)(C(C)C)C(O)=O Amb22367355 [0,2,0,0,0,0|1,0,0]=3 4657 B8R0.26 CCC(CN)S(O)(=O)=O Amb25032256 [0,2,0,0,0,0|2,0,0]=4 4658 B8R0.26 CCC(NC)P(O)(O)=O Amb24479934 [0,2,0,0,0,0|2,0,0]=4 4659 B8R0.26 CCC(NN)P(O)(O)=O Amb25685958 [0,2,0,0,0,0|2,0,0]=4 4660 B8R0.26 NCC(CI)S(O)(=O)=O Amb24481895 [0,2,0,0,0,0|2,0,0]=4 4661 B8R0.26 NC[C@@H](CO)S(O)(=O)=O Amb24478820 [0,2,0,0,0,0|1,0,0]=3 4662 B8R0.26 OP(O)(=O)C(CO)CO Amb25045680 [0,2,0,0,0,0|2,0,0]=4 4663 B8R0.26 OS(=O)(=O)C(CO)CO Amb25107688 [0,2,0,0,0,0|2,0,0]=4 4664 B8R0.27 BrC(C(Br)(C)C)C(=O)O Amb16192461 [0,2,0,0,0,0|2,0,0]=4 4665 B8R0.27 BrC(C(F)(C)C)C(=O)O Amb10605635 [0,2,0,0,0,0|2,0,0]=4 4666 B8R0.27 CC(=O)C(C(O)(C)C)O Amb17593385 [0,2,0,0,0,0|2,0,0]=4 4667 B8R0.27 CC(=O)C(N)C(F)(F)F Amb24433272 [0,2,0,0,0,0|2,0,0]=4 4668 B8R0.27 CC(=O)C(S)C(C)(C)O Amb24747561 [0,2,0,0,0,0|2,0,0]=4 4669 B8R0.27 CC(=O)[C@@H](N)C(C)(C)C Amb24477755 [0,2,0,0,0,0|2,0,0]=4 4670 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,2,0,0,0,0|2,0,0]=4 4671 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|2,0,0]=4 4672 B8R0.27 CC(C(O)=O)C(F)(F)F Amb19148979 [0,2,0,0,0,0|2,0,0]=4 4673 B8R0.27 CC(C(O)=O)S(O)(=O)=O Amb25765487 [0,2,0,0,0,0|2,0,0]=4 4674 B8R0.27 CC(C(O)=O)[Si](O)(O)O Amb24429015 [0,2,0,0,0,0|1,1,0]=4 4675 B8R0.27 CC(C)(C)C(Br)C(O)=O Amb18127181 [0,2,0,0,0,0|2,0,0]=4 4676 B8R0.27 CC(C)(C)C(Cl)C(O)=O Amb18125093 [0,2,0,0,0,0|2,0,0]=4 4677 B8R0.27 CC(C)(C)C(N)C(=O)Cl Amb24548277 [0,2,0,0,0,0|2,0,0]=4 4678 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,2,0,0,0,0|2,0,0]=4 4679 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,2,0,0,0,0|2,0,0]=4 4680 B8R0.27 CC(C)(C)C(O)C(O)=O Amb19299856 [0,2,0,0,0,0|2,0,0]=4 4681 B8R0.27 CC(C)(C)[C@@H](Br)C(O)=O Amb22746895 [0,2,0,0,0,0|2,0,0]=4 4682 B8R0.27 CC(C)(C)[C@@H](N)C(=O)Cl Amb24611035 [0,2,0,0,0,0|2,0,0]=4 4683 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,2,0,0,0,0|2,0,0]=4 4684 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,2,0,0,0,0|2,0,0]=4 4685 B8R0.27 CC(C)(C)[C@@H](N)C(O)=O Amb22744938 [0,2,0,0,0,0|1,0,0]=3 4686 B8R0.27 CC(C)(C)[C@@H](O)C(O)=O Amb22225174 [0,2,0,0,0,0|2,0,0]=4 4687 B8R0.27 CC(C)(C)[C@H](Br)C(O)=O Amb22226488 [0,2,0,0,0,0|2,0,0]=4 4688 B8R0.27 CC(C)(C)[C@H](N)C(=O)Cl Amb24630153 [0,2,0,0,0,0|2,0,0]=4 4689 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,2,0,0,0,0|2,0,0]=4 4690 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,2,0,0,0,0|2,0,0]=4 4691 B8R0.27 CC(C)(Cl)C(Cl)C(O)=O Amb18126746 [0,2,0,0,0,0|2,0,0]=4 4692 B8R0.27 CC(C)(Cl)C(N)C(O)=O Amb25032131 [0,2,0,0,0,0|1,0,0]=3 4693 B8R0.27 CC(C)(Cl)[C@H](N)C(N)=O Amb25777000 [0,2,0,0,0,0|2,0,0]=4 4694 B8R0.27 CC(C)(F)[C@H](N)C(O)=O Amb24369670 [0,2,0,0,0,0|1,0,0]=3 4695 B8R0.27 CC(C)(N)C(N)C(O)=O Amb18642889 [0,2,0,0,0,0|1,0,0]=3 4696 B8R0.27 CC(C)(N)C(O)C(O)=O Amb25075483 [0,2,0,0,0,0|2,0,0]=4 4697 B8R0.27 CC(C)(N)C(S)C(O)=O Amb24436486 [0,2,0,0,0,0|2,0,0]=4 4698 B8R0.27 CC(C)(O)C(=O)C(O)=O Amb25064348 [0,2,0,0,0,0|1,0,1]=4 4699 B8R0.27 CC(C)(O)C(Cl)C(O)=O Amb25101058 [0,2,0,0,0,0|1,0,0]=3 4700 B8R0.27 CC(C)(O)C(N)C(O)=O Amb18642914 [0,2,0,0,0,0|0,0,0]=2 4701 B8R0.27 CC(C)(O)C(O)C(N)=O Amb25732960 [0,2,0,0,0,0|2,0,0]=4 4702 B8R0.27 CC(C)(O)C(O)C(O)=O Amb25118477 [0,2,0,0,0,0|1,0,0]=3 4703 B8R0.27 CC(C)C(N)P(C)(O)=O Amb25784649 [0,2,0,0,0,0|2,0,0]=4 4704 B8R0.27 CC(Cl)(Cl)C(Cl)C(O)=O Amb25032276 [0,2,0,0,0,0|2,0,0]=4 4705 B8R0.27 CC(F)(F)C(Cl)C(O)=O Amb24373113 [0,2,0,0,0,0|2,0,0]=4 4706 B8R0.27 CC(F)(F)[C@@H](N)C(O)=O Amb24618136 [0,2,0,0,0,0|1,0,0]=3 4707 B8R0.27 CC(F)(F)[C@H](N)C(O)=O Amb24641014 [0,2,0,0,0,0|1,0,0]=3 4708 B8R0.27 CC(O)C(N)P(O)(O)=O Amb24524174 [0,2,0,0,0,0|1,0,0]=3 4709 B8R0.27 CC(O)C(O)P(O)(O)=O Amb25235589 [0,2,0,0,0,0|2,0,0]=4 4710 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,2,0,0,0,0|2,0,0]=4 4711 B8R0.27 C[C@@H](C(O)=O)C(F)(F)F Amb24120617 [0,2,0,0,0,0|2,0,0]=4 4712 B8R0.27 C[C@@H](O)[C@@H](O)P(O)(O)=O Amb25226258 [0,2,0,0,0,0|2,0,0]=4 4713 B8R0.27 C[C@@H](O)[C@H](N)P(O)(O)=O Amb24391488 [0,2,0,0,0,0|1,0,0]=3 4714 B8R0.27 C[C@@H](O)[C@H](O)P(O)(O)=O Amb25219228 [0,2,0,0,0,0|2,0,0]=4 4715 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,2,0,0,0,0|2,0,0]=4 4716 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,2,0,0,0,0|2,0,0]=4 4717 B8R0.27 C[C@H](O)[C@@H](Cl)P(O)(O)=O Amb25858138 [0,2,0,0,0,0|2,0,0]=4 4718 B8R0.27 C[C@H](O)[C@H](O)P(O)(O)=O Amb25136255 [0,2,0,0,0,0|2,0,0]=4 4719 B8R0.27 Cl[C@H](C(C)(C)C)C(=O)O Amb10069805 [0,2,0,0,0,0|2,0,0]=4 4720 B8R0.27 NC(C(C)(C)C)C(=O)O Amb2371663 [0,2,0,0,0,0|1,0,0]=3 4721 B8R0.27 NC(C(Cl)Cl)P(O)(O)=O Amb25092293 [0,2,0,0,0,0|2,0,0]=4 4722 B8R0.27 NC(C(F)(F)F)C(=O)O Amb10607071 [0,2,0,0,0,0|1,0,0]=3 4723 B8R0.27 NC(C(F)F)S(O)(=O)=O Amb24478737 [0,2,0,0,0,0|2,0,0]=4 4724 B8R0.27 NC(C(O)=O)C(Cl)(Cl)Cl Amb24480186 [0,2,0,0,0,0|1,0,0]=3 4725 B8R0.27 NC(C(S)(C)C)C(=O)O Amb1907179 [0,2,0,0,0,0|0,1,0]=3 4726 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O Amb16232019 [0,2,0,0,0,0|1,0,0]=3 4727 B8R0.27 N[C@@H](C(O)=O)C(F)(F)F Amb25378031 [0,2,0,0,0,0|1,0,0]=3 4728 B8R0.27 N[C@H](C(O)=O)C(Cl)(Cl)Cl Amb24480006 [0,2,0,0,0,0|1,0,0]=3 4729 B8R0.27 N[C@H](C(O)=O)C(F)(F)F Amb24650499 [0,2,0,0,0,0|1,0,0]=3 4730 B8R0.27 OC(=O)C(Br)C(F)(F)F Amb22274799 [0,2,0,0,0,0|2,0,0]=4 4731 B8R0.27 OC(=O)C(Br)S(O)(=O)=O Amb24375783 [0,2,0,0,0,0|2,0,0]=4 4732 B8R0.27 OC(=O)C(C(O)(C)C)Br Amb17595209 [0,2,0,0,0,0|1,0,0]=3 4733 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,2,0,0,0,0|1,0,0]=3 4734 B8R0.27 OC(=O)C(Cl)S(O)(=O)=O Amb25724885 [0,2,0,0,0,0|2,0,0]=4 4735 B8R0.27 OC(=O)C(F)P(O)(O)=O Amb24520819 [0,2,0,0,0,0|2,0,0]=4 4736 B8R0.27 OC(=O)[C@@H](Br)S(O)(=O)=O Amb25218846 [0,2,0,0,0,0|2,0,0]=4 4737 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,2,0,0,0,0|1,0,0]=3 4738 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,2,0,0,0,0|1,0,0]=3 4739 B8R0.27 OC(C(O)=O)C(Cl)(Cl)Cl Amb24467776 [0,2,0,0,0,0|2,0,0]=4 4740 B8R0.27 OC(C(O)=O)P(O)(O)=O Amb24117287 [0,2,0,0,0,0|2,0,0]=4 4741 B8R0.27 OC(C(O)=O)S(O)(=O)=O Amb24739659 [0,2,0,0,0,0|2,0,0]=4 4742 B8R0.27 O[C@@H](C(C)(C)C)C(=O)O Amb10603129 [0,2,0,0,0,0|2,0,0]=4 4743 B8R0.27 O[C@@H](C(F)(F)F)C(=O)O Amb10838306 [0,2,0,0,0,0|2,0,0]=4 4744 B8R0.27 O[C@H](C(F)(F)F)C(=O)O Amb10841493 [0,2,0,0,0,0|2,0,0]=4 4745 B8R0.27 [2H]C([2H])([2H])C(N)C(O)=O Amb22338765 [0,2,0,0,0,0|1,0,0]=3 4746 B8R0.27 [2H]C([2H])([2H])[C@@H](N)C(O)=O Amb22338907 [0,2,0,0,0,0|1,0,0]=3 4747 B8R0.27 [2H][13C]([2H])([2H])C(N)C(O)=O Amb22367222 [0,2,0,0,0,0|1,0,0]=3 4748 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,2,0,0,0,0|2,0,0]=4 4749 B8R0.18 CC(=C)C(CO)N(C)C Amb25045791 [0,2,0,0,0,0|2,0,0]=4 4750 B8R0.18 CC(=O)C(CC)C(N)=O Amb25082383 [0,2,0,0,0,0|2,0,0]=4 4751 B8R0.18 CC(=O)C(CO)C(C)=O Amb25288499 [0,2,0,0,0,0|2,0,0]=4 4752 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,2,0,0,0,0|2,0,0]=4 4753 B8R0.18 CC(C(C(=O)O)C#N)C Amb10066977 [0,2,0,0,0,0|1,0,1]=4 4754 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,2,0,0,0,0|2,0,0]=4 4755 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,2,0,0,0,0|2,0,0]=4 4756 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,2,0,0,0,0|2,0,0]=4 4757 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,2,0,0,0,0|2,0,0]=4 4758 B8R0.18 CC(C)C(CN)C(N)=O Amb18294193 [0,2,0,0,0,0|2,0,0]=4 4759 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,2,0,0,0,0|1,0,0]=3 4760 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,2,0,0,0,0|1,0,0]=3 4761 B8R0.18 CC(C)C(CO)C(C)=O Amb24370150 [0,2,0,0,0,0|2,0,0]=4 4762 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,2,0,0,0,0|1,0,0]=3 4763 B8R0.18 CC(C)C(N=O)C(O)=O Amb25292210 [0,2,0,0,0,0|1,0,1]=4 4764 B8R0.18 CC(C)C(NBr)C(O)=O Amb24648440 [0,2,0,0,0,0|1,0,0]=3 4765 B8R0.18 CC(C)C(NC)C(=O)Cl Amb25139558 [0,2,0,0,0,0|2,0,0]=4 4766 B8R0.18 CC(C)C(NC)C(N)=O Amb18975189 [0,2,0,0,0,0|2,0,0]=4 4767 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,2,0,0,0,0|1,0,0]=3 4768 B8R0.18 CC(C)C(NCl)C(O)=O Amb24480122 [0,2,0,0,0,0|1,0,0]=3 4769 B8R0.18 CC(C)C(NN)C(O)=O Amb18642886 [0,2,0,0,0,0|1,0,0]=3 4770 B8R0.18 CC(C)C(ON)C(O)=O Amb24477865 [0,2,0,0,0,0|1,0,0]=3 4771 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,2,0,0,0,0|1,0,0]=3 4772 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,2,0,0,0,0|1,0,0]=3 4773 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,2,0,0,0,0|1,0,0]=3 4774 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,2,0,0,0,0|1,0,0]=3 4775 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,2,0,0,0,0|1,0,0]=3 4776 B8R0.18 CC(C)[C@@H](ON)C(O)=O Amb24117143 [0,2,0,0,0,0|1,0,0]=3 4777 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,2,0,0,0,0|1,0,0]=3 4778 B8R0.18 CC(C)[C@H](NC)C(N)=O Amb24376236 [0,2,0,0,0,0|2,0,0]=4 4779 B8R0.18 CC(C)[C@H](NO)C(N)=O Amb24540370 [0,2,0,0,0,0|2,0,0]=4 4780 B8R0.18 CC(C)[C@H](ON)C(O)=O Amb25785764 [0,2,0,0,0,0|1,0,0]=3 4781 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,2,0,0,0,0|2,0,0]=4 4782 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,2,0,0,0,0|1,0,0]=3 4783 B8R0.18 CC(O)C(CC)C(N)=O Amb24539570 [0,2,0,0,0,0|2,0,0]=4 4784 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,2,0,0,0,0|1,0,0]=3 4785 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,2,0,0,0,0|1,0,0]=3 4786 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,2,0,0,0,0|0,0,0]=2 4787 B8R0.18 CC(O)C(NCl)C(O)=O Amb24408588 [0,2,0,0,0,0|0,0,0]=2 4788 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,2,0,0,0,0|0,0,0]=2 4789 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,2,0,0,0,0|0,0,0]=2 4790 B8R0.18 CC(O)[C@H](NCl)C(O)=O Amb25684733 [0,2,0,0,0,0|0,0,0]=2 4791 B8R0.18 CCC(C(N)=O)C(N)=O Amb25848912 [0,2,0,0,0,0|2,0,0]=4 4792 B8R0.18 CCC(C(N)=O)N(C)C Amb23560712 [0,2,0,0,0,0|2,0,0]=4 4793 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,2,0,0,0,0|1,0,0]=3 4794 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,2,0,0,0,0|1,0,0]=3 4795 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,2,0,0,0,0|1,0,0]=3 4796 B8R0.18 CCC(C(O)=O)P(O)=O Amb25205534 [0,2,0,0,0,0|1,1,0]=4 4797 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,2,0,0,0,0|2,0,0]=4 4798 B8R0.18 CC[C@@H](C(=O)O)N(O)O Amb16233002 [0,2,0,0,0,0|1,0,0]=3 4799 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,2,0,0,0,0|1,0,0]=3 4800 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,2,0,0,0,0|1,0,0]=3 4801 B8R0.18 CN(C)C(CO)C(N)=O Amb24495258 [0,2,0,0,0,0|1,0,0]=3 4802 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,2,0,0,0,0|0,0,0]=2 4803 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,2,0,0,0,0|1,0,0]=3 4804 B8R0.18 CN(C)[C@@H](CO)C(N)=O Amb25114181 [0,2,0,0,0,0|1,0,0]=3 4805 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,2,0,0,0,0|0,1,0]=3 4806 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,2,0,0,0,0|0,1,0]=3 4807 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,2,0,0,0,0|1,0,1]=4 4808 B8R0.18 CNC(C(=O)C)C(C)C Amb2369975 [0,2,0,0,0,0|2,0,0]=4 4809 B8R0.18 CNC(C(O)=O)C(O)=O Amb24477701 [0,2,0,0,0,0|0,0,1]=3 4810 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|1,0,0]=3 4811 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|2,0,0]=4 4812 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,2,0,0,0,0|1,0,0]=3 4813 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,2,0,0,0,0|0,0,0]=2 4814 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,2,0,0,0,0|0,0,0]=2 4815 B8R0.18 C[C@@H](O)[C@H](NCl)C(O)=O Amb25124152 [0,2,0,0,0,0|0,0,0]=2 4816 B8R0.18 C[C@H](O)[C@H](NC)C(C)=C Amb24574322 [0,2,0,0,0,0|2,0,0]=4 4817 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,2,0,0,0,0|0,0,0]=2 4818 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,2,0,0,0,0|0,0,0]=2 4819 B8R0.18 C\C=C(/[C@@H](C)O)\C(O)=O Amb25843942 [0,2,0,0,0,0|1,0,1]=4 4820 B8R0.18 NC(=N)C(=NO)C(O)=O Amb25791658 [0,2,0,0,0,0|1,0,1]=4 4821 B8R0.18 NC(=O)C(=NO)C(O)=O Amb25118376 [0,2,0,0,0,0|1,0,1]=4 4822 B8R0.18 OC(=O)C(C=O)C(O)=O Amb25188908 [0,2,0,0,0,0|1,0,1]=4 4823 B8R0.18 OC(=O)C(CF)C(F)F Amb24743896 [0,2,0,0,0,0|2,0,0]=4 4824 B8R0.18 OC(=O)C(CO)C(F)F Amb24559548 [0,2,0,0,0,0|1,0,0]=3 4825 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,2,0,0,0,0|1,1,0]=4 4826 B6R1.2 BrC=1CCOC1 Amb24322594 [1,0,0,1,0,0|2,0,0]=4 4827 B6R1.2 C1C[NH2+]NC1=O Amb2408363 [1,0,0,1,0,0|2,0,0]=4 4828 B6R1.2 C=C1COCC1 Amb24683386 [1,0,0,1,0,0|2,0,0]=4 4829 B6R1.2 FC=1CCOC1 Amb24322813 [1,0,0,1,0,0|2,0,0]=4 4830 B6R1.2 IC=1CCOC1 Amb24322814 [1,0,0,1,0,0|2,0,0]=4 4831 B6R1.2 O=C1CCCN1 Amb20240633 [1,0,0,1,0,0|2,0,0]=4 4832 B6R1.2 O=C1CCCN1 Amb22338202 [1,0,0,1,0,0|2,0,0]=4 4833 B6R1.2 O=C1CCCN1 Amb22432663 [1,0,0,1,0,0|2,0,0]=4 4834 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|1,1,0]=4 4835 B6R1.2 O=C1CCNN1 Amb22730624 [1,0,0,1,0,0|2,0,0]=4 4836 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|1,0,0]=3 4837 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,1,0,0|2,0,0]=4 4838 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,1,0,0|2,0,0]=4 4839 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [1,0,0,1,0,0|2,0,0]=4 4840 B6R1.2 O=[13C]1CCCC1 Amb22353487 [1,0,0,1,0,0|2,0,0]=4 4841 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,1,0,0|2,0,0]=4 4842 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,1,0,0|2,0,0]=4 4843 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|2,0,0]=4 4844 B6R1.3 OCCC1CO1 Amb24334074 [1,0,0,1,0,0|1,0,1]=4 4845 B6R1.3 OCCC=1CC1 Amb24478088 [1,0,0,1,0,0|2,0,0]=4 4846 B6R1.3 OCC[C@@H]1CO1 Amb24120634 [1,0,0,1,0,0|1,0,1]=4 4847 B6R1.3 OCC[C@H]1CO1 Amb25052254 [1,0,0,1,0,0|1,0,1]=4 4848 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|2,0,0]=4 4849 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|1,0,0]=3 4850 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [1,0,0,1,0,0|1,0,0]=3 4851 B6R1.5 C[C@H]1CC(=O)N1 Amb25755939 [1,0,0,1,0,0|2,0,0]=4 4852 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|1,0,0]=3 4853 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|2,0,0]=4 4854 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|2,0,0]=4 4855 B6R1.5 O=C1CC(Br)C1 Amb22388498 [1,0,0,1,0,0|2,0,0]=4 4856 B6R1.5 O=C1CC(Br)N1 Amb24332152 [1,0,0,1,0,0|2,0,0]=4 4857 B6R1.5 O=C1CC(Cl)C1 Amb25087791 [1,0,0,1,0,0|2,0,0]=4 4858 B6R1.5 O=C1CC(Cl)N1 Amb24531401 [1,0,0,1,0,0|2,0,0]=4 4859 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 4860 B6R1.5 OC1CC(=O)C1 Amb22235480 [1,0,0,1,0,0|1,0,0]=3 4861 B6R1.5 OC1CS(=O)C1 Amb25025463 [1,0,0,1,0,0|2,0,0]=4 4862 B6R1.5 O[C@H]1CC(=O)O1 Amb25106737 [1,0,0,1,0,0|0,0,0]=2 4863 B6R1.8 C=C1CC1CO Amb22224918 [1,0,0,1,0,0|2,0,0]=4 4864 B6R1.8 C=C1C[C@@H]1CO Amb25359146 [1,0,0,1,0,0|2,0,0]=4 4865 B6R1.8 C=C1C[C@H]1CO Amb24529640 [1,0,0,1,0,0|2,0,0]=4 4866 B6R1.8 CC1=CC1CO Amb25106800 [1,0,0,1,0,0|2,0,0]=4 4867 B6R1.8 CC1O[C@H]1CO Amb25146658 [1,0,0,1,0,0|1,0,1]=4 4868 B6R1.8 CCC1CC1=O Amb24686409 [1,0,0,1,0,0|2,0,0]=4 4869 B6R1.8 CCC1OC1=O Amb24426509 [1,0,0,1,0,0|1,0,0]=3 4870 B6R1.8 C[C@H]1O[C@H]1CO Amb24514794 [1,0,0,1,0,0|1,0,1]=4 4871 B6R1.8 OCC1=CC1=O Amb24721654 [1,0,0,1,0,0|1,0,1]=4 4872 B6R1.11 CC(=C)C1CO1 Amb19516025 [1,0,0,1,0,0|2,0,0]=4 4873 B6R1.11 CC(=O)C1CS1 Amb25373120 [1,0,0,1,0,0|1,1,0]=4 4874 B6R1.11 CC(=O)[C@H]1CO1 Amb24628197 [1,0,0,1,0,0|1,0,0]=3 4875 B6R1.11 CC(C1CO1)O Amb17593033 [1,0,0,1,0,0|1,0,1]=4 4876 B6R1.11 CC(O)[C@H]1CO1 Amb24531369 [1,0,0,1,0,0|1,0,1]=4 4877 B6R1.11 C[C@@H](O)C1CO1 Amb25146411 [1,0,0,1,0,0|1,0,1]=4 4878 B6R1.11 C[C@H](O)[C@@H]1CO1 Amb25176470 [1,0,0,1,0,0|1,0,1]=4 4879 B6R1.11 FC(=O)C1CC1 Amb17673783 [1,0,0,1,0,0|2,0,0]=4 4880 B6R1.11 NC(=O)C1CC1 Amb1789460 [1,0,0,1,0,0|2,0,0]=4 4881 B6R1.11 N[13C](=O)[13CH]1[13CH2]O1 Amb17614804 [1,0,0,1,0,0|1,0,0]=3 4882 B6R1.11 OC(=O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 4883 B6R1.11 OC(=O)C1CS1 Amb24641854 [1,0,0,1,0,0|0,1,0]=3 4884 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 4885 B6R1.11 OS(=O)C1CC1 Amb24334290 [1,0,0,1,0,0|2,0,0]=4 4886 B6R1.11 [O-]C(=O)C1CO1 Amb22492453 [1,0,0,1,0,0|0,0,1]=3 4887 B6R1.11 [O-]C(=O)[C@@H]1CO1 Amb22503671 [1,0,0,1,0,0|0,0,1]=3 4888 B6R1.11 [O-]C(=O)[C@H]1CO1 Amb22503672 [1,0,0,1,0,0|0,0,1]=3 4889 B6R1.4 CC1CNC1=O Amb24444140 [1,0,0,1,0,0|2,0,0]=4 4890 B6R1.4 CC1COC1=O Amb25794274 [1,0,0,1,0,0|1,0,0]=3 4891 B6R1.4 C[C@@H]1CCC1=O Amb24334317 [1,0,0,1,0,0|2,0,0]=4 4892 B6R1.4 C[C@@H]1CNC1=O Amb24568896 [1,0,0,1,0,0|2,0,0]=4 4893 B6R1.4 C[C@H]1CCC1=O Amb24333446 [1,0,0,1,0,0|2,0,0]=4 4894 B6R1.4 NC1CCC1=O Amb22896568 [1,0,0,1,0,0|1,0,0]=3 4895 B6R1.4 NC1CCC1O Amb19148610 [1,0,0,1,0,0|1,0,1]=4 4896 B6R1.4 NC1CNC1=O Amb18832512 [1,0,0,1,0,0|1,0,0]=3 4897 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [1,0,0,1,0,0|1,0,1]=4 4898 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [1,0,0,1,0,0|1,0,1]=4 4899 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [1,0,0,1,0,0|1,0,1]=4 4900 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [1,0,0,1,0,0|1,0,1]=4 4901 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [1,0,0,1,0,0|1,0,0]=3 4902 B6R1.4 N[C@@H]1COC1=O Amb22748014 [1,0,0,1,0,0|0,0,0]=2 4903 B6R1.4 N[C@@H]1COC1=O Amb22757168 [1,0,0,1,0,0|0,0,0]=2 4904 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [1,0,0,1,0,0|1,0,1]=4 4905 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [1,0,0,1,0,0|1,0,1]=4 4906 B6R1.4 N[C@H]1CNC1=O Amb25811302 [1,0,0,1,0,0|1,0,0]=3 4907 B6R1.4 O=C1CCC1Br Amb21964157 [1,0,0,1,0,0|2,0,0]=4 4908 B6R1.4 O=C1CCC1C Amb17593022 [1,0,0,1,0,0|2,0,0]=4 4909 B6R1.4 O=C1CCC1Cl Amb19892275 [1,0,0,1,0,0|2,0,0]=4 4910 B6R1.4 O=C1CCC1O Amb17593027 [1,0,0,1,0,0|2,0,0]=4 4911 B6R1.4 O=C1SCC1Cl Amb24502718 [1,0,0,1,0,0|1,1,0]=4 4912 B6R1.4 OC1CNC1=O Amb24689689 [1,0,0,1,0,0|2,0,0]=4 4913 B6R1.4 O[C@@H]1C=C[C@@H]1O Amb25686110 [1,0,0,1,0,0|2,0,0]=4 4914 B6R1.4 O[C@@H]1C=C[C@H]1O Amb25177168 [1,0,0,1,0,0|2,0,0]=4 4915 B6R1.4 [NH3+][C@H]1COC1=O Amb22349488 [1,0,0,1,0,0|0,0,1]=3 4916 B6R1.6 C=CC1CCN1 Amb24618150 [1,0,0,1,0,0|2,0,0]=4 4917 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,0]=3 4918 B6R1.6 O=CC1CCO1 Amb24565587 [1,0,0,1,0,0|2,0,0]=4 4919 B6R1.6 O=CC1COC1 Amb21857829 [1,0,0,1,0,0|1,0,0]=3 4920 B6R1.6 O=CC1CSC1 Amb25145476 [1,0,0,1,0,0|1,1,0]=4 4921 B6R1.6 OCC1CCN1 Amb21963462 [1,0,0,1,0,0|1,0,1]=4 4922 B6R1.6 OCC1COC1 Amb19958096 [1,0,0,1,0,0|1,0,1]=4 4923 B6R1.6 OC[C@@H]1CCN1 Amb22406086 [1,0,0,1,0,0|1,0,1]=4 4924 B6R1.6 OC[C@H]1CCN1 Amb22233159 [1,0,0,1,0,0|1,0,1]=4 4925 B6R1.7 C=CC1(N)CC1 Amb25663115 [1,0,0,1,0,0|2,0,0]=4 4926 B6R1.7 CC1(CO)CO1 Amb22001420 [1,0,0,1,0,0|1,0,1]=4 4927 B6R1.7 C[C@@]1(CO)CO1 Amb22801681 [1,0,0,1,0,0|1,0,1]=4 4928 B6R1.7 C[C@]1(CO1)C=O Amb25735120 [1,0,0,1,0,0|1,0,0]=3 4929 B6R1.7 O=CC1(F)CC1 Amb25359463 [1,0,0,1,0,0|2,0,0]=4 4930 B6R1.7 OC1(CC1)C=O Amb24627118 [1,0,0,1,0,0|2,0,0]=4 4931 B6R1.12 CC1C(C)C1=O Amb25807048 [1,0,0,1,0,0|2,0,0]=4 4932 B8R1.1 CC1=NC(CO)CO1 Amb24527624 [0,0,0,1,0,1|2,0,0]=4 4933 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,1|2,0,0]=4 4934 B8R1.1 NC1=NC(CO)CO1 Amb25233954 [0,0,0,1,0,1|2,0,0]=4 4935 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,0,0,1,0,1|2,0,0]=4 4936 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,0,0,1,0,1|2,0,0]=4 4937 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,0,0,1,0,1|2,0,0]=4 4938 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,0,0,1,0,1|2,0,0]=4 4939 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,0,0,1,0,1|2,0,0]=4 4940 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,0,0,1,0,1|2,0,0]=4 4941 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,0,0,1,0,1|2,0,0]=4 4942 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,0,0,1,0,1|2,0,0]=4 4943 B8R1.1 OC1CNC(C1)CO Amb24268900 [0,0,0,1,0,1|1,0,1]=4 4944 B8R1.1 OCC1=COC(=O)O1 Amb25214922 [0,0,0,1,0,1|1,0,1]=4 4945 B8R1.1 OCC1C=CC(=O)N1 Amb24544831 [0,0,0,1,0,1|2,0,0]=4 4946 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,0,0,1,0,1|2,0,0]=4 4947 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,0,0,1,0,1|2,0,0]=4 4948 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,0,0,1,0,1|2,0,0]=4 4949 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,0,0,1,0,1|2,0,0]=4 4950 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,0,0,1,0,1|2,0,0]=4 4951 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,0,0,1,0,1|2,0,0]=4 4952 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,0,0,1,0,1|1,0,0]=3 4953 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,0,0,1,0,1|1,0,0]=3 4954 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,0,0,1,0,1|1,1,0]=4 4955 B8R1.1 OCC1COP(=O)O1 Amb24475979 [0,0,0,1,0,1|2,0,0]=4 4956 B8R1.1 OCC1COS(=O)O1 Amb25802802 [0,0,0,1,0,1|2,0,0]=4 4957 B8R1.1 OCC1NCC(C1)O Amb1102176 [0,0,0,1,0,1|1,0,1]=4 4958 B8R1.1 OCC1OCC(=O)O1 Amb24643063 [0,0,0,1,0,1|2,0,0]=4 4959 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,0,0,1,0,1|1,0,1]=4 4960 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,0,0,1,0,1|2,0,0]=4 4961 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,0,0,1,0,1|2,0,0]=4 4962 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,0,0,1,0,1|2,0,0]=4 4963 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,0,0,1,0,1|2,0,0]=4 4964 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,0,0,1,0,1|2,0,0]=4 4965 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,0,0,1,0,1|2,0,0]=4 4966 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,0,0,1,0,1|1,0,0]=3 4967 B8R1.1 OC[C@@H]1COS(=O)O1 Amb24748538 [0,0,0,1,0,1|2,0,0]=4 4968 B8R1.1 OC[C@H]1C=CC(=O)N1 Amb25225281 [0,0,0,1,0,1|2,0,0]=4 4969 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,0,0,1,0,1|2,0,0]=4 4970 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,0,0,1,0,1|2,0,0]=4 4971 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,0,0,1,0,1|2,0,0]=4 4972 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,0,0,1,0,1|2,0,0]=4 4973 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,0,0,1,0,1|2,0,0]=4 4974 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,0,0,1,0,1|1,1,0]=4 4975 B8R1.1 O[C@@H]1CN[C@@H](C1)CO Amb24117087 [0,0,0,1,0,1|1,0,1]=4 4976 B8R1.1 O[C@@H]1CN[C@H](C1)CO Amb22756284 [0,0,0,1,0,1|1,0,1]=4 4977 B8R1.1 O[C@H]1CN[C@@H](C1)CO Amb19929426 [0,0,0,1,0,1|1,0,1]=4 4978 B8R1.1 O[C@H]1CN[C@H](C1)CO Amb24763113 [0,0,0,1,0,1|1,0,1]=4 4979 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,0,0,1,0,1|2,0,0]=4 4980 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,0,0,1,0,1|2,0,0]=4 4981 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,1,0,1|2,0,0]=4 4982 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,0,0,1,0,1|2,0,0]=4 4983 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,1,0,1|2,0,0]=4 4984 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,1,0,1|2,0,0]=4 4985 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,0,0,1,0,1|2,0,0]=4 4986 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,0,0,1,0,1|2,0,0]=4 4987 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,0,0,1,0,1|2,0,0]=4 4988 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,0,0,1,0,1|1,0,0]=3 4989 B8R1.4 NC1CC(O)COC1 Amb24526934 [0,0,0,1,0,1|1,0,1]=4 4990 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,1,0,1|2,0,0]=4 4991 B8R1.4 NC1CNNC(=O)N1 Amb24559373 [0,0,0,1,0,1|2,0,0]=4 4992 B8R1.4 NC=1COCC(=O)C1 Amb25785409 [0,0,0,1,0,1|1,0,1]=4 4993 B8R1.4 NC=1CONC(=O)N1 Amb24698901 [0,0,0,1,0,1|1,0,1]=4 4994 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,0,0,1,0,1|2,0,0]=4 4995 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,0,0,1,0,1|1,0,0]=3 4996 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,0,0,1,0,1|2,0,0]=4 4997 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,0,0,1,0,1|2,0,0]=4 4998 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,0,0,1,0,1|2,0,0]=4 4999 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,0,0,1,0,1|1,0,1]=4 5000 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,0,0,1,0,1|2,0,0]=4 5001 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,0,0,1,0,1|2,0,0]=4 5002 B8R1.18 CC1OC(=O)NC1N Amb24568318 [0,0,0,1,0,1|1,0,0]=3 5003 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O Amb24760967 [0,0,0,1,0,1|2,0,0]=4 5004 B8R1.18 C[C@@H]1NC(=O)C[C@H]1O Amb25203404 [0,0,0,1,0,1|2,0,0]=4 5005 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,0,0,1,0,1|2,0,0]=4 5006 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,0,0,1,0,1|2,0,0]=4 5007 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,0,0,1,0,1|2,0,0]=4 5008 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,0,0,1,0,1|2,0,0]=4 5009 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,0,0,1,0,1|2,0,0]=4 5010 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,0,0,1,0,1|2,0,0]=4 5011 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,0,0,1,0,1|2,0,0]=4 5012 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,0,0,1,0,1|1,0,0]=3 5013 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,0,0,1,0,1|0,0,2]=4 5014 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,0,0,1,0,1|0,0,0]=2 5015 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,0,0,1,0,1|0,0,2]=4 5016 B8R1.18 N[C@H]1C[C@@H](O)C[C@@H]1O Amb25256550 [0,0,0,1,0,1|1,0,1]=4 5017 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,0,0,1,0,1|2,0,0]=4 5018 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,0,0,1,0,1|2,0,0]=4 5019 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,0,0,1,0,1|2,0,0]=4 5020 B8R1.18 OC1OC(=O)C=C1Br Amb22490504 [0,0,0,1,0,1|1,0,1]=4 5021 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,1|2,0,0]=4 5022 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,1|2,0,0]=4 5023 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,1|2,0,0]=4 5024 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,1|2,0,0]=4 5025 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,1|2,0,0]=4 5026 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,1|2,0,0]=4 5027 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,1|2,0,0]=4 5028 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,0,0,1,0,1|2,0,0]=4 5029 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,1|2,0,0]=4 5030 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,1|2,0,0]=4 5031 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,0,0,1,0,1|2,0,0]=4 5032 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,0,0,1,0,1|2,0,0]=4 5033 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,0,0,1,0,1|1,0,0]=3 5034 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,1,0,1|2,0,0]=4 5035 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,0,0,1,0,1|2,0,0]=4 5036 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,1,0,1|1,0,0]=3 5037 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,1,0,1|1,0,0]=3 5038 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,0,0,1,0,1|0,0,0]=2 5039 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,0,0,1,0,1|0,0,0]=2 5040 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,0,0,1,0,1|2,0,0]=4 5041 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,0,0,1,0,1|0,0,0]=2 5042 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,1,0,1|2,0,0]=4 5043 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,1,0,1|2,0,0]=4 5044 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,1,0,1|2,0,0]=4 5045 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,1,0,1|2,0,0]=4 5046 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,0,0,1,0,1|2,0,0]=4 5047 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,0,0,1,0,1|2,0,0]=4 5048 B8R1.34 NC(=O)CC1CCN1 Amb24561003 [0,0,0,1,0,1|2,0,0]=4 5049 B8R1.34 NC(=O)CC1COC1 Amb25080580 [0,0,0,1,0,1|2,0,0]=4 5050 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,0,0,1,0,1|1,0,0]=3 5051 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,0,0,1,0,1|2,0,0]=4 5052 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,0,0,1,0,1|2,0,0]=4 5053 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,0,0,1,0,1|2,0,0]=4 5054 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,0,0,1,0,1|1,0,0]=3 5055 B8R1.40 N[C@H](CO)C=C1CC1 Amb25293352 [0,0,0,1,0,1|2,0,0]=4 5056 B8R1.42 CC(=O)CC1(C)CO1 Amb25232199 [0,0,0,1,0,1|2,0,0]=4 5057 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,0,0,1,0,1|2,0,0]=4 5058 B8R1.42 NC1(CC(O)=O)CC1 Amb18833024 [0,0,0,1,0,1|1,0,0]=3 5059 B8R1.42 NC1(CC(O)=O)CC1 Amb21964520 [0,0,0,1,0,1|1,0,0]=3 5060 B8R1.42 OC(=O)CC1(O)CC1 Amb24117238 [0,0,0,1,0,1|2,0,0]=4 5061 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,0,0,1,0,1|2,0,0]=4 5062 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,0,0,1,0,1|2,0,0]=4 5063 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,0,0,1,0,1|2,0,0]=4 5064 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,0,0,1,0,1|2,0,0]=4 5065 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,0,0,1,0,1|2,0,0]=4 5066 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,0,0,1,0,1|2,0,0]=4 5067 B8R1.43 NC(=O)C1OC1CO Amb25351466 [0,0,0,1,0,1|2,0,0]=4 5068 B8R1.43 NC(=O)[C@@H]1O[C@H]1CO Amb25229010 [0,0,0,1,0,1|2,0,0]=4 5069 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,0,0,1,0,1|2,0,0]=4 5070 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,0,0,1,0,1|2,0,0]=4 5071 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,0,0,1,0,1|2,0,0]=4 5072 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,0,0,1,0,1|2,0,0]=4 5073 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,0,0,1,0,1|1,0,0]=3 5074 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,0,0,1,0,1|1,0,0]=3 5075 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,0,0,1,0,1|1,0,0]=3 5076 B8R1.43 [O-]C(=O)C1OC1CO Amb24557010 [0,0,0,1,0,1|1,0,1]=4 5077 B8R1.43 [O-]C(=O)[C@@H]1O[C@H]1CO Amb25215740 [0,0,0,1,0,1|1,0,1]=4 5078 B8R1.43 [O-]C(=O)[C@H]1O[C@@H]1CO Amb24541614 [0,0,0,1,0,1|1,0,1]=4 5079 B8R1.51 NC1COS(=O)(=O)C1 Amb24548196 [0,0,0,1,0,1|1,0,1]=4 5080 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,0,0,1,0,1|2,0,0]=4 5081 B8R1.51 N[C@@H]1COS(=O)(=O)C1 Amb24740749 [0,0,0,1,0,1|1,0,1]=4 5082 B8R1.53 OC[C@@H]1CS(=O)(=O)N1 Amb25306284 [0,0,0,1,0,1|1,0,1]=4 5083 B8R1.62 CC1(CCl)CC(=O)O1 Amb25784185 [0,0,0,1,0,1|2,0,0]=4 5084 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,0,0,1,0,1|2,0,0]=4 5085 B8R1.62 NC1(CC(O)C1)CO Amb24596755 [0,0,0,1,0,1|1,0,1]=4 5086 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,0,0,1,0,1|2,0,0]=4 5087 B8R1.67 CC1C(N)C1C(O)=O Amb25764435 [0,0,0,1,0,1|1,0,0]=3 5088 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,0,0,1,0,1|2,0,0]=4 5089 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,0,0,1,0,1|2,0,0]=4 5090 B8R1.67 C[C@H]1[C@H](N)[C@@H]1C(O)=O Amb24698691 [0,0,0,1,0,1|1,0,0]=3 5091 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|2,0,0]=4 5092 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,1,0,0|2,0,0]=4 5093 B8R1.5 CC1SCCOC1=O Amb25255546 [0,1,0,1,0,0|2,0,0]=4 5094 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,1,0,0|2,0,0]=4 5095 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,1,0,0|2,0,0]=4 5096 B8R1.5 NC1CCOCC1O Amb18198453 [0,1,0,1,0,0|1,0,1]=4 5097 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,1,0,0|1,0,0]=3 5098 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,1,0,0|1,0,0]=3 5099 B8R1.5 NC1COCCC1O Amb18198755 [0,1,0,1,0,0|1,0,1]=4 5100 B8R1.5 N[C@@H]1CCCCC1=O Amb25727179 [0,1,0,1,0,0|2,0,0]=4 5101 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,1,0,0|2,0,0]=4 5102 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,1,0,0|2,0,0]=4 5103 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,1,0,1,0,0|1,0,1]=4 5104 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,1,0,1,0,0|1,0,1]=4 5105 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,1,0,1,0,0|1,0,1]=4 5106 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,1,0,1,0,0|1,0,1]=4 5107 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,1,0,1,0,0|1,0,1]=4 5108 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,1,0,1,0,0|1,0,1]=4 5109 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,1,0,1,0,0|1,0,1]=4 5110 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,1,0,1,0,0|1,0,1]=4 5111 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,1,0,1,0,0|1,0,1]=4 5112 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,1,0,0|2,0,0]=4 5113 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,1,0,0|2,0,0]=4 5114 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,1,0,0|2,0,0]=4 5115 B8R1.5 O=C1CCOC[C@@H]1Cl Amb24723222 [0,1,0,1,0,0|2,0,0]=4 5116 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,1,0,0|2,0,0]=4 5117 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,1,0,0|2,0,0]=4 5118 B8R1.5 O=C1NCCCC1N Amb1088746 [0,1,0,1,0,0|2,0,0]=4 5119 B8R1.5 O=C1NCCC[C@@H]1N Amb10603272 [0,1,0,1,0,0|2,0,0]=4 5120 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,1,0,0|2,0,0]=4 5121 B8R1.5 O=C1OCCCN1N Amb17608306 [0,1,0,1,0,0|2,0,0]=4 5122 B8R1.5 OC1CCCOC1=O Amb19959000 [0,1,0,1,0,0|2,0,0]=4 5123 B8R1.5 OC1COC=CC1=O Amb25094706 [0,1,0,1,0,0|2,0,0]=4 5124 B8R1.5 O[C@@H]1COCCC1=O Amb25086646 [0,1,0,1,0,0|2,0,0]=4 5125 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,1,0,1,0,0|2,0,0]=4 5126 B8R1.7 CC(=O)C1CNCC1 Amb18833067 [0,1,0,1,0,0|2,0,0]=4 5127 B8R1.7 CC(=O)C1CNCC1 Amb22899078 [0,1,0,1,0,0|2,0,0]=4 5128 B8R1.7 CC(=O)C1COCC1 Amb18833038 [0,1,0,1,0,0|2,0,0]=4 5129 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,1,0,1,0,0|2,0,0]=4 5130 B8R1.7 CC(=O)C1NCCS1 Amb25127993 [0,1,0,1,0,0|2,0,0]=4 5131 B8R1.7 ClC(=O)C1CSCN1 Amb17142875 [0,1,0,1,0,0|1,1,0]=4 5132 B8R1.7 NC(=O)C1CC=NN1 Amb24482182 [0,1,0,1,0,0|2,0,0]=4 5133 B8R1.7 NC(=O)C1CCCN1 Amb1152272 [0,1,0,1,0,0|2,0,0]=4 5134 B8R1.7 NC(=O)C1CNCC1 Amb19373271 [0,1,0,1,0,0|2,0,0]=4 5135 B8R1.7 NC(=O)C1COCN1 Amb24740220 [0,1,0,1,0,0|1,0,0]=3 5136 B8R1.7 NC(=O)[C@@H]1CC=NN1 Amb25201424 [0,1,0,1,0,0|2,0,0]=4 5137 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,1,0,1,0,0|2,0,0]=4 5138 B8R1.7 NC(=O)[C@@H]1CCON1 Amb24542870 [0,1,0,1,0,0|1,0,0]=3 5139 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb20671395 [0,1,0,1,0,0|2,0,0]=4 5140 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb22405893 [0,1,0,1,0,0|2,0,0]=4 5141 B8R1.7 NC(=O)[C@@H]1CSCN1 Amb25111427 [0,1,0,1,0,0|1,1,0]=4 5142 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,1,0,1,0,0|2,0,0]=4 5143 B8R1.7 NC(=O)[C@H]1CNCC1 Amb20671394 [0,1,0,1,0,0|2,0,0]=4 5144 B8R1.7 NC(=O)[C@H]1CNCC1 Amb22405894 [0,1,0,1,0,0|2,0,0]=4 5145 B8R1.7 O=C(Cl)[C@H]1CCCN1 Amb24655823 [0,1,0,1,0,0|2,0,0]=4 5146 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|1,0,1]=4 5147 B8R1.7 OC(=O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|1,0,1]=4 5148 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|2,0,0]=4 5149 B8R1.7 OC(=O)C1C=CCS1 Amb18642794 [0,1,0,1,0,0|2,0,0]=4 5150 B8R1.7 OC(=O)C1CC=NN1 Amb18641765 [0,1,0,1,0,0|1,0,0]=3 5151 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [0,1,0,1,0,0|2,0,0]=4 5152 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|1,0,0]=3 5153 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [0,1,0,1,0,0|1,0,0]=3 5154 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|2,0,0]=4 5155 B8R1.7 OC(=O)C1CCNN1 Amb18641878 [0,1,0,1,0,0|1,0,0]=3 5156 B8R1.7 OC(=O)C1CCON1 Amb24351403 [0,1,0,1,0,0|0,0,0]=2 5157 B8R1.7 OC(=O)C1CN=CS1 Amb25829554 [0,1,0,1,0,0|2,0,0]=4 5158 B8R1.7 OC(=O)C1CNC=N1 Amb25247319 [0,1,0,1,0,0|1,0,1]=4 5159 B8R1.7 OC(=O)C1CNCC1 Amb16230724 [0,1,0,1,0,0|1,0,0]=3 5160 B8R1.7 OC(=O)C1CNCC1 Amb16233446 [0,1,0,1,0,0|1,0,0]=3 5161 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [0,1,0,1,0,0|2,0,0]=4 5162 B8R1.7 OC(=O)C1CNOC1 Amb24560626 [0,1,0,1,0,0|0,0,0]=2 5163 B8R1.7 OC(=O)C1CSC=C1 Amb18642796 [0,1,0,1,0,0|1,1,0]=4 5164 B8R1.7 OC(=O)C1CSCC1 Amb18124360 [0,1,0,1,0,0|1,1,0]=4 5165 B8R1.7 OC(=O)C1CSCN1 Amb2549799 [0,1,0,1,0,0|0,1,0]=3 5166 B8R1.7 OC(=O)C1CSSC1 Amb17593735 [0,1,0,1,0,0|1,1,0]=4 5167 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [0,1,0,1,0,0|1,0,0]=3 5168 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [0,1,0,1,0,0|1,0,0]=3 5169 B8R1.7 OC(=O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,0]=3 5170 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|2,0,0]=4 5171 B8R1.7 OC(=O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|2,0,0]=4 5172 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [0,1,0,1,0,0|1,0,1]=4 5173 B8R1.7 OC(=O)C=1CCON1 Amb24353499 [0,1,0,1,0,0|0,0,2]=4 5174 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [0,1,0,1,0,0|1,0,1]=4 5175 B8R1.7 OC(=O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|1,0,1]=4 5176 B8R1.7 OC(=O)[C@@H]1CCC=N1 Amb25075457 [0,1,0,1,0,0|1,0,1]=4 5177 B8R1.7 OC(=O)[C@@H]1COCC1 Amb22226787 [0,1,0,1,0,0|1,0,0]=3 5178 B8R1.7 OC(=O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|0,0,0]=2 5179 B8R1.7 OC(=O)[C@@H]1NCCS1 Amb24383041 [0,1,0,1,0,0|1,0,0]=3 5180 B8R1.7 OC(=O)[C@H]1C=CCN1 Amb19515991 [0,1,0,1,0,0|1,0,1]=4 5181 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [0,1,0,1,0,0|2,0,0]=4 5182 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [0,1,0,1,0,0|2,0,0]=4 5183 B8R1.7 OC(=O)[C@H]1CCSS1 Amb24738509 [0,1,0,1,0,0|1,1,0]=4 5184 B8R1.7 OC(=O)[C@H]1COCC1 Amb10603235 [0,1,0,1,0,0|1,0,0]=3 5185 B8R1.7 OC(=O)[C@H]1COCN1 Amb25733088 [0,1,0,1,0,0|0,0,0]=2 5186 B8R1.7 OC(=O)[C@H]1NCC=C1 Amb16183937 [0,1,0,1,0,0|1,0,1]=4 5187 B8R1.7 OS(=O)C1COCC1 Amb25713371 [0,1,0,1,0,0|2,0,0]=4 5188 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [0,1,0,1,0,0|1,0,0]=3 5189 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [0,1,0,1,0,0|1,0,0]=3 5190 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [0,1,0,1,0,0|1,0,0]=3 5191 B8R1.7 [O-]C(=O)C1CSCN1 Amb10072986 [0,1,0,1,0,0|0,1,1]=4 5192 B8R1.19 CC1(C)CONC1=O Amb21927202 [0,1,0,1,0,0|2,0,0]=4 5193 B8R1.19 CC1(N)CCCC1=O Amb24411535 [0,1,0,1,0,0|2,0,0]=4 5194 B8R1.19 CC1(N)CCNC1=O Amb18124254 [0,1,0,1,0,0|2,0,0]=4 5195 B8R1.19 CC1(N)CCOC1=O Amb24632713 [0,1,0,1,0,0|1,0,0]=3 5196 B8R1.19 CC1(O)COCC1=O Amb24582470 [0,1,0,1,0,0|2,0,0]=4 5197 B8R1.19 O=C1OCCC1(Br)Br Amb25227692 [0,1,0,1,0,0|2,0,0]=4 5198 B8R1.19 O=C1OCCC1(C)C Amb10603955 [0,1,0,1,0,0|2,0,0]=4 5199 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,1,0,1,0,0|2,0,0]=4 5200 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,1,0,1,0,0|2,0,0]=4 5201 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,1,0,1,0,0|2,0,0]=4 5202 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,1,0,1,0,0|2,0,0]=4 5203 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,1,0,1,0,0|2,0,0]=4 5204 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,1,0,1,0,0|1,0,0]=3 5205 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,1,0,1,0,0|2,0,0]=4 5206 B8R1.23 NC(=O)C1CC(O)C1 Amb23570502 [0,1,0,1,0,0|2,0,0]=4 5207 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,1,0,1,0,0|2,0,0]=4 5208 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,1,0,1,0,0|2,0,0]=4 5209 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,1,0,1,0,0|2,0,0]=4 5210 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,1,0,1,0,0|2,0,0]=4 5211 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,1,0,1,0,0|2,0,0]=4 5212 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,1,0,1,0,0|1,0,1]=4 5213 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,1,0,1,0,0|0,0,1]=3 5214 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|2,0,0]=4 5215 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,1,0,1,0,0|0,0,1]=3 5216 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,1,0,1,0,0|2,0,0]=4 5217 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,1,0,1,0,0|1,0,1]=4 5218 B8R1.23 OC1CC(C1)C(=O)Cl Amb24661280 [0,1,0,1,0,0|2,0,0]=4 5219 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,1,0,1,0,0|1,0,0]=3 5220 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,1,0,1,0,0|1,0,0]=3 5221 B8R1.24 CC1(C)C(O)CC1=O Amb24707960 [0,1,0,1,0,0|2,0,0]=4 5222 B8R1.24 OC1CC(=O)C1(Cl)Cl Amb24562337 [0,1,0,1,0,0|2,0,0]=4 5223 B8R1.30 C=C1CC1(N)C(N)=O Amb25239007 [0,1,0,1,0,0|2,0,0]=4 5224 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,1,0,1,0,0|1,0,0]=3 5225 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,1,0,1,0,0|2,0,0]=4 5226 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,1,0,1,0,0|1,0,0]=3 5227 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,1,0,1,0,0|2,0,0]=4 5228 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,1,0,1,0,0|2,0,0]=4 5229 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,1,0,1,0,0|2,0,0]=4 5230 B8R1.30 CC1OC1(C)C(N)=O Amb24482460 [0,1,0,1,0,0|2,0,0]=4 5231 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,1,0,1,0,0|1,0,0]=3 5232 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,1,0,1,0,0|2,0,0]=4 5233 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,1,0,1,0,0|1,0,0]=3 5234 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,1,0,1,0,0|1,0,0]=3 5235 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,1,0,1,0,0|2,0,0]=4 5236 B8R1.30 C[C@@H]1O[C@@]1(C)C(N)=O Amb24760855 [0,1,0,1,0,0|2,0,0]=4 5237 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,1,0,1,0,0|1,0,0]=3 5238 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,1,0,1,0,0|2,0,0]=4 5239 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,1,0,1,0,0|1,0,0]=3 5240 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,1,0,1,0,0|2,0,0]=4 5241 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,1,0,1,0,0|2,0,0]=4 5242 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,1,0,1,0,0|2,0,0]=4 5243 B8R1.30 N[C@@]1(C[C@H]1Cl)C(O)=O Amb22748908 [0,1,0,1,0,0|1,0,0]=3 5244 B8R1.30 N[C@]1(C[C@@H]1Cl)C(O)=O Amb25245700 [0,1,0,1,0,0|1,0,0]=3 5245 B8R1.30 N[C@]1(C[C@H]1Br)C(O)=O Amb24567904 [0,1,0,1,0,0|1,0,0]=3 5246 B8R1.46 C=C1[C@@H](CO)NC1=O Amb25848569 [0,1,0,1,0,0|1,0,0]=3 5247 B8R1.46 CCC1NC(=O)C1=C Amb24713912 [0,1,0,1,0,0|2,0,0]=4 5248 B8R1.46 C[C@@H]1[C@H](CBr)OC1=O Amb24612442 [0,1,0,1,0,0|2,0,0]=4 5249 B8R1.46 C[C@H]1[C@H](CBr)OC1=O Amb24626650 [0,1,0,1,0,0|2,0,0]=4 5250 B8R1.46 NC1C(C#N)NC1=O Amb25315357 [0,1,0,1,0,0|2,0,0]=4 5251 B8R1.46 NC1C(CF)NC1=O Amb25810377 [0,1,0,1,0,0|2,0,0]=4 5252 B8R1.46 N[C@@H]1[C@H](CF)NC1=O Amb25231101 [0,1,0,1,0,0|2,0,0]=4 5253 B8R1.46 OC1C(CO)OC1=O Amb25359586 [0,1,0,1,0,0|1,0,0]=3 5254 B8R1.46 OCC1CC(=O)N1O Amb25143826 [0,1,0,1,0,0|2,0,0]=4 5255 B8R1.46 OC[C@H]1CC(=O)[C@H]1F Amb24602944 [0,1,0,1,0,0|2,0,0]=4 5256 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,1,0,1,0,0|2,0,0]=4 5257 B8R1.54 NC(C1CC1)C(=O)Cl Amb25733572 [0,1,0,1,0,0|2,0,0]=4 5258 B8R1.54 NC(C1CC1)C(N)=O Amb18282442 [0,1,0,1,0,0|2,0,0]=4 5259 B8R1.54 NC(C1CC1)C(O)=O Amb19515010 [0,1,0,1,0,0|1,0,0]=3 5260 B8R1.54 N[C@@H](C1CC1)C(O)=O Amb19929447 [0,1,0,1,0,0|1,0,0]=3 5261 B8R1.54 OC(=O)C(Br)C1CC1 Amb24634830 [0,1,0,1,0,0|2,0,0]=4 5262 B8R1.54 OC(=O)C(Cl)C1CC1 Amb24333436 [0,1,0,1,0,0|2,0,0]=4 5263 B8R1.54 OC(C1CC1)C(O)=O Amb18282441 [0,1,0,1,0,0|2,0,0]=4 5264 B8R1.54 O[C@@H](C1CC1)C(O)=O Amb25312037 [0,1,0,1,0,0|2,0,0]=4 5265 B8R1.54 O[C@H](C1CC1)C(O)=O Amb25715899 [0,1,0,1,0,0|2,0,0]=4 5266 B8R1.78 CC(=O)C1(C)COC1 Amb22406104 [0,1,0,1,0,0|2,0,0]=4 5267 B8R1.78 CC1(CCN1)C(O)=O Amb24483061 [0,1,0,1,0,0|1,0,0]=3 5268 B8R1.78 CC1(CCO1)C(O)=O Amb22001906 [0,1,0,1,0,0|1,0,0]=3 5269 B8R1.78 CC1(CNC1)C(O)=O Amb24077476 [0,1,0,1,0,0|2,0,0]=4 5270 B8R1.78 CC1(CNC1)C(O)=O Amb24561978 [0,1,0,1,0,0|2,0,0]=4 5271 B8R1.78 CC1(CSC1)C(O)=O Amb21960451 [0,1,0,1,0,0|1,1,0]=4 5272 B8R1.78 C[C@]1(CCN1)C(O)=O Amb25726906 [0,1,0,1,0,0|1,0,0]=3 5273 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [0,1,0,1,0,0|2,0,0]=4 5274 B8R1.78 NC(=O)C1(N)CCC1 Amb22137941 [0,1,0,1,0,0|2,0,0]=4 5275 B8R1.78 NC(=O)C1(N)COC1 Amb24483241 [0,1,0,1,0,0|1,0,0]=3 5276 B8R1.78 NC1(CCC1)C(=O)Cl Amb24567984 [0,1,0,1,0,0|2,0,0]=4 5277 B8R1.78 NC1(CNC1)C(O)=O Amb19895006 [0,1,0,1,0,0|1,0,0]=3 5278 B8R1.78 NC1(CNC1)C(O)=O Amb21960937 [0,1,0,1,0,0|1,0,0]=3 5279 B8R1.78 NC1(COC1)C(O)=O Amb18199133 [0,1,0,1,0,0|0,0,0]=2 5280 B8R1.78 NC1(CSC1)C(O)=O Amb21927718 [0,1,0,1,0,0|0,1,0]=3 5281 B8R1.78 OC(=O)C1(C)CCC1 Amb10843968 [0,1,0,1,0,0|2,0,0]=4 5282 B8R1.78 OC(=O)C1(C)COC1 Amb13883560 [0,1,0,1,0,0|1,0,0]=3 5283 B8R1.78 OC(=O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|2,0,0]=4 5284 B8R1.78 OC(=O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|2,0,0]=4 5285 B8R1.78 OC(=O)C1(F)CNC1 Amb23440120 [0,1,0,1,0,0|2,0,0]=4 5286 B8R1.78 OC(=O)C1(F)COC1 Amb24541298 [0,1,0,1,0,0|1,0,0]=3 5287 B8R1.78 OC(=O)C1(O)CNC1 Amb24122891 [0,1,0,1,0,0|2,0,0]=4 5288 B8R1.78 OC(=O)C1(O)COC1 Amb25714262 [0,1,0,1,0,0|1,0,0]=3 5289 B8R1.78 OC(=O)C1(O)CSC1 Amb25259612 [0,1,0,1,0,0|1,1,0]=4 5290 B8R1.11 C=C1OC=CC1CO Amb25115945 [0,1,0,1,0,0|2,0,0]=4 5291 B8R1.11 CCC1CCOC1=O Amb23538353 [0,1,0,1,0,0|2,0,0]=4 5292 B8R1.11 CCC1NCCC1=O Amb18833066 [0,1,0,1,0,0|2,0,0]=4 5293 B8R1.11 CNC1CCNC1=O Amb22059501 [0,1,0,1,0,0|2,0,0]=4 5294 B8R1.11 CNC1COCC1O Amb18944293 [0,1,0,1,0,0|1,0,1]=4 5295 B8R1.11 CNC1CONC1=O Amb24120339 [0,1,0,1,0,0|1,0,0]=3 5296 B8R1.11 CN[C@@H]1COC[C@@H]1O Amb24700231 [0,1,0,1,0,0|1,0,1]=4 5297 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22748628 [0,1,0,1,0,0|1,0,1]=4 5298 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22757852 [0,1,0,1,0,0|1,0,1]=4 5299 B8R1.11 CN[C@H]1CCSC1=O Amb25367035 [0,1,0,1,0,0|1,1,0]=4 5300 B8R1.11 CN[C@H]1COC[C@@H]1O Amb10608328 [0,1,0,1,0,0|1,0,1]=4 5301 B8R1.11 CN[C@H]1COC[C@H]1O Amb22230434 [0,1,0,1,0,0|1,0,1]=4 5302 B8R1.11 COC1COCC1N Amb17606146 [0,1,0,1,0,0|1,0,1]=4 5303 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb22757962 [0,1,0,1,0,0|1,0,1]=4 5304 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb24539352 [0,1,0,1,0,0|1,0,1]=4 5305 B8R1.11 CO[C@@H]1COC[C@H]1N Amb22757840 [0,1,0,1,0,0|1,0,1]=4 5306 B8R1.11 CO[C@@H]1COC[C@H]1N Amb23438206 [0,1,0,1,0,0|1,0,1]=4 5307 B8R1.11 CO[C@H]1COC[C@@H]1N Amb10608202 [0,1,0,1,0,0|1,0,1]=4 5308 B8R1.11 CO[C@H]1COC[C@H]1N Amb25683516 [0,1,0,1,0,0|1,0,1]=4 5309 B8R1.11 N#CC1COCC1=O Amb24183529 [0,1,0,1,0,0|1,0,1]=4 5310 B8R1.11 NC1COCC1CO Amb24581733 [0,1,0,1,0,0|1,0,1]=4 5311 B8R1.11 NCC1CCCC1=O Amb18833069 [0,1,0,1,0,0|2,0,0]=4 5312 B8R1.11 NCC1CCNC1=O Amb18833033 [0,1,0,1,0,0|2,0,0]=4 5313 B8R1.11 NCC1CNCC1=O Amb25168729 [0,1,0,1,0,0|2,0,0]=4 5314 B8R1.11 NCC1COCC1O Amb25728184 [0,1,0,1,0,0|1,0,1]=4 5315 B8R1.11 NCC1CSCC1=O Amb24529601 [0,1,0,1,0,0|1,1,0]=4 5316 B8R1.11 NCN1CCOC1=O Amb25662499 [0,1,0,1,0,0|2,0,0]=4 5317 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb23439671 [0,1,0,1,0,0|1,0,1]=4 5318 B8R1.11 NC[C@@H]1COC[C@H]1O Amb23439670 [0,1,0,1,0,0|1,0,1]=4 5319 B8R1.11 NC[C@@H]1COC[C@H]1O Amb25277795 [0,1,0,1,0,0|1,0,1]=4 5320 B8R1.11 NC[C@H]1COC[C@H]1O Amb25351472 [0,1,0,1,0,0|1,0,1]=4 5321 B8R1.11 NNC1COCC1O Amb24706024 [0,1,0,1,0,0|1,0,1]=4 5322 B8R1.11 NN[C@@H]1COC[C@H]1O Amb24567848 [0,1,0,1,0,0|1,0,1]=4 5323 B8R1.11 N\C=C/1\CCOC1=O Amb24575038 [0,1,0,1,0,0|1,0,1]=4 5324 B8R1.11 O=C1OCCC1CCl Amb24649714 [0,1,0,1,0,0|2,0,0]=4 5325 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,1,0,1,0,0|2,0,0]=4 5326 B8R1.11 OC1CCNC1CO Amb18641923 [0,1,0,1,0,0|1,0,1]=4 5327 B8R1.11 OC1CCNC1CO Amb24117910 [0,1,0,1,0,0|1,0,1]=4 5328 B8R1.11 OC1CNCC1CO Amb22587601 [0,1,0,1,0,0|1,0,1]=4 5329 B8R1.11 OC1CNNC1CO Amb24711850 [0,1,0,1,0,0|1,0,1]=4 5330 B8R1.11 OCC1=CCOC1=O Amb25286254 [0,1,0,1,0,0|1,0,1]=4 5331 B8R1.11 OCC1CCCC1=O Amb22491993 [0,1,0,1,0,0|2,0,0]=4 5332 B8R1.11 OCC1CCNC1=O Amb22749924 [0,1,0,1,0,0|2,0,0]=4 5333 B8R1.11 OCC1CCSC1=O Amb17593391 [0,1,0,1,0,0|1,1,0]=4 5334 B8R1.11 OCC1N=COC1=O Amb24511756 [0,1,0,1,0,0|0,0,1]=3 5335 B8R1.11 OCC1NCCC1=O Amb25189929 [0,1,0,1,0,0|1,0,0]=3 5336 B8R1.11 OCN1N=COC1=O Amb25120122 [0,1,0,1,0,0|1,0,1]=4 5337 B8R1.11 OC[C@@H]1CCOC1=O Amb24423403 [0,1,0,1,0,0|1,0,0]=3 5338 B8R1.11 OC[C@@H]1NCCC1=O Amb25202333 [0,1,0,1,0,0|1,0,0]=3 5339 B8R1.11 OC[C@@H]1OC=CC1=O Amb17678799 [0,1,0,1,0,0|2,0,0]=4 5340 B8R1.11 OC[C@H]1OC=CC1=O Amb25319926 [0,1,0,1,0,0|2,0,0]=4 5341 B8R1.11 O[C@@H]1CCN[C@H]1CO Amb25327371 [0,1,0,1,0,0|1,0,1]=4 5342 B8R1.11 O[C@@H]1CNC[C@@H]1CO Amb22757874 [0,1,0,1,0,0|1,0,1]=4 5343 B8R1.11 O[C@@H]1CNC[C@H]1CO Amb22757877 [0,1,0,1,0,0|1,0,1]=4 5344 B8R1.11 O[C@@H]1CNC[C@H]1CO Amb24573013 [0,1,0,1,0,0|1,0,1]=4 5345 B8R1.11 O[C@H]1CNC[C@H]1CO Amb24697864 [0,1,0,1,0,0|1,0,1]=4 5346 B8R1.11 O[C@H]1CNN[C@@H]1CO Amb24550596 [0,1,0,1,0,0|1,0,1]=4 5347 B8R1.25 OC1C(O)C(=O)C1=O Amb1211924 [0,1,0,1,0,0|1,0,1]=4 5348 B8R1.38 CNC(=O)C1CCN1 Amb24452000 [0,1,0,1,0,0|2,0,0]=4 5349 B8R1.38 CNC(=O)C1COC1 Amb25189024 [0,1,0,1,0,0|2,0,0]=4 5350 B8R1.38 CNC(=O)[C@@H]1CCN1 Amb25745110 [0,1,0,1,0,0|2,0,0]=4 5351 B8R1.38 COC(=O)C1CCN1 Amb20243415 [0,1,0,1,0,0|1,0,0]=3 5352 B8R1.38 COC(=O)C1CCN1 Amb22757529 [0,1,0,1,0,0|1,0,0]=3 5353 B8R1.38 COC(=O)C1CCO1 Amb22736125 [0,1,0,1,0,0|2,0,0]=4 5354 B8R1.38 COC(=O)C1CNC1 Amb10604008 [0,1,0,1,0,0|2,0,0]=4 5355 B8R1.38 COC(=O)C1CNC1 Amb13883580 [0,1,0,1,0,0|2,0,0]=4 5356 B8R1.38 COC(=O)C1COC1 Amb21927994 [0,1,0,1,0,0|1,0,0]=3 5357 B8R1.38 COC(=O)C1COC1 Amb21961760 [0,1,0,1,0,0|1,0,0]=3 5358 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,0]=3 5359 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,0]=3 5360 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,0]=3 5361 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,0]=3 5362 B8R1.38 N=C(NO)C1COC1 Amb17933805 [0,1,0,1,0,0|2,0,0]=4 5363 B8R1.38 N[C@@H](CO)C1COC1 Amb25689732 [0,1,0,1,0,0|1,0,1]=4 5364 B8R1.38 N[C@H](CO)C1COC1 Amb25114651 [0,1,0,1,0,0|1,0,1]=4 5365 B8R1.38 ONC(=O)C1CCO1 Amb25295628 [0,1,0,1,0,0|2,0,0]=4 5366 B8R1.38 ONC(=O)C1CNC1 Amb25684724 [0,1,0,1,0,0|2,0,0]=4 5367 B8R1.38 ONC(=O)C1COC1 Amb24557050 [0,1,0,1,0,0|1,0,0]=3 5368 B8R1.39 C#CC(=O)C1(N)CC1 Amb25104611 [0,1,0,1,0,0|2,0,0]=4 5369 B8R1.39 C=CC(=O)C1(N)CC1 Amb25081556 [0,1,0,1,0,0|2,0,0]=4 5370 B8R1.39 CC1(CC1)C(=O)NO Amb24541600 [0,1,0,1,0,0|2,0,0]=4 5371 B8R1.39 CCC(=O)C1(C)CO1 Amb25074177 [0,1,0,1,0,0|2,0,0]=4 5372 B8R1.39 COC(=O)C1(Br)CC1 Amb19888923 [0,1,0,1,0,0|2,0,0]=4 5373 B8R1.39 COC(=O)C1(C)CC1 Amb10604239 [0,1,0,1,0,0|2,0,0]=4 5374 B8R1.39 COC(=O)C1(C)CO1 Amb17672313 [0,1,0,1,0,0|1,0,0]=3 5375 B8R1.39 COC(=O)C1(C)CS1 Amb25187795 [0,1,0,1,0,0|1,1,0]=4 5376 B8R1.39 COC(=O)C1(N)CC1 Amb10069999 [0,1,0,1,0,0|1,0,0]=3 5377 B8R1.39 COC(=O)C1(N)CC1 Amb10844951 [0,1,0,1,0,0|1,0,0]=3 5378 B8R1.39 COC(=O)C1(N)CC1 Amb17607966 [0,1,0,1,0,0|1,0,0]=3 5379 B8R1.39 NC1(CC1)C(=O)NO Amb24453446 [0,1,0,1,0,0|1,0,0]=3 5380 B8R1.44 N[C@]1(C[C@H]1CO)CO Amb25368322 [0,1,0,1,0,0|1,0,1]=4 5381 B8R1.50 C=C1C(N)COC1=O Amb18641720 [0,1,0,1,0,0|1,0,0]=3 5382 B8R1.50 C=C1[C@@H](N)COC1=O Amb24744705 [0,1,0,1,0,0|1,0,0]=3 5383 B8R1.50 C=C1[C@@H](O)COC1=O Amb24435902 [0,1,0,1,0,0|1,0,1]=4 5384 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,1,0,1,0,0|1,0,1]=4 5385 B8R1.50 CC1C(O)CNC1=O Amb24441657 [0,1,0,1,0,0|2,0,0]=4 5386 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,1,0,1,0,0|1,0,0]=3 5387 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|2,0,0]=4 5388 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,1,0,1,0,0|2,0,0]=4 5389 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,1,0,1,0,0|1,0,0]=3 5390 B8R1.50 CC1CSC(=O)C1N Amb25169595 [0,1,0,1,0,0|1,1,0]=4 5391 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,1,0,1,0,0|1,0,0]=3 5392 B8R1.50 CC1ONC(=O)C1N Amb25063865 [0,1,0,1,0,0|1,0,0]=3 5393 B8R1.50 CC1SOC(=O)C1N Amb24665733 [0,1,0,1,0,0|0,1,0]=3 5394 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,1,0,1,0,0|1,0,1]=4 5395 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,1,0,1,0,0|2,0,0]=4 5396 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,1,0,1,0,0|2,0,0]=4 5397 B8R1.50 CN1OC[C@@H](N)C1=O Amb25703607 [0,1,0,1,0,0|1,0,0]=3 5398 B8R1.50 CN1SCC(N)C1=O Amb25230901 [0,1,0,1,0,0|1,1,0]=4 5399 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,1,0,1,0,0|1,0,0]=3 5400 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,1,0,1,0,0|1,0,0]=3 5401 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,1,0,1,0,0|1,0,0]=3 5402 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,1,0,1,0,0|1,0,1]=4 5403 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,1,0,1,0,0|2,0,0]=4 5404 B8R1.50 C[C@H]1ONC(=O)[C@H]1N Amb24514974 [0,1,0,1,0,0|1,0,0]=3 5405 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,1,0,1,0,0|1,0,1]=4 5406 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,1,0,1,0,0|2,0,0]=4 5407 B8R1.50 NC1C(N)CNC1=O Amb18641832 [0,1,0,1,0,0|2,0,0]=4 5408 B8R1.50 NC1C(O)C=CC1O Amb25695094 [0,1,0,1,0,0|1,0,1]=4 5409 B8R1.50 NC1C(O)CCC1O Amb24381348 [0,1,0,1,0,0|1,0,1]=4 5410 B8R1.50 NC1C(O)CNC1=O Amb24374633 [0,1,0,1,0,0|1,0,0]=3 5411 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,1,0,1,0,0|0,0,0]=2 5412 B8R1.50 NC1CNC(=O)C1O Amb24481564 [0,1,0,1,0,0|1,0,1]=4 5413 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,1,0,1,0,0|0,0,1]=3 5414 B8R1.50 NC1[C@@H](O)CC[C@@H]1O Amb24515534 [0,1,0,1,0,0|1,0,1]=4 5415 B8R1.50 NC1[C@H](O)CC[C@H]1O Amb24566623 [0,1,0,1,0,0|1,0,1]=4 5416 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,1,0,0|1,0,0]=3 5417 B8R1.50 N[C@@H]1[C@@H](O)C=C[C@H]1O Amb24481487 [0,1,0,1,0,0|1,0,1]=4 5418 B8R1.50 N[C@@H]1[C@@H](O)CC[C@H]1O Amb25041662 [0,1,0,1,0,0|1,0,1]=4 5419 B8R1.50 N[C@@H]1[C@@H](O)CNC1=O Amb24612410 [0,1,0,1,0,0|1,0,0]=3 5420 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,1,0,1,0,0|0,0,0]=2 5421 B8R1.50 N[C@@H]1[C@H](O)COC1O Amb25174437 [0,1,0,1,0,0|0,0,2]=4 5422 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,1,0,0|1,0,0]=3 5423 B8R1.50 N[C@H]1CNC(=O)[C@@H]1O Amb24612411 [0,1,0,1,0,0|1,0,1]=4 5424 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,1,0,1,0,0|0,0,0]=2 5425 B8R1.50 N[C@H]1[C@H](N)CNC1=O Amb24566659 [0,1,0,1,0,0|2,0,0]=4 5426 B8R1.50 N[C@H]1[C@H](O)COC1O Amb25366114 [0,1,0,1,0,0|0,0,2]=4 5427 B8R1.50 O=C1C(Br)COC1=O Amb25760646 [0,1,0,1,0,0|1,0,1]=4 5428 B8R1.50 O=C1C(N)CCN1C Amb10607857 [0,1,0,1,0,0|2,0,0]=4 5429 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,1,0,1,0,0|1,0,1]=4 5430 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,1,0,1,0,0|1,0,0]=3 5431 B8R1.50 OC1C=CC(=O)C1Br Amb24398644 [0,1,0,1,0,0|2,0,0]=4 5432 B8R1.50 OC1C=CC(=O)C1O Amb25285676 [0,1,0,1,0,0|2,0,0]=4 5433 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,1,0,1,0,0|2,0,0]=4 5434 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,1,0,1,0,0|1,0,0]=3 5435 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,1,0,1,0,0|1,0,0]=3 5436 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,1,0,1,0,0|1,0,1]=4 5437 B8R1.50 O[C@@H]1C=CC(=O)[C@H]1Br Amb25273749 [0,1,0,1,0,0|2,0,0]=4 5438 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,1,0,1,0,0|1,0,0]=3 5439 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,1,0,1,0,0|1,0,0]=3 5440 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,1,0,1,0,0|1,0,1]=4 5441 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,1,0,1,0,0|1,0,0]=3 5442 B8R1.58 CC1(CO)CCC1=O Amb24380838 [0,1,0,1,0,0|2,0,0]=4 5443 B8R1.58 C[C@@]1(CO)COC1=O Amb25763988 [0,1,0,1,0,0|1,0,0]=3 5444 B8R1.63 C#CC1(CC1)C(O)=O Amb24560584 [0,1,0,1,0,0|2,0,0]=4 5445 B8R1.63 CC(=O)C1(CN)CC1 Amb24453598 [0,1,0,1,0,0|2,0,0]=4 5446 B8R1.63 CC(=O)C1(CO)CC1 Amb24481444 [0,1,0,1,0,0|2,0,0]=4 5447 B8R1.63 CC(=O)C1(CO)CO1 Amb25344995 [0,1,0,1,0,0|2,0,0]=4 5448 B8R1.63 CCC1(CC1)C(O)=O Amb18560530 [0,1,0,1,0,0|2,0,0]=4 5449 B8R1.63 CCC1(CO1)C(C)=O Amb24754014 [0,1,0,1,0,0|2,0,0]=4 5450 B8R1.63 CC[C@]1(CO1)C(C)=O Amb24417183 [0,1,0,1,0,0|2,0,0]=4 5451 B8R1.63 CNC1(CC1)C(O)=O Amb22757078 [0,1,0,1,0,0|1,0,0]=3 5452 B8R1.63 COC1(CC1)C(O)=O Amb24358755 [0,1,0,1,0,0|2,0,0]=4 5453 B8R1.63 CSC1(CC1)C(O)=O Amb24481335 [0,1,0,1,0,0|2,0,0]=4 5454 B8R1.63 NCC1(CC1)C(=O)O Amb10607863 [0,1,0,1,0,0|1,0,0]=3 5455 B8R1.63 NCC1(CC1)C(N)=O Amb22741302 [0,1,0,1,0,0|2,0,0]=4 5456 B8R1.63 NCC1(CC1)C(O)=O Amb21959700 [0,1,0,1,0,0|1,0,0]=3 5457 B8R1.63 OC(=O)C1(CCl)CO1 Amb25702443 [0,1,0,1,0,0|1,0,0]=3 5458 B8R1.63 OC(=O)C1(CF)CC1 Amb24054902 [0,1,0,1,0,0|2,0,0]=4 5459 B8R1.63 OC(=O)[C@@]1(CCl)CO1 Amb25113608 [0,1,0,1,0,0|1,0,0]=3 5460 B8R1.63 OCC1(CC1)C(=O)N Amb10608173 [0,1,0,1,0,0|2,0,0]=4 5461 B8R1.63 OCC1(CC1)C(=O)O Amb15701269 [0,1,0,1,0,0|1,0,0]=3 5462 B8R1.55 OP(O)(=O)C1CCN1 Amb24481363 [0,1,0,1,0,0|2,0,0]=4 5463 B8R1.16 CC1NC(=O)C1CN Amb24374940 [0,1,0,1,0,0|2,0,0]=4 5464 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,1,0,1,0,0|1,0,0]=3 5465 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,1,0,1,0,0|2,0,0]=4 5466 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,1,0,1,0,0|2,0,0]=4 5467 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,1,0,1,0,0|2,0,0]=4 5468 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,1,0,1,0,0|2,0,0]=4 5469 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,1,0,1,0,0|2,0,0]=4 5470 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,1,0,1,0,0|2,0,0]=4 5471 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|2,0,0]=4 5472 B8R2.38 O=C1OCC2OC12 Amb24061718 [0,0,0,2,0,0|2,0,0]=4 5473 B8R2.5 O=C1OC2C=CC12 Amb24751511 [0,0,0,2,0,0|2,0,0]=4 5474 B8R2.66 OC(=O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|2,0,0]=4 5475 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,0,0,0,0,2|1,0,1]=4 5476 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,0,0,0,0,2|1,0,1]=4 5477 B8R0.9 C=CC(N)\C=C\C(O)=O Amb18642503 [0,0,0,0,0,2|1,0,1]=4 5478 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,0,0,0,0,2|1,0,1]=4 5479 B8R0.9 CC(=C)CCC(N)CO Amb25775333 [0,0,0,0,0,2|2,0,0]=4 5480 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,0,0,0,0,2|2,0,0]=4 5481 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,0,0,0,2|2,0,0]=4 5482 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,0,0,0,0,2|1,0,0]=3 5483 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,0,0,0,0,2|1,0,0]=3 5484 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,0,0,0,0,2|2,0,0]=4 5485 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,0,0,0,0,2|2,0,0]=4 5486 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,0,0,0,0,2|1,0,0]=3 5487 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,0,0,0,0,2|2,0,0]=4 5488 B8R0.9 CC(=O)\C=C/[C@H](O)CO Amb25735081 [0,0,0,0,0,2|2,0,0]=4 5489 B8R0.9 CC(C)=CCC(N)CO Amb25320777 [0,0,0,0,0,2|2,0,0]=4 5490 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,0,0,0,0,2|2,0,0]=4 5491 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,0,0,0,0,2|2,0,0]=4 5492 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,0,0,0,0,2|2,0,0]=4 5493 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,0,0,0,0,2|2,0,0]=4 5494 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,0,0,0,0,2|2,0,0]=4 5495 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,0,0,0,0,2|2,0,0]=4 5496 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,0,0,0,0,2|1,0,0]=3 5497 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,0,0,0,0,2|2,0,0]=4 5498 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,0,0,0,0,2|1,0,0]=3 5499 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,0,0,0,0,2|2,0,0]=4 5500 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,0,0,0,0,2|2,0,0]=4 5501 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,0,0,0,0,2|2,0,0]=4 5502 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,0,0,0,0,2|2,0,0]=4 5503 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,0,0,0,0,2|2,0,0]=4 5504 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,0,0,0,0,2|1,0,0]=3 5505 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,0,0,0,0,2|2,0,0]=4 5506 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,0,0,0,0,2|2,0,0]=4 5507 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,0,0,0,0,2|2,0,0]=4 5508 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,0,0,0,0,2|2,0,0]=4 5509 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,0,0,0,0,2|2,0,0]=4 5510 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,0,0,0,0,2|1,0,0]=3 5511 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,0,0,0,0,2|2,0,0]=4 5512 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,0,0,0,0,2|2,0,0]=4 5513 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,0,0,0,0,2|2,0,0]=4 5514 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,0,0,0,0,2|1,0,0]=3 5515 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,0,0,0,0,2|2,0,0]=4 5516 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,0,0,0,0,2|2,0,0]=4 5517 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,0,0,0,0,2|2,0,0]=4 5518 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,0,0,0,0,2|2,0,0]=4 5519 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,0,0,0,0,2|2,0,0]=4 5520 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,0,0,0,0,2|2,0,0]=4 5521 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,0,0,0,0,2|2,0,0]=4 5522 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,0,0,0,0,2|1,0,1]=4 5523 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,0,0,0,0,2|0,0,0]=2 5524 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,0,0,0,0,2|2,0,0]=4 5525 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,0,0,0,0,2|1,0,0]=3 5526 B8R0.9 NC(NCC(O)=O)=NO Amb24568694 [0,0,0,0,0,2|1,0,1]=4 5527 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,0,0,0,0,2|1,0,0]=3 5528 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,0,0,0,0,2|2,0,0]=4 5529 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,0,0,0,0,2|2,0,0]=4 5530 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,0,0,0,0,2|0,0,2]=4 5531 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,0,0,0,0,2|0,0,0]=2 5532 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,0,0,0,0,2|1,0,1]=4 5533 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,0,0,0,0,2|0,0,0]=2 5534 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,0,0,0,0,2|1,0,0]=3 5535 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,0,0,0,0,2|1,0,0]=3 5536 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,0,0,0,0,2|0,1,0]=3 5537 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,0,0,0,0,2|1,0,1]=4 5538 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,0,0,0,0,2|2,0,0]=4 5539 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,0,0,0,0,2|1,0,1]=4 5540 B8R0.9 OC(=O)\C=C\C(=O)CO Amb18642735 [0,0,0,0,0,2|1,0,1]=4 5541 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,0,0,0,0,2|2,0,0]=4 5542 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,0,0,0,0,2|1,0,0]=3 5543 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,0,0,0,0,2|2,0,0]=4 5544 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,0,0,0,0,2|1,0,0]=3 5545 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,0,0,0,0,2|1,0,0]=3