0 B7R0.16 C=C(Br)C(C)C(C)O Amb27978585 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.16 C=C(Br)[C@@H](O)[C@@H](C)O Amb28321601 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,0,0,0,0,0|2,0,1]=3 4 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.16 C=C(C(=O)O)C(F)F Amb24117234 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,0,0,0,0,0|1,0,1]=2 9 B7R0.16 C=C(C(C)=O)[C@@H](C)O Amb26964906 [0,0,0,0,0,0|2,0,1]=3 10 B7R0.16 C=C(C(C)=O)[C@H](C)O Amb27424236 [0,0,0,0,0,0|2,0,1]=3 11 B7R0.16 C=C(C(C)O)S(C)=O Amb27487029 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,0,0,0,0,0|2,0,2]=4 13 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,0,0,0,0,0|2,0,1]=3 14 B7R0.16 C=C(C)C(C)C(C)O Amb28045615 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.16 C=C(C)C(Cl)C(C)=O Amb27633869 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.16 C=C(C)C(N)C(=C)O Amb27762325 [0,0,0,0,0,0|2,0,1]=3 18 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,0,0,0,0,0|1,0,1]=2 19 B7R0.16 C=C(C)C(N)C(C)C Amb18641748 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.16 C=C(C)C(N)C(F)F Amb24720668 [0,0,0,0,0,0|4,0,0]=4 21 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,0,0,0,0,0|2,0,1]=3 22 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.16 C=C(C)C(O)[C@@H](C)N Amb30024548 [0,0,0,0,0,0|4,0,0]=4 24 B7R0.16 C=C(C)C(O)[C@H](C)N Amb35737780 [0,0,0,0,0,0|4,0,0]=4 25 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,0,0,0,0,0|1,0,1]=2 26 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,0,0,0,0,0|2,0,1]=3 27 B7R0.16 C=C(C)[C@@H](O)[C@@H](C)N Amb27247074 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.16 C=C(C)[C@@H](O)[C@H](C)N Amb27817851 [0,0,0,0,0,0|4,0,0]=4 29 B7R0.16 C=C(C)[C@H](O)[C@@H](C)O Amb27980717 [0,0,0,0,0,0|3,0,0]=3 30 B7R0.16 CC(=N)C(C)C(C)=O Amb28315572 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,0,0,0,0,0|1,0,3]=4 32 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,0,0,0,0,0|2,0,2]=4 35 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,0,0,0,0,0|3,0,0]=3 36 B7R0.16 CC(=O)C(Br)C(C)Cl Amb27791473 [0,0,0,0,0,0|3,0,0]=3 37 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [0,0,0,0,0,0|2,0,2]=4 38 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [0,0,0,0,0,0|2,0,2]=4 39 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,0,0,0,0,0|2,0,0]=2 40 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,0,0,0,0,0|2,0,0]=2 41 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [0,0,0,0,0,0|2,0,2]=4 42 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,0,0,0,0,0|3,0,0]=3 43 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,0,0,0,0,0|0,0,2]=2 45 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,0,0,0,0,0|1,0,2]=3 46 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,0,0,0,0,0|1,0,2]=3 47 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,0,0,0,0,0|2,0,0]=2 48 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [0,0,0,0,0,0|2,0,2]=4 49 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,0,0,0,0,0|3,0,0]=3 50 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,0,0,0,0,0|2,0,0]=2 51 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,0,0,0,0,0|3,0,0]=3 52 B7R0.16 CC(=O)N(C)C(C)C Amb28435200 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.16 CC(=O)N(N)C(C)C Amb18641904 [0,0,0,0,0,0|3,0,0]=3 54 B7R0.16 CC(=O)[C@@H](C)[C@@H](C)Cl Amb28325873 [0,0,0,0,0,0|3,0,0]=3 55 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,0,0,0,0,0|2,0,0]=2 56 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,0,0,0,0,0|2,0,0]=2 57 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,0,0,0,0,0|2,0,0]=2 58 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,0,0,0,0,0|2,0,0]=2 59 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,0,0,0,0,0|3,0,0]=3 60 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,0,0,0,0,0|2,0,0]=2 61 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,0,0,0,0,0|3,0,0]=3 62 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,0,0,0,0,0|2,0,0]=2 63 B7R0.16 CC(=O)\C(F)=C(/C)O Amb28384212 [0,0,0,0,0,0|2,0,2]=4 64 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,0,0,0,0,0|1,0,2]=3 65 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,0,0,0,0,0|1,1,1]=3 66 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,0,0,0,0,0|2,0,1]=3 67 B7R0.16 CC(Br)C(Br)C(=O)Cl Amb27482606 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,0,0,0,0,0|2,0,0]=2 69 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,0,0,0,0,0|2,0,1]=3 70 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,0,0,0,0,0|3,0,0]=3 72 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,0,0,0,0,0|3,0,0]=3 73 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,0,0,0,0,0|1,0,1]=2 74 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,0,0,0,0,0|2,0,2]=4 75 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,0,0,0,0,0|2,0,2]=4 76 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,0,0,0,0,0|2,0,2]=4 77 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,0,0,0,0,0|2,0,2]=4 78 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,0,0,0,0,0|1,0,2]=3 80 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,0,0,0,0,0|3,0,1]=4 81 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,0,0,0,0,0|2,0,1]=3 82 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,0,0,0,0,0|2,0,2]=4 84 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.16 CC(C)C(Br)C(=N)N Amb28285546 [0,0,0,0,0,0|4,0,0]=4 86 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,0,0,0,0,0|3,0,0]=3 87 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,0,0,0,0,0|2,0,0]=2 88 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,0,0,0,0,0|3,0,0]=3 89 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,0,0,0,0,0|3,0,0]=3 90 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,0,0,0,0,0|2,0,0]=2 91 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,0,0,0,0,0|3,0,1]=4 92 B7R0.16 CC(C)C(C)C(N)=S Amb28400471 [0,0,0,0,0,0|3,1,0]=4 93 B7R0.16 CC(C)C(C)S(=O)Cl Amb32720503 [0,0,0,0,0,0|4,0,0]=4 94 B7R0.16 CC(C)C(C)S(=O)[O-] Amb25685559 [0,0,0,0,0,0|3,0,1]=4 95 B7R0.16 CC(C)C(C)S(N)=O Amb32720504 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,0,0,0,0,0|3,0,0]=3 97 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,0,0,0,0,0|2,0,0]=2 98 B7R0.16 CC(C)C(F)C(=N)N Amb32456108 [0,0,0,0,0,0|4,0,0]=4 99 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,0,0,0,0,0|2,0,0]=2 100 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,0,0,0,0,0|2,0,0]=2 102 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,0,0,0,0,0|1,0,0]=1 103 B7R0.16 CC(C)C(N)C(C)C Amb20668320 [0,0,0,0,0,0|3,0,1]=4 104 B7R0.16 CC(C)C(N)C(C)C Amb4017840 [0,0,0,0,0,0|3,0,1]=4 105 B7R0.16 CC(C)C(N)C(C)N Amb26334235 [0,0,0,0,0,0|3,0,1]=4 106 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,0,0,0,0,0|2,0,1]=3 107 B7R0.16 CC(C)C(N)C(C)S Amb32788400 [0,0,0,0,0,0|2,1,1]=4 108 B7R0.16 CC(C)C(N)C(F)F Amb24054178 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.16 CC(C)C(N)C(F)F Amb28401287 [0,0,0,0,0,0|3,0,1]=4 110 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,0,0,0,0,0|2,0,0]=2 111 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,0,0,0,0,0|2,0,0]=2 112 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,0,0,0,0,0|2,0,0]=2 113 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,0,0,0,0,0|2,1,0]=3 114 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,0,0,0,0,0|3,0,0]=3 115 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,0,0,0,0,0|2,0,0]=2 116 B7R0.16 CC(C)C(O)C(C)O Amb27251557 [0,0,0,0,0,0|3,0,1]=4 117 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,0,0,0,0,0|3,0,0]=3 118 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,0,0,0,0,0|2,0,0]=2 119 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,0,0,0,0,0|4,0,0]=4 120 B7R0.16 CC(C)N(N)C(N)=S Amb28249182 [0,0,0,0,0,0|3,1,0]=4 121 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,0,0,0,0,0|4,0,0]=4 122 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,0,0,0,0,0|2,0,0]=2 123 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,0,0,0,0,0|2,0,0]=2 124 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,0,0,0,0,0|3,0,0]=3 125 B7R0.16 CC(C)[C@@H](C)[C@@H](C)O Amb27801928 [0,0,0,0,0,0|3,0,1]=4 126 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,0,0,0,0,0|3,0,0]=3 127 B7R0.16 CC(C)[C@@H](Cl)[C@@H](C)O Amb27433932 [0,0,0,0,0,0|3,0,1]=4 128 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,0,0,0,0,0|1,0,0]=1 129 B7R0.16 CC(C)[C@@H](N)C(F)F Amb28284605 [0,0,0,0,0,0|3,0,1]=4 130 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,0,0,0,0,0|2,0,0]=2 131 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,0,0,0,0,0|2,0,0]=2 132 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,0,0,0,0,0|2,0,0]=2 133 B7R0.16 CC(C)[C@@H](N)[C@@H](C)N Amb27880978 [0,0,0,0,0,0|3,0,1]=4 134 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,0,0,0,0,0|2,0,0]=2 135 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,0,0,0,0,0|3,0,0]=3 136 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,0,0,0,0,0|2,0,0]=2 137 B7R0.16 CC(C)[C@H](C)B(O)O Amb27604530 [0,0,0,0,0,0|3,0,1]=4 138 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,0,0,0,0,0|2,0,0]=2 139 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,0,0,0,0,0|3,0,0]=3 140 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,0,0,0,0,0|3,0,0]=3 141 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,0,0,0,0,0|1,0,0]=1 142 B7R0.16 CC(C)[C@H](N)C(C)O Amb35623965 [0,0,0,0,0,0|2,0,1]=3 143 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,0,0,0,0,0|2,0,0]=2 144 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,0,0,0,0,0|2,0,0]=2 145 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,0,0,0,0,0|2,0,0]=2 146 B7R0.16 CC(C)[C@H](N)[C@H](C)N Amb27964099 [0,0,0,0,0,0|3,0,1]=4 147 B7R0.16 CC(C)[C@H](N)[C@H](C)O Amb27167748 [0,0,0,0,0,0|2,0,1]=3 148 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,0,0,0,0,0|2,0,0]=2 149 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,0,0,0,0,0|2,0,0]=2 150 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,0,0,0,0,0|2,0,0]=2 151 B7R0.16 CC(Cl)C(C)S(=O)Cl Amb27794713 [0,0,0,0,0,0|4,0,0]=4 152 B7R0.16 CC(Cl)C(Cl)C(=O)Cl Amb27634873 [0,0,0,0,0,0|3,0,0]=3 153 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,0,0,0,0,0|2,0,0]=2 154 B7R0.16 CC(Cl)N(C)C(=O)Cl Amb27656929 [0,0,0,0,0,0|4,0,0]=4 155 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,0,0,0,0,0|2,0,1]=3 156 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,0,0,0,0,0|1,0,0]=1 157 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,0,0,0,0,0|1,0,0]=1 158 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,0,0,0,0,0|2,0,0]=2 159 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,0,0,0,0,0|1,0,0]=1 160 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,0,0,0,0,0|2,0,0]=2 161 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,0,0,0,0,0|2,0,0]=2 162 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,0,0,0,0,0|3,0,0]=3 163 B7R0.16 CC(N)C(C)S(C)=O Amb27870518 [0,0,0,0,0,0|4,0,0]=4 164 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,0,0,0,0,0|2,0,0]=2 165 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,0,0,0,0,0|1,0,0]=1 166 B7R0.16 CC(N)C(N)C(F)F Amb13953209 [0,0,0,0,0,0|3,0,1]=4 167 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,0,0,0,0,0|2,0,0]=2 168 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,0,0,0,0,0|2,0,0]=2 169 B7R0.16 CC(N)C(O)C(N)=O Amb27483181 [0,0,0,0,0,0|3,0,0]=3 170 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,0,0,0,0,0|1,0,0]=1 171 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,0,0,0,0,0|1,0,0]=1 172 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,0,0,0,0,0|1,0,1]=2 173 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,0,0,0,0,0|1,0,0]=1 174 B7R0.16 CC(O)C(Br)C(C)F Amb27985825 [0,0,0,0,0,0|3,0,1]=4 175 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,0,0,0,0,0|1,0,0]=1 176 B7R0.16 CC(O)C(C)C(C)O Amb2818287 [0,0,0,0,0,0|2,0,1]=3 177 B7R0.16 CC(O)C(C)C(F)F Amb32944356 [0,0,0,0,0,0|3,0,1]=4 178 B7R0.16 CC(O)C(C)N(C)C Amb28401148 [0,0,0,0,0,0|4,0,0]=4 179 B7R0.16 CC(O)C(Cl)=C(Cl)Cl Amb27243012 [0,0,0,0,0,0|3,0,1]=4 180 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,0,0,0,0,0|1,0,0]=1 181 B7R0.16 CC(O)C(Cl)C(C)Cl Amb27471157 [0,0,0,0,0,0|3,0,1]=4 182 B7R0.16 CC(O)C(Cl)C(C)O Amb27971887 [0,0,0,0,0,0|2,0,1]=3 183 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,0,0,0,0,0|1,0,0]=1 184 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,0,0,0,0,0|1,0,0]=1 185 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,0,0,0,0,0|0,0,0]=0 186 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,0,0,0,0,0|0,0,0]=0 187 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,0,0,0,0|1,0,0]=1 188 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,0,0,0,0,0|1,0,0]=1 189 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,0,0,0,0,0|1,0,0]=1 190 B7R0.16 CC(O)C(O)C(C)Cl Amb28384116 [0,0,0,0,0,0|3,0,1]=4 191 B7R0.16 CC(O)C(O)C(C)O Amb27826429 [0,0,0,0,0,0|2,0,1]=3 192 B7R0.16 CC(O)C(O)[C@@H](C)O Amb27775950 [0,0,0,0,0,0|2,0,1]=3 193 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,0,0,0,0,0|1,0,0]=1 194 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,0,0,0,0,0|1,1,1]=3 195 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,0,0,0,0,0|0,1,0]=1 196 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,0,0,0,0,0|0,1,0]=1 197 B7R0.16 CC([C@@H](C)O)[C@@H](C)O Amb27396018 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.16 CC([C@H](C)O)[C@H](C)O Amb27659871 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,0,0,0,0,0|2,0,2]=4 200 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,0,0,0,0,0|3,0,1]=4 201 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,0,0,0,0,0|3,0,0]=3 202 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,0,0,0,0,0|3,0,0]=3 203 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,0,0,0,0,0|3,0,0]=3 204 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,0,0,0,0,0|2,0,0]=2 205 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,0,0,0,0,0|2,0,0]=2 206 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(N)=O Amb27607679 [0,0,0,0,0,0|3,0,0]=3 207 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,0,0,0,0,0|1,0,0]=1 208 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,0,0,0,0,0|1,0,0]=1 209 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,0,0,0,0,0|2,0,0]=2 210 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,0,0,0,0,0|1,0,0]=1 211 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,0,0,0,0,0|1,0,0]=1 212 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,0,0,0,0,0|0,0,0]=0 213 B7R0.16 C[C@@H](O)[C@@H](C)S(C)=O Amb28249125 [0,0,0,0,0,0|3,0,0]=3 214 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,0,0,0,0,0|1,0,0]=1 215 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,0,0,0,0,0|0,0,0]=0 216 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,0,0,0,0,0|1,0,0]=1 217 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,0,0,0,0,0|1,0,0]=1 218 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,0,0,0,0,0|0,0,0]=0 219 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,0,0,0,0,0|0,0,0]=0 220 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,0,0,0,0,0|0,0,0]=0 221 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,0,0,0,0|1,0,0]=1 222 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,0,0,0,0,0|0,1,0]=1 223 B7R0.16 C[C@@H]([C@@H](C)O)N(C)C Amb27977802 [0,0,0,0,0,0|4,0,0]=4 224 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,0,0,0,0,0|3,0,0]=3 225 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,0,0,0,0,0|1,0,0]=1 226 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)Cl Amb28384464 [0,0,0,0,0,0|3,0,0]=3 227 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,0,0,0,0,0|2,0,0]=2 228 B7R0.16 C[C@H](Cl)[C@H](Cl)[C@@H](C)O Amb27983786 [0,0,0,0,0,0|3,0,1]=4 229 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,0,0,0,0,0|2,0,0]=2 230 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,0,0,0,0,0|2,0,0]=2 231 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,0,0,0,0,0|1,0,0]=1 232 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,0,0,0,0,0|1,0,0]=1 233 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,0,0,0,0,0|1,0,0]=1 234 B7R0.16 C[C@H](O)[C@@H](Cl)[C@H](C)Cl Amb27407083 [0,0,0,0,0,0|3,0,1]=4 235 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,0,0,0,0,0|1,0,0]=1 236 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,0,0,0,0,0|0,0,0]=0 237 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,0,0,0,0,0|1,0,0]=1 238 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,0,0,0,0,0|1,0,0]=1 239 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,0,0,0,0,0|1,0,0]=1 240 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,0,0,0,0,0|1,0,0]=1 241 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,0,0,0,0,0|0,0,0]=0 242 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,0,0,0,0,0|0,0,0]=0 243 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,0,0,0,0,0|1,0,0]=1 244 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,0,0,0,0,0|2,0,2]=4 246 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,0,0,0,0,0|1,0,2]=3 247 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,0,0,0,0,0|0,0,2]=2 248 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,0,0,0,0,0|1,0,2]=3 249 B7R0.16 C\C(O)=C(\O)C(C)O Amb25227909 [0,0,0,0,0,0|2,0,1]=3 250 B7R0.16 C\C(O)=C(\O)[C@@H](C)O Amb27862909 [0,0,0,0,0,0|2,0,1]=3 251 B7R0.16 N=C(N)C(N)C(N)=O Amb27601378 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.16 NC(=O)C(N)C(N)=O Amb518675 [0,0,0,0,0,0|2,0,2]=4 253 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,0,0,0,0,0|1,0,2]=3 254 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,0,0,0,0|1,0,1]=2 255 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,0,0,0,0,0|2,0,0]=2 256 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,0,0,0,0,0|2,0,0]=2 257 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,0,0,0,0,0|2,0,0]=2 258 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,0,0,0,0,0|1,0,0]=1 259 B7R0.16 O=C(Cl)C(Cl)C(Cl)Cl Amb27605896 [0,0,0,0,0,0|4,0,0]=4 260 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,0,0,0,0,0|2,0,2]=4 261 B7R0.16 O=C(O)C(=O)C(Br)Br Amb24179214 [0,0,0,0,0,0|3,0,1]=4 262 B7R0.16 O=C(O)C(=O)C(Cl)Br Amb27830042 [0,0,0,0,0,0|3,0,1]=4 263 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,0,0,0,0,0|2,0,1]=3 264 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,0,0,0,0,0|2,0,1]=3 265 B7R0.16 O=C(O)C(F)C(Cl)Cl Amb4015382 [0,0,0,0,0,0|3,0,0]=3 266 B7R0.16 O=C(O)C(F)C(F)F Amb27481077 [0,0,0,0,0,0|3,0,0]=3 267 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,0,0,0,0,0|2,0,1]=3 268 B7R0.16 O=C(O)C(O)C(Cl)Cl Amb27212773 [0,0,0,0,0,0|3,0,0]=3 269 B7R0.16 O=C(O)C(O)C(F)F Amb25074883 [0,0,0,0,0,0|3,0,0]=3 270 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,0,0,0,0,0|2,0,1]=3 271 B7R0.16 OC(Cl)C(O)C(O)Cl Amb27594148 [0,0,0,0,0,0|3,0,1]=4 272 B6R0.2 C=C(Br)CC(C)C Amb22583739 [1,0,0,0,0,0|3,0,0]=4 273 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,0,0,0,0,0|1,0,1]=3 274 B6R0.2 C=C(C)CC(C)=O Amb17593075 [1,0,0,0,0,0|2,0,1]=4 275 B6R0.2 C=C(C)CC(C)Br Amb24365286 [1,0,0,0,0,0|3,0,0]=4 276 B6R0.2 C=C(C)CC(C)C Amb4019530 [1,0,0,0,0,0|3,0,0]=4 277 B6R0.2 C=C(C)CC(C)Cl Amb24558200 [1,0,0,0,0,0|3,0,0]=4 278 B6R0.2 C=C(C)CC(C)O Amb17593083 [1,0,0,0,0,0|2,0,0]=3 279 B6R0.2 C=C(C)CN(C)O Amb33199952 [1,0,0,0,0,0|3,0,0]=4 280 B6R0.2 C=C(C)C[C@@H](C)N Amb33199541 [1,0,0,0,0,0|3,0,0]=4 281 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [1,0,0,0,0,0|2,0,0]=3 282 B6R0.2 C=C(C)C[C@H](C)N Amb33199534 [1,0,0,0,0,0|3,0,0]=4 283 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [1,0,0,0,0,0|2,0,0]=3 284 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,0,0,0,0,0|1,0,2]=4 285 B6R0.2 C=C(Cl)CC(C)Cl Amb28396615 [1,0,0,0,0,0|3,0,0]=4 286 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,0,0,0,0,0|1,0,2]=4 287 B6R0.2 CC(=O)CC(=O)F Amb28122452 [1,0,0,0,0,0|1,0,2]=4 288 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,0,0,0,0,0|0,0,2]=3 289 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [1,0,0,0,0,0|0,0,3]=4 290 B6R0.2 CC(=O)CC(C)=O Amb2716228 [1,0,0,0,0,0|1,0,2]=4 291 B6R0.2 CC(=O)CC(C)=S Amb28381251 [1,0,0,0,0,0|1,1,1]=4 292 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,0,0,0,0,0|2,0,0]=3 293 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [1,0,0,0,0,0|2,0,0]=3 294 B6R0.2 CC(=O)CC(C)N Amb22587050 [1,0,0,0,0,0|2,0,0]=3 295 B6R0.2 CC(=O)CC(C)N Amb2583230 [1,0,0,0,0,0|2,0,0]=3 296 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,0,0,0,0,0|1,0,0]=2 297 B6R0.2 CC(=O)CC(C)S Amb24600676 [1,0,0,0,0,0|1,1,0]=3 298 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,0,0,0,0,0|1,0,1]=3 299 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.2 CC(=O)CC(N)=O Amb6608777 [1,0,0,0,0,0|1,0,2]=4 301 B6R0.2 CC(=O)CN(C)C Amb9217324 [1,0,0,0,0,0|3,0,0]=4 302 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [1,0,0,0,0,0|2,0,0]=3 303 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [1,0,0,0,0,0|2,0,0]=3 304 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,0,0,0,0,0|1,0,2]=4 305 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [1,0,0,0,0,0|3,0,0]=4 306 B6R0.2 CC(=O)NC(C)Br Amb27444682 [1,0,0,0,0,0|3,0,0]=4 307 B6R0.2 CC(=O)NC(C)C Amb3366263 [1,0,0,0,0,0|3,0,0]=4 308 B6R0.2 CC(=O)NC(C)N Amb27468729 [1,0,0,0,0,0|3,0,0]=4 309 B6R0.2 CC(=O)OC(C)Br Amb19958925 [1,0,0,0,0,0|3,0,0]=4 310 B6R0.2 CC(=O)OC(C)C Amb3940484 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [1,0,0,0,0,0|3,0,0]=4 312 B6R0.2 CC(=O)OC(C)N Amb27184949 [1,0,0,0,0,0|3,0,0]=4 313 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [1,0,0,0,0,0|1,0,2]=4 315 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,0,0,0,0,0|0,1,1]=3 316 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,0,0,0,0,0|1,0,0]=2 317 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,0,0,0,0,0|1,0,2]=4 318 B6R0.2 CC(C)=CC(C)O Amb22229846 [1,0,0,0,0,0|2,0,1]=4 319 B6R0.2 CC(C)CB(O)O Amb2447316 [1,0,0,0,0,0|2,0,1]=4 320 B6R0.2 CC(C)CC(=N)N Amb10066934 [1,0,0,0,0,0|3,0,0]=4 321 B6R0.2 CC(C)CC(=N)N Amb2696279 [1,0,0,0,0,0|3,0,0]=4 322 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,0,0,0,0,0|2,0,0]=3 323 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,0,0,0,0,0|2,0,0]=3 324 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,0,0,0,0,0|2,0,0]=3 325 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,0,0,0,0,0|1,0,0]=2 326 B6R0.2 CC(C)CC(C)O Amb6608920 [1,0,0,0,0,0|2,0,1]=4 327 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,0,0,0,0,0|2,0,0]=3 328 B6R0.2 CC(C)CC(N)=S Amb6246355 [1,0,0,0,0,0|2,1,0]=4 329 B6R0.2 CC(C)CC(N)O Amb28383510 [1,0,0,0,0,0|2,0,1]=4 330 B6R0.2 CC(C)CC(O)O Amb27207854 [1,0,0,0,0,0|1,0,2]=4 331 B6R0.2 CC(C)CN(C)O Amb33360311 [1,0,0,0,0,0|3,0,0]=4 332 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [1,0,0,0,0,0|3,0,0]=4 333 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [1,0,0,0,0,0|2,0,1]=4 334 B6R0.2 CC(C)CS(C)=O Amb27972160 [1,0,0,0,0,0|3,0,0]=4 335 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,0,0,0,0,0|3,0,0]=4 336 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [1,0,0,0,0,0|2,0,1]=4 337 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [1,0,0,0,0,0|2,0,1]=4 338 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [1,0,0,0,0,0|2,0,1]=4 339 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [1,0,0,0,0,0|3,0,0]=4 340 B6R0.2 CC(C)NC(=O)S Amb27817487 [1,0,0,0,0,0|2,1,0]=4 341 B6R0.2 CC(C)NC(N)=O Amb1104587 [1,0,0,0,0,0|3,0,0]=4 342 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [1,0,0,0,0,0|3,0,0]=4 343 B6R0.2 CC(C)OC(N)=O Amb4017684 [1,0,0,0,0,0|3,0,0]=4 344 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,0,0,0,0,0|3,0,0]=4 345 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [1,0,0,0,0,0|2,0,0]=3 346 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,0,0,0,0,0|1,0,0]=2 347 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [1,0,0,0,0,0|3,0,0]=4 348 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [1,0,0,0,0,0|3,0,0]=4 349 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,0,0,0,0,0|1,0,0]=2 350 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,0,0,0,0,0|1,0,0]=2 351 B6R0.2 CC(N)CC(=O)S Amb27413857 [1,0,0,0,0,0|1,1,0]=3 352 B6R0.2 CC(N)CC(C)O Amb18640217 [1,0,0,0,0,0|2,0,1]=4 353 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,0,0,0,0,0|2,0,0]=3 354 B6R0.2 CC(N)CC(N)=O Amb33532770 [1,0,0,0,0,0|2,0,0]=3 355 B6R0.2 CC(N)CS(C)=O Amb33546327 [1,0,0,0,0,0|3,0,0]=4 356 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,0,0,0,0,0|0,0,0]=1 357 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [1,0,0,0,0,0|0,0,1]=2 358 B6R0.2 CC(O)CC(C)F Amb28065744 [1,0,0,0,0,0|2,0,1]=4 359 B6R0.2 CC(O)CC(C)O Amb10068523 [1,0,0,0,0,0|1,0,1]=3 360 B6R0.2 CC(O)CC(C)S Amb24122653 [1,0,0,0,0,0|1,1,1]=4 361 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,0,0,0,0,0|1,0,0]=2 362 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,0,0,0,0,0|1,1,0]=3 363 B6R0.2 CC(O)CN(C)C Amb8513140 [1,0,0,0,0,0|3,0,0]=4 364 B6R0.2 CC(O)CN(C)N Amb28050102 [1,0,0,0,0,0|3,0,0]=4 365 B6R0.2 CC(O)CN(Cl)Cl Amb28321334 [1,0,0,0,0,0|3,0,0]=4 366 B6R0.2 CC(O)CS(C)=O Amb28137235 [1,0,0,0,0,0|2,0,0]=3 367 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [1,0,0,0,0,0|1,0,1]=3 368 B6R0.2 CC(O)C[NH+](C)C Amb33934480 [1,0,0,0,0,0|3,0,0]=4 369 B6R0.2 CC(O)SC(=N)N Amb27482112 [1,0,0,0,0,0|3,0,0]=4 370 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,0,0,0,0,0|0,1,0]=2 371 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,0,0,0,0,0|3,0,0]=4 372 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [1,0,0,0,0,0|3,0,0]=4 373 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,0,0,0,0,0|2,0,0]=3 374 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,0,0,0,0,0|2,0,0]=3 375 B6R0.2 CN(C)CC(N)=O Amb17231806 [1,0,0,0,0,0|3,0,0]=4 376 B6R0.2 CN(C)CC(N)=O Amb33321491 [1,0,0,0,0,0|3,0,0]=4 377 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,0,0,0,0,0|1,0,0]=2 379 B6R0.2 CP(O)OC(N)=O Amb27436991 [1,0,0,0,0,0|3,0,0]=4 380 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,0,0,0,0,0|2,0,1]=4 381 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,0,0,0,0,0|1,0,0]=2 382 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,0,0,0,0,0|1,0,0]=2 383 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,0,0,0,0,0|1,0,0]=2 384 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,0,0,0,0,0|1,0,0]=2 385 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,0,0,0,0,0|0,0,0]=1 386 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [1,0,0,0,0,0|0,0,1]=2 387 B6R0.2 C[C@@H](O)CC(F)F Amb33337765 [1,0,0,0,0,0|2,0,1]=4 388 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [1,0,0,0,0,0|3,0,0]=4 389 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [1,0,0,0,0,0|2,0,0]=3 390 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,0,0,0,0,0|1,0,0]=2 391 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,0,0,0,0,0|1,0,0]=2 392 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,0,0,0,0,0|1,0,0]=2 393 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [1,0,0,0,0,0|2,0,0]=3 394 B6R0.2 C[C@H](N)C[C@H](C)O Amb27593805 [1,0,0,0,0,0|2,0,1]=4 395 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,0,0,0,0,0|0,0,0]=1 396 B6R0.2 C[C@H](O)CC(F)F Amb32811467 [1,0,0,0,0,0|2,0,1]=4 397 B6R0.2 C[C@H](O)C[C@@H](C)F Amb27486566 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [1,0,0,0,0,0|1,0,1]=3 399 B6R0.2 C[C@H](O)C[C@H](C)I Amb28042894 [1,0,0,0,0,0|2,0,1]=4 400 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,0,0,0,0,0|1,0,1]=3 401 B6R0.2 C[C@H](O)NC(=N)N Amb28366102 [1,0,0,0,0,0|3,0,0]=4 402 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,0,0,0,0,0|3,0,0]=4 403 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,0,0,0,0,0|2,0,0]=3 404 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,0,0,0,0,0|2,0,0]=3 405 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [1,0,0,0,0,0|2,0,1]=4 406 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,0,0,0,0,0|1,0,2]=4 407 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,0,0,0,0,0|1,0,2]=4 408 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,0,0,0,0,0|1,0,2]=4 409 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,0,0,0,0,0|1,0,2]=4 410 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,0,0,0,0,0|1,0,2]=4 411 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,0,0,0,0,0|1,0,2]=4 412 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,0,0,0,0,0|1,0,2]=4 413 B6R0.2 NC(=O)CC(F)F Amb28401488 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,0,0,0,0,0|1,1,1]=4 415 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,0,0,0,0,0|1,1,0]=3 416 B6R0.2 O=C(O)CB(O)O Amb24053058 [1,0,0,0,0,0|2,0,0]=3 417 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,0,0,0,0,0|1,0,2]=4 418 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,0,0,0,0,0|1,0,1]=3 419 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [1,0,0,0,0,0|2,0,0]=3 420 B6R0.2 O=C(O)CC(F)F Amb22001551 [1,0,0,0,0,0|2,0,0]=3 421 B6R0.2 O=C(O)CS(=O)O Amb27788997 [1,0,0,0,0,0|2,0,0]=3 422 B6R0.2 O=C([O-])CC(F)F Amb24117960 [1,0,0,0,0,0|2,0,1]=4 423 B6R0.2 O=S(O)CC(F)F Amb30035176 [1,0,0,0,0,0|3,0,0]=4 424 B6R0.2 OC(=S)CC(F)F Amb34179023 [1,0,0,0,0,0|2,1,0]=4 425 B6R0.2 OC(O)CC(O)O Amb27632053 [1,0,0,0,0,0|1,0,2]=4 426 B6R0.3 C#CC(C)C(C)O Amb25885080 [1,0,0,0,0,0|2,0,1]=4 427 B6R0.3 C#CC(C)[C@@H](C)O Amb27457723 [1,0,0,0,0,0|2,0,1]=4 428 B6R0.3 C#CC(N)C(=O)O Amb28282694 [1,0,0,0,0,0|0,0,2]=3 429 B6R0.3 C#CC(N)C(C)C Amb26014287 [1,0,0,0,0,0|2,0,1]=4 430 B6R0.3 C#CC(N)C(C)C Amb33551338 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.3 C#CC(O)C(=O)O Amb22731622 [1,0,0,0,0,0|1,0,2]=4 432 B6R0.3 C#C[C@@H](C)[C@@H](C)O Amb28191860 [1,0,0,0,0,0|2,0,1]=4 433 B6R0.3 C#C[C@@H](C)[C@H](C)O Amb27977833 [1,0,0,0,0,0|2,0,1]=4 434 B6R0.3 C#C[C@@H](O)[C@H](C)O Amb27171580 [1,0,0,0,0,0|2,0,1]=4 435 B6R0.3 C=C(Br)C(C)CC Amb22583745 [1,0,0,0,0,0|3,0,0]=4 436 B6R0.3 C=C(Br)C(C)CO Amb27757394 [1,0,0,0,0,0|3,0,0]=4 437 B6R0.3 C=C(C)C(Br)CO Amb25707965 [1,0,0,0,0,0|3,0,0]=4 438 B6R0.3 C=C(C)C(C)C=O Amb18639176 [1,0,0,0,0,0|2,0,1]=4 439 B6R0.3 C=C(C)C(C)CO Amb24539367 [1,0,0,0,0,0|3,0,0]=4 440 B6R0.3 C=C(C)C(Cl)CC Amb27229374 [1,0,0,0,0,0|3,0,0]=4 441 B6R0.3 C=C(C)C(Cl)CO Amb27858700 [1,0,0,0,0,0|3,0,0]=4 442 B6R0.3 C=C(C)C(F)CO Amb28043434 [1,0,0,0,0,0|3,0,0]=4 443 B6R0.3 C=C(C)C(N)CO Amb26544297 [1,0,0,0,0,0|2,0,0]=3 444 B6R0.3 C=C(C)C(O)CC Amb26365874 [1,0,0,0,0,0|3,0,0]=4 445 B6R0.3 C=C(C)C(O)CO Amb23570510 [1,0,0,0,0,0|3,0,0]=4 446 B6R0.3 C=C(C)[C@@H](C)C=O Amb27838285 [1,0,0,0,0,0|2,0,1]=4 447 B6R0.3 C=C(C)[C@@H](N)CO Amb25693320 [1,0,0,0,0,0|2,0,0]=3 448 B6R0.3 C=C(C)[C@H](C)CO Amb28350373 [1,0,0,0,0,0|3,0,0]=4 449 B6R0.3 C=C(C)[C@H](F)CO Amb27763892 [1,0,0,0,0,0|3,0,0]=4 450 B6R0.3 C=C(C)[C@H](N)CO Amb27174504 [1,0,0,0,0,0|2,0,0]=3 451 B6R0.3 C=C(C=O)C(C)C Amb18639179 [1,0,0,0,0,0|2,0,1]=4 452 B6R0.3 C=C(C=O)C(C)O Amb28050261 [1,0,0,0,0,0|1,0,1]=3 453 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [1,0,0,0,0,0|2,0,1]=4 454 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [1,0,0,0,0,0|2,0,1]=4 455 B6R0.3 C=C(CC)C(=O)O Amb18639591 [1,0,0,0,0,0|1,0,1]=3 456 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [1,0,0,0,0,0|2,0,1]=4 457 B6R0.3 C=C(CO)C(=O)O Amb18121817 [1,0,0,0,0,0|1,0,1]=3 458 B6R0.3 C=C(CO)C(C)=O Amb24571845 [1,0,0,0,0,0|2,0,1]=4 459 B6R0.3 C=C(CS)C(=O)O Amb27263242 [1,0,0,0,0,0|1,1,1]=4 460 B6R0.3 C=C(Cl)C(Br)CO Amb27656944 [1,0,0,0,0,0|3,0,0]=4 461 B6R0.3 C=C(OC)C(=O)O Amb18639906 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.3 C=C(SC)C(=O)O Amb27882690 [1,0,0,0,0,0|2,0,1]=4 463 B6R0.3 C=CC(=C)[C@@H](C)O Amb27196639 [1,0,0,0,0,0|2,0,1]=4 464 B6R0.3 C=CC(=O)C(C)O Amb27660466 [1,0,0,0,0,0|2,0,1]=4 465 B6R0.3 C=CC(=O)[C@@H](C)O Amb27838249 [1,0,0,0,0,0|2,0,1]=4 466 B6R0.3 C=CC(Br)C(C)C Amb27483981 [1,0,0,0,0,0|3,0,0]=4 467 B6R0.3 C=CC(C)C(=O)O Amb21618706 [1,0,0,0,0,0|1,0,2]=4 468 B6R0.3 C=CC(C)C(C)C Amb4019534 [1,0,0,0,0,0|3,0,0]=4 469 B6R0.3 C=CC(C)C(C)N Amb30029109 [1,0,0,0,0,0|3,0,0]=4 470 B6R0.3 C=CC(C)C(C)O Amb26948663 [1,0,0,0,0,0|2,0,0]=3 471 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [1,0,0,0,0,0|1,0,2]=4 472 B6R0.3 C=CC(Cl)C(C)Cl Amb27408403 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.3 C=CC(N)C(=O)O Amb20240543 [1,0,0,0,0,0|0,0,2]=3 474 B6R0.3 C=CC(N)C(C)C Amb23536604 [1,0,0,0,0,0|2,0,0]=3 475 B6R0.3 C=CC(O)C(=O)O Amb24061247 [1,0,0,0,0,0|1,0,2]=4 476 B6R0.3 C=CC(O)C(C)C Amb22346222 [1,0,0,0,0,0|3,0,0]=4 477 B6R0.3 C=CC(O)[C@@H](C)N Amb35617942 [1,0,0,0,0,0|3,0,0]=4 478 B6R0.3 C=CC(O)[C@H](C)N Amb35588758 [1,0,0,0,0,0|3,0,0]=4 479 B6R0.3 C=CC(S)C(=O)O Amb28069741 [1,0,0,0,0,0|1,0,2]=4 480 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [1,0,0,0,0,0|1,0,2]=4 481 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [1,0,0,0,0,0|0,0,2]=3 482 B6R0.3 C=C[C@@H](N)C(C)O Amb27213302 [1,0,0,0,0,0|1,0,0]=2 483 B6R0.3 C=C[C@@H](O)C(C)C Amb27780531 [1,0,0,0,0,0|3,0,0]=4 484 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [1,0,0,0,0,0|1,0,2]=4 485 B6R0.3 C=C[C@H](C)[C@H](C)O Amb27651702 [1,0,0,0,0,0|2,0,0]=3 486 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [1,0,0,0,0,0|0,0,2]=3 487 B6R0.3 CC(=O)C(Br)C=O Amb17232509 [1,0,0,0,0,0|1,0,2]=4 488 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [1,0,0,0,0,0|3,0,0]=4 489 B6R0.3 CC(=O)C(C)C=O Amb18639572 [1,0,0,0,0,0|1,0,2]=4 490 B6R0.3 CC(=O)C(C)CCl Amb26477594 [1,0,0,0,0,0|3,0,0]=4 491 B6R0.3 CC(=O)C(C)CO Amb10844844 [1,0,0,0,0,0|2,0,0]=3 492 B6R0.3 CC(=O)C(Cl)C=O Amb28137911 [1,0,0,0,0,0|1,0,2]=4 493 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [1,0,0,0,0,0|3,0,0]=4 494 B6R0.3 CC(=O)C(O)CO Amb26463044 [1,0,0,0,0,0|2,0,0]=3 495 B6R0.3 CC(=O)C([Na])CN Amb28423432 [1,0,0,0,0,0|3,0,0]=4 496 B6R0.3 CC(=O)N(C)CO Amb28191296 [1,0,0,0,0,0|3,0,0]=4 497 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,0,0,0,0,0|2,0,0]=3 498 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [1,0,0,0,0,0|1,0,0]=2 499 B6R0.3 CC(Br)C(Br)C=O Amb27594756 [1,0,0,0,0,0|2,0,0]=3 500 B6R0.3 CC(Br)C(Br)CO Amb30621786 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.3 CC(C#N)C(=O)O Amb17210512 [1,0,0,0,0,0|2,0,1]=4 502 B6R0.3 CC(C)C(=O)C=O Amb28050041 [1,0,0,0,0,0|2,0,1]=4 503 B6R0.3 CC(C)C(Br)C=O Amb17594091 [1,0,0,0,0,0|2,0,0]=3 504 B6R0.3 CC(C)C(Br)CO Amb27776750 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.3 CC(C)C(C)C=O Amb17593082 [1,0,0,0,0,0|2,0,0]=3 506 B6R0.3 CC(C)C(C)CO Amb26452810 [1,0,0,0,0,0|2,0,1]=4 507 B6R0.3 CC(C)C(Cl)C=O Amb18123761 [1,0,0,0,0,0|2,0,0]=3 508 B6R0.3 CC(C)C(F)C=O Amb27421552 [1,0,0,0,0,0|2,0,0]=3 509 B6R0.3 CC(C)C(N)C#N Amb1129748 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.3 CC(C)C(N)C#N Amb19514958 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.3 CC(C)C(N)CBr Amb27261624 [1,0,0,0,0,0|2,0,1]=4 512 B6R0.3 CC(C)C(N)CCl Amb27777259 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.3 CC(C)C(N)CN Amb19283589 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.3 CC(C)C(N)CN Amb9380667 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.3 CC(C)C(N)CO Amb3939350 [1,0,0,0,0,0|1,0,1]=3 516 B6R0.3 CC(C)C(N)CS Amb28289530 [1,0,0,0,0,0|1,1,1]=4 517 B6R0.3 CC(C)C(O)C=O Amb17593092 [1,0,0,0,0,0|2,0,0]=3 518 B6R0.3 CC(C)C(O)CO Amb27148682 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.3 CC(C)C(S)CO Amb25809908 [1,0,0,0,0,0|2,0,1]=4 520 B6R0.3 CC(C)N(C)C=O Amb33547758 [1,0,0,0,0,0|3,0,0]=4 521 B6R0.3 CC(C)[C@@H](C)C=O Amb27224855 [1,0,0,0,0,0|2,0,0]=3 522 B6R0.3 CC(C)[C@@H](C)CO Amb17613247 [1,0,0,0,0,0|2,0,1]=4 523 B6R0.3 CC(C)[C@@H](C)NO Amb27641375 [1,0,0,0,0,0|3,0,0]=4 524 B6R0.3 CC(C)[C@@H](N)C#N Amb26394267 [1,0,0,0,0,0|2,0,1]=4 525 B6R0.3 CC(C)[C@@H](N)C#N Amb28827646 [1,0,0,0,0,0|2,0,1]=4 526 B6R0.3 CC(C)[C@@H](N)C=O Amb28292701 [1,0,0,0,0,0|1,0,0]=2 527 B6R0.3 CC(C)[C@@H](N)CCl Amb27626961 [1,0,0,0,0,0|2,0,1]=4 528 B6R0.3 CC(C)[C@@H](N)CF Amb33624251 [1,0,0,0,0,0|2,0,1]=4 529 B6R0.3 CC(C)[C@@H](N)CO Amb3939342 [1,0,0,0,0,0|1,0,1]=3 530 B6R0.3 CC(C)[C@H](Br)CO Amb27760382 [1,0,0,0,0,0|2,0,1]=4 531 B6R0.3 CC(C)[C@H](C)C=O Amb27635299 [1,0,0,0,0,0|2,0,0]=3 532 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [1,0,0,0,0,0|2,0,1]=4 533 B6R0.3 CC(C)[C@H](Cl)CO Amb27488685 [1,0,0,0,0,0|2,0,1]=4 534 B6R0.3 CC(C)[C@H](N)C#N Amb27202695 [1,0,0,0,0,0|2,0,1]=4 535 B6R0.3 CC(C)[C@H](N)C#N Amb28827649 [1,0,0,0,0,0|2,0,1]=4 536 B6R0.3 CC(C)[C@H](N)CO Amb2785298 [1,0,0,0,0,0|1,0,1]=3 537 B6R0.3 CC(C)\C(N)=N\O Amb2695033 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.3 CC(C=O)C(=O)O Amb27784775 [1,0,0,0,0,0|1,0,2]=4 539 B6R0.3 CC(C=O)C(F)F Amb25746789 [1,0,0,0,0,0|3,0,0]=4 540 B6R0.3 CC(C=O)S(C)=O Amb29849577 [1,0,0,0,0,0|2,0,1]=4 541 B6R0.3 CC(CBr)C(=O)O Amb22002601 [1,0,0,0,0,0|2,0,0]=3 542 B6R0.3 CC(CCl)C(=O)O Amb18522181 [1,0,0,0,0,0|2,0,0]=3 543 B6R0.3 CC(CF)C(=O)O Amb24432331 [1,0,0,0,0,0|2,0,0]=3 544 B6R0.3 CC(CN)C(=O)O Amb2699128 [1,0,0,0,0,0|2,0,0]=3 545 B6R0.3 CC(CN)C(=O)O Amb6773978 [1,0,0,0,0,0|2,0,0]=3 546 B6R0.3 CC(CN)C(=O)O Amb8631418 [1,0,0,0,0,0|2,0,0]=3 547 B6R0.3 CC(CO)C(=O)O Amb8011522 [1,0,0,0,0,0|1,0,0]=2 548 B6R0.3 CC(CO)C(N)=S Amb8869143 [1,0,0,0,0,0|2,1,0]=4 549 B6R0.3 CC(CO)[N+](=O)[O-] Amb17600148 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.3 CC(Cl)C(Cl)CO Amb28385636 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.3 CC(Cl)C(O)C=O Amb27848371 [1,0,0,0,0,0|2,0,0]=3 552 B6R0.3 CC(Cl)C(O)CO Amb27858806 [1,0,0,0,0,0|2,0,1]=4 553 B6R0.3 CC(Cl)\C(N)=N/O Amb2696029 [1,0,0,0,0,0|2,0,1]=4 554 B6R0.3 CC(F)C(O)CO Amb28350261 [1,0,0,0,0,0|2,0,1]=4 555 B6R0.3 CC(N)C(C)CO Amb18122199 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.3 CC(N)C(N)CO Amb27196655 [1,0,0,0,0,0|1,0,1]=3 557 B6R0.3 CC(N)C(O)C=O Amb28133361 [1,0,0,0,0,0|2,0,0]=3 558 B6R0.3 CC(N)C(O)CO Amb24583121 [1,0,0,0,0,0|2,0,1]=4 559 B6R0.3 CC(N)\C(N)=N\O Amb25144101 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.3 CC(NN)C(=O)O Amb18640367 [1,0,0,0,0,0|3,0,0]=4 561 B6R0.3 CC(O)C(=N)NO Amb19516866 [1,0,0,0,0,0|1,0,2]=4 562 B6R0.3 CC(O)C(=O)C=O Amb28287297 [1,0,0,0,0,0|1,0,1]=3 563 B6R0.3 CC(O)C(Br)CO Amb28290500 [1,0,0,0,0,0|1,0,1]=3 564 B6R0.3 CC(O)C(C)C#N Amb18121116 [1,0,0,0,0,0|2,0,1]=4 565 B6R0.3 CC(O)C(C)CN Amb10068614 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.3 CC(O)C(C)CO Amb4019853 [1,0,0,0,0,0|1,0,1]=3 567 B6R0.3 CC(O)C(C)CS Amb24334206 [1,0,0,0,0,0|1,1,1]=4 568 B6R0.3 CC(O)C(C)NO Amb27772254 [1,0,0,0,0,0|2,0,0]=3 569 B6R0.3 CC(O)C(C)ON Amb27826314 [1,0,0,0,0,0|3,0,0]=4 570 B6R0.3 CC(O)C(Cl)C=O Amb28121057 [1,0,0,0,0,0|1,0,0]=2 571 B6R0.3 CC(O)C(N)C#N Amb27408643 [1,0,0,0,0,0|1,0,1]=3 572 B6R0.3 CC(O)C(N)CN Amb19328774 [1,0,0,0,0,0|1,0,1]=3 573 B6R0.3 CC(O)C(N)CN Amb22059292 [1,0,0,0,0,0|1,0,1]=3 574 B6R0.3 CC(O)C(N)CO Amb17593100 [1,0,0,0,0,0|0,0,1]=2 575 B6R0.3 CC(O)C(N)CO Amb32666361 [1,0,0,0,0,0|0,0,1]=2 576 B6R0.3 CC(O)C(O)C#N Amb28435703 [1,0,0,0,0,0|2,0,1]=4 577 B6R0.3 CC(O)C(O)CN Amb26871700 [1,0,0,0,0,0|2,0,1]=4 578 B6R0.3 CC(O)C(O)CO Amb22227692 [1,0,0,0,0,0|1,0,1]=3 579 B6R0.3 CC(O)N(C)C=O Amb27191911 [1,0,0,0,0,0|2,0,0]=3 580 B6R0.3 CC(O)[C@H](F)CN Amb27220559 [1,0,0,0,0,0|2,0,1]=4 581 B6R0.3 CC(O)[C@H](N)CO Amb28050579 [1,0,0,0,0,0|0,0,1]=2 582 B6R0.3 CC(O)\C(F)=C\F Amb27844479 [1,0,0,0,0,0|2,0,1]=4 583 B6R0.3 CC(O)\C(N)=N\O Amb8384662 [1,0,0,0,0,0|1,0,1]=3 584 B6R0.3 CC(ON)C(=O)O Amb33038242 [1,0,0,0,0,0|3,0,0]=4 585 B6R0.3 CC(S)C(C)C=O Amb27838214 [1,0,0,0,0,0|1,1,0]=3 586 B6R0.3 CC(S)C(C)CO Amb22641872 [1,0,0,0,0,0|1,1,1]=4 587 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.3 CCC(=O)C(=O)O Amb3940359 [1,0,0,0,0,0|1,0,1]=3 589 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [1,0,0,0,0,0|1,0,2]=4 590 B6R0.3 CCC(=O)C(C)=O Amb8514604 [1,0,0,0,0,0|2,0,1]=4 591 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,0,0,0,0,0|2,0,1]=4 592 B6R0.3 CCC(=S)C(=O)O Amb27872099 [1,0,0,0,0,0|1,0,1]=3 593 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,0,0,0,0,0|2,0,0]=3 594 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [1,0,0,0,0,0|2,0,0]=3 595 B6R0.3 CCC(Br)C(=O)O Amb5716858 [1,0,0,0,0,0|1,0,0]=2 596 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,0,0,0,0,0|2,0,0]=3 597 B6R0.3 CCC(Br)C(N)=O Amb13952819 [1,0,0,0,0,0|2,0,0]=3 598 B6R0.3 CCC(Br)[N+](=O)[O-] Amb17673702 [1,0,0,0,0,0|2,0,1]=4 599 B6R0.3 CCC(C)B(O)O Amb10071974 [1,0,0,0,0,0|2,0,1]=4 600 B6R0.3 CCC(C)C(=N)N Amb6740564 [1,0,0,0,0,0|3,0,0]=4 601 B6R0.3 CCC(C)C(=N)N Amb8630181 [1,0,0,0,0,0|3,0,0]=4 602 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [1,0,0,0,0,0|2,0,0]=3 603 B6R0.3 CCC(C)C(=O)O Amb9703224 [1,0,0,0,0,0|1,0,0]=2 604 B6R0.3 CCC(C)C(C)=O Amb4605996 [1,0,0,0,0,0|2,0,0]=3 605 B6R0.3 CCC(C)C(C)O Amb8513435 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.3 CCC(C)C(N)=O Amb33548100 [1,0,0,0,0,0|2,0,0]=3 607 B6R0.3 CCC(C)C(N)=S Amb6740516 [1,0,0,0,0,0|2,1,0]=4 608 B6R0.3 CCC(C)C(O)O Amb27826789 [1,0,0,0,0,0|1,0,2]=4 609 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [1,0,0,0,0,0|3,0,0]=4 610 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [1,0,0,0,0,0|2,0,1]=4 611 B6R0.3 CCC(C)S(N)=O Amb32756501 [1,0,0,0,0,0|3,0,0]=4 612 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [1,0,0,0,0,0|2,0,1]=4 613 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [1,0,0,0,0,0|2,0,1]=4 614 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [1,0,0,0,0,0|2,0,1]=4 615 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [1,0,0,0,0,0|2,0,0]=3 616 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,0,0,0,0,0|2,0,0]=3 617 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [1,0,0,0,0,0|1,0,0]=2 618 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,0,0,0,0,0|2,0,0]=3 619 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,0,0,0,0,0|2,0,0]=3 620 B6R0.3 CCC(Cl)C(O)O Amb27400305 [1,0,0,0,0,0|1,0,2]=4 621 B6R0.3 CCC(Cl)[N+](=O)[O-] Amb4016590 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.3 CCC(F)C(=N)N Amb32456109 [1,0,0,0,0,0|3,0,0]=4 623 B6R0.3 CCC(F)C(=O)O Amb25716167 [1,0,0,0,0,0|1,0,0]=2 624 B6R0.3 CCC(N)B(O)O Amb28367684 [1,0,0,0,0,0|1,0,1]=3 625 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [1,0,0,0,0,0|1,0,0]=2 626 B6R0.3 CCC(N)C(=O)O Amb9729506 [1,0,0,0,0,0|0,0,0]=1 627 B6R0.3 CCC(N)C(C)C Amb10610298 [1,0,0,0,0,0|2,0,1]=4 628 B6R0.3 CCC(N)C(C)C Amb9031905 [1,0,0,0,0,0|2,0,1]=4 629 B6R0.3 CCC(N)C(C)Cl Amb27409375 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.3 CCC(N)C(C)O Amb32662794 [1,0,0,0,0,0|1,0,1]=3 631 B6R0.3 CCC(N)C(C)O Amb8855230 [1,0,0,0,0,0|1,0,1]=3 632 B6R0.3 CCC(N)C(C)S Amb32788301 [1,0,0,0,0,0|1,1,1]=4 633 B6R0.3 CCC(N)C(F)F Amb28050189 [1,0,0,0,0,0|2,0,1]=4 634 B6R0.3 CCC(N)C(F)F Amb32661586 [1,0,0,0,0,0|2,0,1]=4 635 B6R0.3 CCC(N)C(N)=O Amb1914080 [1,0,0,0,0,0|1,0,0]=2 636 B6R0.3 CCC(N)C(N)=O Amb33528521 [1,0,0,0,0,0|1,0,0]=2 637 B6R0.3 CCC(N)C(N)O Amb28348585 [1,0,0,0,0,0|1,0,1]=3 638 B6R0.3 CCC(N)N(C)C Amb24480382 [1,0,0,0,0,0|3,0,0]=4 639 B6R0.3 CCC(N)P(=O)=O Amb27786328 [1,0,0,0,0,0|1,0,1]=3 640 B6R0.3 CCC(O)C(=N)N Amb33321504 [1,0,0,0,0,0|3,0,0]=4 641 B6R0.3 CCC(O)C(=O)O Amb6609018 [1,0,0,0,0,0|1,0,0]=2 642 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [1,0,0,0,0,0|1,0,1]=3 643 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,0,0,0,0,0|2,0,0]=3 644 B6R0.3 CCC(O)C(C)O Amb2227553 [1,0,0,0,0,0|2,0,1]=4 645 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,0,0,0,0,0|2,0,0]=3 646 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,0,0,0,0,0|2,1,0]=4 647 B6R0.3 CCC(O)S(=O)[O-] Amb27166943 [1,0,0,0,0,0|2,0,1]=4 648 B6R0.3 CCC(S)C(=O)O Amb17501370 [1,0,0,0,0,0|1,0,0]=2 649 B6R0.3 CCC(S)C(C)=O Amb8393170 [1,0,0,0,0,0|2,0,0]=3 650 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [1,0,0,0,0,0|3,0,0]=4 651 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,0,0,0,0,0|3,0,0]=4 652 B6R0.3 CCN(N)C(=N)N Amb28207703 [1,0,0,0,0,0|3,0,0]=4 653 B6R0.3 CCN(N)C(C)=O Amb18639976 [1,0,0,0,0,0|2,0,0]=3 654 B6R0.3 CCN(N)C(N)=O Amb28184355 [1,0,0,0,0,0|2,0,0]=3 655 B6R0.3 CCN(O)C(C)=O Amb27652499 [1,0,0,0,0,0|3,0,0]=4 656 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [1,0,0,0,0,0|1,0,0]=2 657 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [1,0,0,0,0,0|2,0,1]=4 658 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [1,0,0,0,0,0|1,0,0]=2 659 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [1,0,0,0,0,0|2,0,0]=3 660 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [1,0,0,0,0,0|2,0,1]=4 661 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [1,0,0,0,0,0|2,0,0]=3 662 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [1,0,0,0,0,0|1,0,0]=2 663 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,0,0,0,0,0|2,0,0]=3 664 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [1,0,0,0,0,0|0,0,0]=1 665 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [1,0,0,0,0,0|0,0,0]=1 666 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [1,0,0,0,0,0|1,0,0]=2 667 B6R0.3 CC[C@@H](N)C(C)C Amb24480517 [1,0,0,0,0,0|2,0,1]=4 668 B6R0.3 CC[C@@H](N)C(C)C Amb32665143 [1,0,0,0,0,0|2,0,1]=4 669 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [1,0,0,0,0,0|1,0,1]=3 670 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,0,0,0,0,0|1,0,0]=2 671 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,0,0,0,0,0|1,0,0]=2 672 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [1,0,0,0,0,0|1,0,1]=3 673 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [1,0,0,0,0,0|1,0,0]=2 674 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [1,0,0,0,0,0|2,0,0]=3 675 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [1,0,0,0,0,0|1,0,0]=2 676 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,0,0,0,0,0|2,0,1]=4 677 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [1,0,0,0,0,0|2,0,0]=3 678 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [1,0,0,0,0,0|1,0,0]=2 679 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [1,0,0,0,0,0|2,0,0]=3 680 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [1,0,0,0,0,0|1,0,0]=2 681 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [1,0,0,0,0,0|0,0,0]=1 682 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [1,0,0,0,0,0|0,0,0]=1 683 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [1,0,0,0,0,0|1,0,0]=2 684 B6R0.3 CC[C@H](N)C(C)C Amb27975596 [1,0,0,0,0,0|2,0,1]=4 685 B6R0.3 CC[C@H](N)C(C)C Amb31291137 [1,0,0,0,0,0|2,0,1]=4 686 B6R0.3 CC[C@H](N)C(F)F Amb28073533 [1,0,0,0,0,0|2,0,1]=4 687 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [1,0,0,0,0,0|1,0,0]=2 688 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [1,0,0,0,0,0|1,0,0]=2 689 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [1,0,0,0,0,0|1,0,1]=3 690 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [1,0,0,0,0,0|1,0,0]=2 691 B6R0.3 CC[C@H](O)[C@@H](C)O Amb27972258 [1,0,0,0,0,0|2,0,1]=4 692 B6R0.3 CC[C@H](O)[C@H](C)O Amb27664238 [1,0,0,0,0,0|2,0,1]=4 693 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [1,0,0,0,0,0|1,0,0]=2 694 B6R0.3 CN(C)C(N)CO Amb28399614 [1,0,0,0,0,0|2,0,1]=4 695 B6R0.3 CNC(=O)C(=O)O Amb2691295 [1,0,0,0,0,0|2,0,1]=4 696 B6R0.3 CNC(C)C(=O)O Amb19373699 [1,0,0,0,0,0|2,0,0]=3 697 B6R0.3 CNC(C)C(=O)O Amb9271766 [1,0,0,0,0,0|2,0,0]=3 698 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,0,0,0,0,0|3,0,0]=4 699 B6R0.3 CNC(C)C(N)=O Amb33527202 [1,0,0,0,0,0|3,0,0]=4 700 B6R0.3 CNC(C)C(N)=O Amb7758120 [1,0,0,0,0,0|3,0,0]=4 701 B6R0.3 CNC(O)C(=O)O Amb27229907 [1,0,0,0,0,0|2,0,0]=3 702 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [1,0,0,0,0,0|2,0,0]=3 703 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [1,0,0,0,0,0|2,0,0]=3 704 B6R0.3 CN[C@@H](C)C(C)O Amb29849613 [1,0,0,0,0,0|3,0,0]=4 705 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,0,0,0,0,0|3,0,0]=4 706 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,0,0,0,0,0|3,0,0]=4 707 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [1,0,0,0,0,0|2,0,0]=3 708 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,0,0,0,0,0|3,0,0]=4 709 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,0,0,0,0,0|3,0,0]=4 710 B6R0.3 COC(=O)C(=O)O Amb33545007 [1,0,0,0,0,0|2,0,1]=4 711 B6R0.3 COC(Br)C(=O)O Amb27439128 [1,0,0,0,0,0|2,0,0]=3 712 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.3 COC(C)C(=O)Cl Amb26005661 [1,0,0,0,0,0|3,0,0]=4 714 B6R0.3 COC(C)C(=O)O Amb9729215 [1,0,0,0,0,0|2,0,0]=3 715 B6R0.3 COC(C)C(C)=O Amb9666021 [1,0,0,0,0,0|3,0,0]=4 716 B6R0.3 COC(C)C(C)O Amb22757090 [1,0,0,0,0,0|3,0,0]=4 717 B6R0.3 COC(C)C(N)=O Amb6541307 [1,0,0,0,0,0|3,0,0]=4 718 B6R0.3 COC(C)[C@H](C)O Amb27805786 [1,0,0,0,0,0|3,0,0]=4 719 B6R0.3 COC(Cl)C(=O)O Amb28280799 [1,0,0,0,0,0|2,0,0]=3 720 B6R0.3 COC(Cl)C(C)=O Amb28118971 [1,0,0,0,0,0|3,0,0]=4 721 B6R0.3 COC(F)C(=O)O Amb27764863 [1,0,0,0,0,0|2,0,0]=3 722 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [1,0,0,0,0,0|2,0,1]=4 723 B6R0.3 COC(O)C(C)=O Amb27954086 [1,0,0,0,0,0|3,0,0]=4 724 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [1,0,0,0,0,0|3,0,0]=4 725 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [1,0,0,0,0,0|2,0,0]=3 726 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [1,0,0,0,0,0|3,0,0]=4 727 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [1,0,0,0,0,0|3,0,0]=4 728 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [1,0,0,0,0,0|2,0,0]=3 729 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [1,0,0,0,0,0|3,0,0]=4 730 B6R0.3 CSC(C)C(=O)O Amb6274567 [1,0,0,0,0,0|2,0,0]=3 731 B6R0.3 CSC(C)C(C)O Amb33550763 [1,0,0,0,0,0|3,0,0]=4 732 B6R0.3 CSC(C)C(N)=O Amb28047863 [1,0,0,0,0,0|3,0,0]=4 733 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [1,0,0,0,0,0|3,0,0]=4 734 B6R0.3 CSC(N)C(=O)O Amb28383509 [1,0,0,0,0,0|1,0,0]=2 735 B6R0.3 CS[C@@H](C)[C@H](C)O Amb27765798 [1,0,0,0,0,0|3,0,0]=4 736 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [1,0,0,0,0,0|2,0,0]=3 737 B6R0.3 C[C@@H](C=O)N(C)C Amb27268446 [1,0,0,0,0,0|3,0,0]=4 738 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [1,0,0,0,0,0|2,0,0]=3 739 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [1,0,0,0,0,0|2,0,0]=3 740 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [1,0,0,0,0,0|2,0,0]=3 741 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [1,0,0,0,0,0|2,0,0]=3 742 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [1,0,0,0,0,0|1,0,0]=2 743 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [1,0,0,0,0,0|2,0,0]=3 744 B6R0.3 C[C@@H](Cl)[C@H](Br)C=O Amb27858842 [1,0,0,0,0,0|2,0,0]=3 745 B6R0.3 C[C@@H](Cl)[C@H](O)CO Amb28137873 [1,0,0,0,0,0|2,0,1]=4 746 B6R0.3 C[C@@H](O)C(=N)NO Amb22587591 [1,0,0,0,0,0|1,0,2]=4 747 B6R0.3 C[C@@H](O)C(O)CN Amb28050484 [1,0,0,0,0,0|2,0,1]=4 748 B6R0.3 C[C@@H](O)[C@@H](N)CO Amb4493367 [1,0,0,0,0,0|0,0,1]=2 749 B6R0.3 C[C@@H](O)[C@@H](O)CO Amb28319973 [1,0,0,0,0,0|1,0,1]=3 750 B6R0.3 C[C@@H](O)[C@H](Br)CO Amb27955199 [1,0,0,0,0,0|1,0,1]=3 751 B6R0.3 C[C@@H](O)[C@H](C)C#N Amb27484706 [1,0,0,0,0,0|2,0,1]=4 752 B6R0.3 C[C@@H](O)[C@H](N)C=O Amb27657440 [1,0,0,0,0,0|0,0,0]=1 753 B6R0.3 C[C@@H](O)[C@H](N)CN Amb19374892 [1,0,0,0,0,0|1,0,1]=3 754 B6R0.3 C[C@@H](O)[C@H](N)CO Amb32661654 [1,0,0,0,0,0|0,0,1]=2 755 B6R0.3 C[C@@H](O)[C@H](N)CO Amb4489737 [1,0,0,0,0,0|0,0,1]=2 756 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [1,0,0,0,0,0|3,0,0]=4 757 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [1,0,0,0,0,0|2,0,0]=3 759 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,0,0,0,0,0|3,0,0]=4 760 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [1,0,0,0,0,0|2,0,0]=3 761 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [1,0,0,0,0,0|2,0,0]=3 762 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [1,0,0,0,0,0|2,0,0]=3 763 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [1,0,0,0,0,0|1,0,0]=2 764 B6R0.3 C[C@H](Cl)[C@H](O)CO Amb28458286 [1,0,0,0,0,0|2,0,1]=4 765 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [1,0,0,0,0,0|3,0,0]=4 766 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [1,0,0,0,0,0|3,0,0]=4 767 B6R0.3 C[C@H](O)C(=N)NO Amb22587550 [1,0,0,0,0,0|1,0,2]=4 768 B6R0.3 C[C@H](O)C(=O)CO Amb27838238 [1,0,0,0,0,0|1,0,2]=4 769 B6R0.3 C[C@H](O)[C@@H](N)CO Amb8516107 [1,0,0,0,0,0|0,0,1]=2 770 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [1,0,0,0,0,0|0,0,1]=2 771 B6R0.3 C[C@H](O)[C@H](O)C=O Amb28434698 [1,0,0,0,0,0|1,0,0]=2 772 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [1,0,0,0,0,0|3,0,0]=4 773 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [1,0,0,0,0,0|3,0,0]=4 774 B6R0.3 C\C(=C/Br)C(C)O Amb27848009 [1,0,0,0,0,0|2,0,1]=4 775 B6R0.3 C\C(=C/Cl)C(C)O Amb27233447 [1,0,0,0,0,0|2,0,1]=4 776 B6R0.3 C\C(=N/O)C(=O)O Amb28187271 [1,0,0,0,0,0|2,0,1]=4 777 B6R0.3 C\C(O)=C(/C)C=O Amb27238606 [1,0,0,0,0,0|1,0,2]=4 778 B6R0.3 C\C(O)=C(\Br)C=O Amb27643424 [1,0,0,0,0,0|1,0,2]=4 779 B6R0.3 C\C(O)=C(\C)C=O Amb27210577 [1,0,0,0,0,0|1,0,2]=4 780 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [1,0,0,0,0,0|1,0,2]=4 781 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [1,0,0,0,0,0|1,0,2]=4 782 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [1,0,0,0,0,0|1,0,2]=4 783 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [1,0,0,0,0,0|1,0,2]=4 784 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [1,0,0,0,0,0|1,0,2]=4 785 B6R0.3 C\C=C(\Br)[C@@H](C)O Amb28064198 [1,0,0,0,0,0|2,0,1]=4 786 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [1,0,0,0,0,0|1,0,2]=4 787 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [1,0,0,0,0,0|1,0,2]=4 788 B6R0.3 C\C=C(\Cl)C(C)O Amb28350374 [1,0,0,0,0,0|2,0,1]=4 789 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [1,0,0,0,0,0|1,0,2]=4 790 B6R0.3 N#CC(N)C(=O)O Amb25328320 [1,0,0,0,0,0|1,0,1]=3 791 B6R0.3 N#CC(N)C(N)=O Amb33544806 [1,0,0,0,0,0|2,0,1]=4 792 B6R0.3 N#CC(O)C(=O)O Amb27467286 [1,0,0,0,0,0|2,0,1]=4 793 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [1,0,0,0,0,0|3,0,0]=4 794 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,0,0,0,0,0|3,0,0]=4 795 B6R0.3 NC(=O)C(N)CO Amb17593097 [1,0,0,0,0,0|1,0,0]=2 796 B6R0.3 NC(=O)C(N)CO Amb2720301 [1,0,0,0,0,0|1,0,0]=2 797 B6R0.3 NC(=O)C(N)CS Amb18641990 [1,0,0,0,0,0|1,1,0]=3 798 B6R0.3 NC(=O)C(N)CS Amb33330875 [1,0,0,0,0,0|1,1,0]=3 799 B6R0.3 NC(=O)C(O)CO Amb27169520 [1,0,0,0,0,0|2,0,0]=3 800 B6R0.3 NC(=O)N(S)CO Amb27249862 [1,0,0,0,0,0|3,0,0]=4 801 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [1,0,0,0,0,0|1,0,0]=2 802 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [1,0,0,0,0,0|1,0,0]=2 803 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [1,0,0,0,0,0|1,1,0]=3 804 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [1,0,0,0,0,0|2,0,0]=3 805 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [1,0,0,0,0,0|1,0,0]=2 806 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [1,0,0,0,0,0|1,0,0]=2 807 B6R0.3 NC(=O)\C(N)=N\O Amb16186552 [1,0,0,0,0,0|2,0,1]=4 808 B6R0.3 NC(CCl)C(=O)O Amb19651457 [1,0,0,0,0,0|1,0,0]=2 809 B6R0.3 NC(CCl)C(=O)O Amb21961077 [1,0,0,0,0,0|1,0,0]=2 810 B6R0.3 NC(CF)C(=O)O Amb10839589 [1,0,0,0,0,0|1,0,0]=2 811 B6R0.3 NC(CO)C(=O)O Amb9702805 [1,0,0,0,0,0|0,0,0]=1 812 B6R0.3 NC(CO)C(F)F Amb27250856 [1,0,0,0,0,0|2,0,1]=4 813 B6R0.3 NC(CO)P(O)O Amb27953933 [1,0,0,0,0,0|1,0,1]=3 814 B6R0.3 NC(CP)C(=O)O Amb27234251 [1,0,0,0,0,0|1,0,0]=2 815 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [1,0,0,0,0,0|1,1,0]=3 816 B6R0.3 NC(CS)C(=O)O Amb13961966 [1,0,0,0,0,0|0,1,0]=2 817 B6R0.3 NC(CS)C(=O)O Amb22489523 [1,0,0,0,0,0|0,1,0]=2 818 B6R0.3 NC(CS)C(=O)O Amb6537913 [1,0,0,0,0,0|0,1,0]=2 819 B6R0.3 NC(CS)C(=O)O Amb6537914 [1,0,0,0,0,0|0,1,0]=2 820 B6R0.3 NC(CS)C(=O)S Amb27838279 [1,0,0,0,0,0|0,2,0]=3 821 B6R0.3 NC(CS)S(=O)O Amb27238568 [1,0,0,0,0,0|1,1,0]=3 822 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [1,0,0,0,0,0|1,0,0]=2 823 B6R0.3 NCC(Br)C(=O)O Amb28385732 [1,0,0,0,0,0|2,0,0]=3 824 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [1,0,0,0,0,0|2,0,0]=3 825 B6R0.3 NCC(F)C(=O)O Amb22733051 [1,0,0,0,0,0|2,0,0]=3 826 B6R0.3 NCC(F)C(=O)O Amb2688010 [1,0,0,0,0,0|2,0,0]=3 827 B6R0.3 NCC(F)C(N)=O Amb26984913 [1,0,0,0,0,0|3,0,0]=4 828 B6R0.3 NCC(F)C(N)=O Amb32667436 [1,0,0,0,0,0|3,0,0]=4 829 B6R0.3 NCC(N)C(=O)O Amb22899095 [1,0,0,0,0,0|1,0,0]=2 830 B6R0.3 NCC(N)C(=O)O Amb2697095 [1,0,0,0,0,0|1,0,0]=2 831 B6R0.3 NCC(N)C(=O)O Amb8514284 [1,0,0,0,0,0|1,0,0]=2 832 B6R0.3 NCC(O)C(=O)O Amb8517492 [1,0,0,0,0,0|2,0,0]=3 833 B6R0.3 NCC(O)C(N)=O Amb27164291 [1,0,0,0,0,0|3,0,0]=4 834 B6R0.3 NCC(O)C(N)=O Amb28827639 [1,0,0,0,0,0|3,0,0]=4 835 B6R0.3 NCC(S)C(=O)O Amb17593238 [1,0,0,0,0,0|2,0,0]=3 836 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [1,0,0,0,0,0|2,0,0]=3 837 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [1,0,0,0,0,0|2,0,0]=3 838 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [1,0,0,0,0,0|1,0,0]=2 839 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [1,0,0,0,0,0|1,0,0]=2 840 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [1,0,0,0,0,0|2,0,0]=3 841 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [1,0,0,0,0,0|2,0,0]=3 842 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [1,0,0,0,0,0|3,0,0]=4 843 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [1,0,0,0,0,0|2,0,0]=3 844 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [1,0,0,0,0,0|2,0,0]=3 845 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [1,0,0,0,0,0|1,0,0]=2 846 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [1,0,0,0,0,0|1,0,0]=2 847 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [1,0,0,0,0,0|1,0,0]=2 848 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [1,0,0,0,0,0|2,0,0]=3 849 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [1,0,0,0,0,0|3,0,0]=4 850 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [1,0,0,0,0,0|0,1,1]=3 851 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [1,0,0,0,0,0|1,0,0]=2 852 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [1,0,0,0,0,0|1,0,0]=2 853 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [1,0,0,0,0,0|1,0,0]=2 854 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [1,0,0,0,0,0|0,0,0]=1 855 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [1,0,0,0,0,0|0,0,0]=1 856 B6R0.3 N[C@@H](CO)C(F)F Amb27202123 [1,0,0,0,0,0|2,0,1]=4 857 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [1,0,0,0,0,0|0,1,0]=2 858 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [1,0,0,0,0,0|0,1,0]=2 859 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [1,0,0,0,0,0|0,1,0]=2 860 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [1,0,0,0,0,0|1,1,0]=3 861 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [1,0,0,0,0,0|0,1,0]=2 862 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [1,0,0,0,0,0|2,0,0]=3 863 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [1,0,0,0,0,0|1,0,0]=2 864 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [1,0,0,0,0,0|1,0,0]=2 865 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [1,0,0,0,0,0|1,0,0]=2 866 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [1,0,0,0,0,0|0,0,0]=1 867 B6R0.3 N[C@H](CO)C(F)F Amb33337773 [1,0,0,0,0,0|2,0,1]=4 868 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [1,0,0,0,0,0|1,1,0]=3 869 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [1,0,0,0,0,0|0,1,0]=2 870 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [1,0,0,0,0,0|0,1,0]=2 871 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [1,0,0,0,0,0|0,1,0]=2 872 B6R0.3 N\C(=N/O)C(=O)O Amb24670890 [1,0,0,0,0,0|1,0,1]=3 873 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [1,0,0,0,0,0|3,0,0]=4 874 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [1,0,0,0,0,0|3,0,0]=4 875 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [1,0,0,0,0,0|3,0,0]=4 876 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [1,0,0,0,0,0|3,0,0]=4 877 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [1,0,0,0,0,0|2,0,1]=4 878 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [1,0,0,0,0,0|2,0,1]=4 879 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [1,0,0,0,0,0|2,0,1]=4 880 B6R0.3 O=C(O)C(=O)CI Amb27659477 [1,0,0,0,0,0|2,0,1]=4 881 B6R0.3 O=C(O)C(=O)CO Amb6600025 [1,0,0,0,0,0|1,0,1]=3 882 B6R0.3 O=C(O)C(=O)CS Amb6600041 [1,0,0,0,0,0|1,1,1]=4 883 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [1,0,0,0,0,0|2,0,0]=3 884 B6R0.3 O=C(O)C(Br)CF Amb10605519 [1,0,0,0,0,0|2,0,0]=3 885 B6R0.3 O=C(O)C(Br)CO Amb18126327 [1,0,0,0,0,0|1,0,0]=2 886 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [1,0,0,0,0,0|2,0,0]=3 887 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [1,0,0,0,0,0|1,0,0]=2 888 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [1,0,0,0,0,0|1,1,0]=3 889 B6R0.3 O=C(O)C(F)CO Amb17593117 [1,0,0,0,0,0|1,0,0]=2 890 B6R0.3 O=C(O)C(O)CBr Amb24061932 [1,0,0,0,0,0|2,0,0]=3 891 B6R0.3 O=C(O)C(O)CCl Amb6371692 [1,0,0,0,0,0|2,0,0]=3 892 B6R0.3 O=C(O)C(O)CF Amb27476477 [1,0,0,0,0,0|2,0,0]=3 893 B6R0.3 O=C(O)C(O)CO Amb17593103 [1,0,0,0,0,0|1,0,0]=2 894 B6R0.3 O=C(O)C(O)CS Amb18642053 [1,0,0,0,0,0|1,1,0]=3 895 B6R0.3 O=C(O)C(S)CS Amb18643295 [1,0,0,0,0,0|1,1,0]=3 896 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [1,0,0,0,0,0|1,0,0]=2 897 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [1,0,0,0,0,0|1,0,0]=2 898 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [1,0,0,0,0,0|2,0,0]=3 899 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [1,0,0,0,0,0|2,0,0]=3 900 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [1,0,0,0,0,0|2,0,0]=3 901 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [1,0,0,0,0,0|1,0,0]=2 902 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [1,0,0,0,0,0|1,0,0]=2 903 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [1,0,0,0,0,0|2,0,0]=3 904 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [1,0,0,0,0,0|2,0,0]=3 905 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [1,0,0,0,0,0|1,0,0]=2 906 B6R0.3 O=C(O)\C(Br)=N\O Amb26949828 [1,0,0,0,0,0|2,0,1]=4 907 B6R0.3 O=C(O)\C(Cl)=C/O Amb24479774 [1,0,0,0,0,0|1,0,2]=4 908 B6R0.3 O=C(O)\C(Cl)=N\O Amb25839923 [1,0,0,0,0,0|2,0,1]=4 909 B6R0.3 O=C(O)\C(O)=C/O Amb27220871 [1,0,0,0,0,0|1,0,2]=4 910 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [1,0,0,0,0,0|1,0,2]=4 911 B6R0.3 O=CC(F)C(=O)O Amb22055301 [1,0,0,0,0,0|1,0,2]=4 912 B6R0.3 O=CC(O)C(F)F Amb27251635 [1,0,0,0,0,0|3,0,0]=4 913 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [1,0,0,0,0,0|1,0,2]=4 914 B6R0.3 O=C[C@@H](O)C(F)F Amb27256277 [1,0,0,0,0,0|3,0,0]=4 915 B6R0.3 O=[N+]([O-])C(Br)CO Amb24479795 [1,0,0,0,0,0|2,0,1]=4 916 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [1,0,0,0,0,0|2,0,1]=4 917 B8R0.2 C#CC(=O)[C@@H](N)C(C)C Amb35617525 [0,1,0,0,0,0|2,0,0]=3 918 B8R0.2 C#CC(=O)[C@H](N)C(C)C Amb35617735 [0,1,0,0,0,0|2,0,0]=3 919 B8R0.2 C#CC(O)[C@@H](N)C(C)C Amb35737512 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.2 C#CC(O)[C@H](N)C(C)C Amb35582951 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.2 C#C[C@@H](C)[C@H](C)C(=O)O Amb27257738 [0,1,0,0,0,0|2,0,0]=3 922 B8R0.2 C#C[C@H](C)[C@@H](O)C(=O)O Amb27777980 [0,1,0,0,0,0|2,0,0]=3 923 B8R0.2 C=C(C(=O)CC)C(C)O Amb27984022 [0,1,0,0,0,0|2,0,1]=4 924 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,1,0,0,0,0|2,0,1]=4 925 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [0,1,0,0,0,0|1,0,1]=3 926 B8R0.2 C=C(C(=O)OC)C(C)Br Amb27878767 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.2 C=C(C(=O)OC)[C@@H](C)O Amb27956621 [0,1,0,0,0,0|1,0,1]=3 928 B8R0.2 C=C(C(C)=O)[C@@H](O)CC Amb27165607 [0,1,0,0,0,0|2,0,1]=4 929 B8R0.2 C=C(C(C)=O)[C@H](C)CO Amb28202165 [0,1,0,0,0,0|2,0,1]=4 930 B8R0.2 C=C(C(C)=O)[C@H](O)CC Amb27634796 [0,1,0,0,0,0|2,0,1]=4 931 B8R0.2 C=C(C)C(C)C(O)CC Amb28401073 [0,1,0,0,0,0|3,0,0]=4 932 B8R0.2 C=C(C)C(C)C(O)CO Amb27956458 [0,1,0,0,0,0|3,0,0]=4 933 B8R0.2 C=C(C)C(Cl)C(=O)OC Amb27955894 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.2 C=C(C)C(N)C(=O)OC Amb25888625 [0,1,0,0,0,0|1,0,1]=3 935 B8R0.2 C=C(C)C(N)C(C)CC Amb27760262 [0,1,0,0,0,0|3,0,0]=4 936 B8R0.2 C=C(C)C(N)C(C)OC Amb27593425 [0,1,0,0,0,0|2,0,0]=3 937 B8R0.2 C=C(C)[C@@H](C)[C@@H](O)CC Amb28319535 [0,1,0,0,0,0|3,0,0]=4 938 B8R0.2 C=C(C)[C@@H](O)[C@H](C)CO Amb27825917 [0,1,0,0,0,0|3,0,0]=4 939 B8R0.2 C=C(C)[C@H](N)C(=O)OC Amb27883320 [0,1,0,0,0,0|1,0,1]=3 940 B8R0.2 C=C(C)[C@H](O)[C@@H](C)CO Amb28139290 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.2 C=C(CC)C(C)C(C)O Amb27956475 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.2 C=C(CC)[C@H](C)[C@@H](C)O Amb27662316 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.2 C=C(CO)[C@H](C)[C@H](C)O Amb28049166 [0,1,0,0,0,0|2,0,0]=3 944 B8R0.2 C=C=C(C)C(O)C(=O)O Amb28284623 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.2 C=CC(=C)C(N)C(=O)O Amb28323133 [0,1,0,0,0,0|1,0,2]=4 946 B8R0.2 C=CC(=O)C(C)C(C)N Amb28076481 [0,1,0,0,0,0|3,0,0]=4 947 B8R0.2 C=CC(=O)[C@@H](N)C(C)C Amb35617526 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.2 C=CC(=O)[C@H](N)C(C)C Amb35617737 [0,1,0,0,0,0|2,0,0]=3 949 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [0,1,0,0,0,0|2,0,0]=3 950 B8R0.2 C=CC(C)C(C)C(N)=O Amb27835599 [0,1,0,0,0,0|3,0,0]=4 951 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [0,1,0,0,0,0|1,0,0]=2 952 B8R0.2 C=CC(C)C(N)C(N)=O Amb25993208 [0,1,0,0,0,0|2,0,0]=3 953 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [0,1,0,0,0,0|1,0,0]=2 955 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [0,1,0,0,0,0|1,0,0]=2 956 B8R0.2 C=CC(N)C(C)C(=O)O Amb33036213 [0,1,0,0,0,0|2,0,1]=4 957 B8R0.2 C=CC(O)C(C)C(=O)O Amb18642774 [0,1,0,0,0,0|1,0,1]=3 958 B8R0.2 C=CC(O)C(N)C(=O)O Amb18642830 [0,1,0,0,0,0|0,0,1]=2 959 B8R0.2 C=CC(O)[C@@H](N)C(C)C Amb29849508 [0,1,0,0,0,0|2,0,1]=4 960 B8R0.2 C=CC(O)[C@H](N)C(=O)O Amb28429839 [0,1,0,0,0,0|0,0,1]=2 961 B8R0.2 C=CC(O)[C@H](N)C(C)C Amb35623854 [0,1,0,0,0,0|2,0,1]=4 962 B8R0.2 C=CS(=O)[C@H](C)[C@H](C)O Amb28315527 [0,1,0,0,0,0|3,0,0]=4 963 B8R0.2 C=C[C@@H](C)[C@H](C)C(C)=O Amb25986022 [0,1,0,0,0,0|3,0,0]=4 964 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [0,1,0,0,0,0|1,0,0]=2 965 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [0,1,0,0,0,0|2,0,0]=3 966 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [0,1,0,0,0,0|1,0,0]=2 967 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [0,1,0,0,0,0|2,0,0]=3 968 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [0,1,0,0,0,0|2,0,0]=3 969 B8R0.2 C=C[C@H](O)[C@@H](C)C(=O)O Amb28422977 [0,1,0,0,0,0|1,0,1]=3 970 B8R0.2 C=C[C@H](O)[C@@H](N)C(=O)O Amb27236340 [0,1,0,0,0,0|0,0,1]=2 971 B8R0.2 C=C[C@H](O)[C@@H](N)C(C)C Amb27814982 [0,1,0,0,0,0|2,0,1]=4 972 B8R0.2 C=C[C@H](O)[C@H](C)C(=O)O Amb28285106 [0,1,0,0,0,0|1,0,1]=3 973 B8R0.2 CC(=O)C(=O)C(O)CO Amb25830733 [0,1,0,0,0,0|2,0,1]=4 974 B8R0.2 CC(=O)C(=O)[C@@H](O)CO Amb25697046 [0,1,0,0,0,0|2,0,1]=4 975 B8R0.2 CC(=O)C(=O)[C@H](O)CO Amb27490779 [0,1,0,0,0,0|2,0,1]=4 976 B8R0.2 CC(=O)C(C)C(C)C#N Amb27838666 [0,1,0,0,0,0|3,0,0]=4 977 B8R0.2 CC(=O)C(C)C(C)C=O Amb27643957 [0,1,0,0,0,0|2,0,1]=4 978 B8R0.2 CC(=O)C(C)C(N)CO Amb27186035 [0,1,0,0,0,0|3,0,0]=4 979 B8R0.2 CC(=O)C(C)\C(C)=N\O Amb27599356 [0,1,0,0,0,0|2,0,1]=4 980 B8R0.2 CC(=O)C(O)C(O)CO Amb26636819 [0,1,0,0,0,0|2,0,0]=3 981 B8R0.2 CC(=O)N(C)C(C)CO Amb27628421 [0,1,0,0,0,0|3,0,0]=4 982 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO Amb26654815 [0,1,0,0,0,0|2,0,0]=3 983 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,1,0,0,0,0|1,0,2]=4 984 B8R0.2 CC(=O)[C@H](O)[C@@H](O)CO Amb28201025 [0,1,0,0,0,0|2,0,0]=3 985 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,1,0,0,0,0|2,0,0]=3 986 B8R0.2 CC(C#N)C(N)C(=O)O Amb33065998 [0,1,0,0,0,0|1,0,0]=2 987 B8R0.2 CC(C#N)C(N)C(N)=O Amb33127595 [0,1,0,0,0,0|2,0,0]=3 988 B8R0.2 CC(C#N)[C@@H](N)C(=O)O Amb33308709 [0,1,0,0,0,0|1,0,0]=2 989 B8R0.2 CC(C#N)[C@H](N)C(=O)O Amb33308645 [0,1,0,0,0,0|1,0,0]=2 990 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,1,0,0,0,0|2,0,0]=3 991 B8R0.2 CC(C(=O)O)N(C)C=O Amb18284942 [0,1,0,0,0,0|2,0,1]=4 992 B8R0.2 CC(C)C(Br)C(=O)CBr Amb26007156 [0,1,0,0,0,0|3,0,0]=4 993 B8R0.2 CC(C)C(Br)C(=O)NO Amb28137656 [0,1,0,0,0,0|2,0,0]=3 994 B8R0.2 CC(C)C(C)C(=O)CBr Amb28388772 [0,1,0,0,0,0|3,0,0]=4 995 B8R0.2 CC(C)C(C)C(O)C=O Amb27758170 [0,1,0,0,0,0|2,0,1]=4 996 B8R0.2 CC(C)C(F)C(=O)CN Amb27642925 [0,1,0,0,0,0|3,0,0]=4 997 B8R0.2 CC(C)C(N)C(=O)CO Amb27202150 [0,1,0,0,0,0|1,0,0]=2 998 B8R0.2 CC(C)C(N)C(=O)NN Amb18061950 [0,1,0,0,0,0|2,0,0]=3 999 B8R0.2 CC(C)C(N)C(=O)NO Amb2439843 [0,1,0,0,0,0|1,0,0]=2 1000 B8R0.2 CC(C)C(N)C(=O)OBr Amb28137372 [0,1,0,0,0,0|1,0,0]=2 1001 B8R0.2 CC(C)C(N)C(O)C#N Amb27866568 [0,1,0,0,0,0|2,0,1]=4 1002 B8R0.2 CC(C)C(N)C(O)CCl Amb27792171 [0,1,0,0,0,0|2,0,1]=4 1003 B8R0.2 CC(C)C(N)\C(N)=N\O Amb25967017 [0,1,0,0,0,0|2,0,0]=3 1004 B8R0.2 CC(C)C(O)\C(N)=N/O Amb19737368 [0,1,0,0,0,0|3,0,0]=4 1005 B8R0.2 CC(C)[C@H](N)C(=O)CCl Amb28423857 [0,1,0,0,0,0|2,0,0]=3 1006 B8R0.2 CC(C)[C@H](N)C(=O)NN Amb27628835 [0,1,0,0,0,0|2,0,0]=3 1007 B8R0.2 CC(C)[C@H](O)C(=O)NN Amb27956618 [0,1,0,0,0,0|3,0,0]=4 1008 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [0,1,0,0,0,0|1,0,0]=2 1009 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,1,0,0,0,0|2,0,0]=3 1010 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,1,0,0,0,0|2,0,0]=3 1011 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,1,0,0,0,0|2,0,0]=3 1012 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,1,0,0,0,0|2,0,0]=3 1013 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [0,1,0,0,0,0|1,0,0]=2 1014 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [0,1,0,0,0,0|0,0,0]=1 1015 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [0,1,0,0,0,0|1,0,0]=2 1016 B8R0.2 CC(CO)C(O)[C@@H](C)O Amb28345360 [0,1,0,0,0,0|2,0,1]=4 1017 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [0,1,0,0,0,0|0,0,0]=1 1018 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [0,1,0,0,0,0|0,0,0]=1 1019 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [0,1,0,0,0,0|1,1,0]=3 1020 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [0,1,0,0,0,0|1,0,0]=2 1021 B8R0.2 CC(O)C(C)C(=O)CO Amb27948718 [0,1,0,0,0,0|1,0,0]=2 1022 B8R0.2 CC(O)C(C)C(C)CO Amb27218307 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.2 CC(O)C(C)N(C)N=O Amb27956569 [0,1,0,0,0,0|3,0,0]=4 1024 B8R0.2 CC(O)C(N)\C(O)=N\O Amb24539768 [0,1,0,0,0,0|0,0,1]=2 1025 B8R0.2 CC(O)C(O)C(=O)C=O Amb27476247 [0,1,0,0,0,0|1,0,1]=3 1026 B8R0.2 CC(O)C(O)C(=O)CO Amb27785801 [0,1,0,0,0,0|1,0,0]=2 1027 B8R0.2 CC(O)C(O)C(O)C=O Amb24711583 [0,1,0,0,0,0|1,0,1]=3 1028 B8R0.2 CC(O)[C@@H](O)[C@@H](C)CO Amb27763837 [0,1,0,0,0,0|2,0,1]=4 1029 B8R0.2 CC(O)[C@H](O)C(=O)CO Amb27227013 [0,1,0,0,0,0|1,0,0]=2 1030 B8R0.2 CC(O)[C@H](O)[C@@H](O)CO Amb28049155 [0,1,0,0,0,0|1,0,2]=4 1031 B8R0.2 CCC(=O)C(C)C(C)O Amb26509261 [0,1,0,0,0,0|2,0,0]=3 1032 B8R0.2 CCC(=O)C(N)C(C)C Amb23536939 [0,1,0,0,0,0|2,0,0]=3 1033 B8R0.2 CCC(=O)N(N)C(C)C Amb33191468 [0,1,0,0,0,0|3,0,0]=4 1034 B8R0.2 CCC(=O)[C@@H](C)[C@@H](C)O Amb27211930 [0,1,0,0,0,0|2,0,0]=3 1035 B8R0.2 CCC(=O)[C@@H](C)[C@H](C)O Amb27432902 [0,1,0,0,0,0|2,0,0]=3 1036 B8R0.2 CCC(=O)[C@H](N)C(C)C Amb30022955 [0,1,0,0,0,0|2,0,0]=3 1037 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [0,1,0,0,0,0|0,1,1]=3 1038 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [0,1,0,0,0,0|2,0,1]=4 1039 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,1,0,0,0,0|2,0,0]=3 1041 B8R0.2 CCC(C)C(Br)C(N)=O Amb27472685 [0,1,0,0,0,0|3,0,0]=4 1042 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,1,0,0,0,0|2,0,0]=3 1043 B8R0.2 CCC(C)C(C)C(C)=O Amb4035878 [0,1,0,0,0,0|3,0,0]=4 1044 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,1,0,0,0,0|2,0,0]=3 1045 B8R0.2 CCC(C)C(Cl)C(N)=O Amb27771780 [0,1,0,0,0,0|3,0,0]=4 1046 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,1,0,0,0,0|1,0,0]=2 1047 B8R0.2 CCC(C)C(N)C(C)O Amb18832525 [0,1,0,0,0,0|2,0,1]=4 1048 B8R0.2 CCC(C)C(N)C(N)=O Amb1105283 [0,1,0,0,0,0|2,0,0]=3 1049 B8R0.2 CCC(C)C(N)C(N)=O Amb1152621 [0,1,0,0,0,0|2,0,0]=3 1050 B8R0.2 CCC(C)C(N)C(N)=O Amb33551930 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.2 CCC(C)C(N)C(N)=S Amb19374909 [0,1,0,0,0,0|2,1,0]=4 1052 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,1,0,0,0,0|2,0,0]=3 1053 B8R0.2 CCC(C)C(O)C(N)=O Amb24112761 [0,1,0,0,0,0|3,0,0]=4 1054 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,1,0,0,0,0|2,0,0]=3 1055 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,1,0,0,0,0|2,0,0]=3 1056 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,1,0,0,0,0|1,0,0]=2 1057 B8R0.2 CCC(C)[C@H](Br)C(=O)Cl Amb27166137 [0,1,0,0,0,0|3,0,0]=4 1058 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,1,0,0,0,0|2,0,0]=3 1059 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,1,0,0,0,0|2,0,0]=3 1060 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,1,0,0,0,0|2,0,0]=3 1061 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,1,0,0,0,0|1,0,0]=2 1062 B8R0.2 CCC(C)[C@H](N)C(C)=O Amb35617474 [0,1,0,0,0,0|2,0,0]=3 1063 B8R0.2 CCC(C)[C@H](N)C(C)O Amb35588414 [0,1,0,0,0,0|2,0,1]=4 1064 B8R0.2 CCC(Cl)C(C)C(C)=O Amb27983787 [0,1,0,0,0,0|3,0,0]=4 1065 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [0,1,0,0,0,0|2,0,1]=4 1066 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [0,1,0,0,0,0|2,0,0]=3 1067 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [0,1,0,0,0,0|2,0,0]=3 1068 B8R0.2 CCC(N)C(O)C(N)=O Amb28055940 [0,1,0,0,0,0|3,0,0]=4 1069 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [0,1,0,0,0,0|1,0,0]=2 1070 B8R0.2 CCC(O)C(C)C(C)=O Amb26336386 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.2 CCC(O)C(C)[N+](=O)[O-] Amb17618435 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [0,1,0,0,0,0|1,0,0]=2 1073 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [0,1,0,0,0,0|0,0,0]=1 1074 B8R0.2 CCC(O)C(O)C(C)O Amb27456333 [0,1,0,0,0,0|2,0,1]=4 1075 B8R0.2 CCC(O)[C@@H](N)C(C)C Amb35623967 [0,1,0,0,0,0|2,0,1]=4 1076 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [0,1,0,0,0,0|0,0,0]=1 1077 B8R0.2 CCC(O)[C@H](N)C(C)C Amb35623663 [0,1,0,0,0,0|2,0,1]=4 1078 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [0,1,0,0,0,0|3,0,0]=4 1079 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [0,1,0,0,0,0|3,0,0]=4 1080 B8R0.2 CCN(N)C(C)C(=O)O Amb27655613 [0,1,0,0,0,0|3,0,0]=4 1081 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,1,0,0,0,0|2,0,0]=3 1082 B8R0.2 CC[C@@H](C)[C@@H](Br)C(=O)Cl Amb27194351 [0,1,0,0,0,0|3,0,0]=4 1083 B8R0.2 CC[C@@H](C)[C@@H](C)C(C)=O Amb27949165 [0,1,0,0,0,0|3,0,0]=4 1084 B8R0.2 CC[C@@H](C)[C@@H](C)C(N)=O Amb28049888 [0,1,0,0,0,0|3,0,0]=4 1085 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,1,0,0,0,0|2,0,0]=3 1086 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,1,0,0,0,0|2,0,0]=3 1087 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,1,0,0,0,0|1,0,0]=2 1088 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,1,0,0,0,0|2,0,0]=3 1089 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,1,0,0,0,0|2,0,0]=3 1090 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,1,0,0,0,0|3,0,0]=4 1091 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,1,0,0,0,0|1,0,0]=2 1092 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [0,1,0,0,0,0|1,0,0]=2 1093 B8R0.2 CC[C@@H](O)[C@@H](C)C(C)=O Amb26600956 [0,1,0,0,0,0|2,0,0]=3 1094 B8R0.2 CC[C@@H](O)[C@H](C)[C@H](C)O Amb27946609 [0,1,0,0,0,0|2,0,1]=4 1095 B8R0.2 CC[C@@H](O)[C@H](O)C(C)=O Amb27861441 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.2 CC[C@@H](O)[C@H](O)C(C)O Amb28049151 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [0,1,0,0,0,0|2,0,0]=3 1098 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,1,0,0,0,0|2,0,1]=4 1099 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,1,0,0,0,0|2,0,0]=3 1100 B8R0.2 CC[C@H](C)C(C)C(N)=O Amb28049537 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,1,0,0,0,0|1,0,0]=2 1102 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.2 CC[C@H](C)[C@@H](C)C(C)=O Amb27250604 [0,1,0,0,0,0|3,0,0]=4 1104 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,1,0,0,0,0|1,0,0]=2 1106 B8R0.2 CC[C@H](C)[C@H](Br)C(N)=O Amb27235575 [0,1,0,0,0,0|3,0,0]=4 1107 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)Cl Amb27768651 [0,1,0,0,0,0|3,0,0]=4 1108 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,1,0,0,0,0|2,0,0]=3 1109 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,1,0,0,0,0|1,0,0]=2 1110 B8R0.2 CC[C@H](C)[C@H](N)C(C)O Amb35737490 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb10878815 [0,1,0,0,0,0|2,0,0]=3 1112 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb9813724 [0,1,0,0,0,0|2,0,0]=3 1113 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,1,0,0,0,0|2,0,0]=3 1114 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [0,1,0,0,0,0|2,0,0]=3 1115 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [0,1,0,0,0,0|0,0,0]=1 1116 B8R0.2 CC[C@H](O)[C@@H](O)[C@@H](C)O Amb28454611 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [0,1,0,0,0,0|1,0,0]=2 1118 B8R0.2 CC[C@H](O)[C@H](C)C(C)=O Amb27590145 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [0,1,0,0,0,0|0,0,0]=1 1120 B8R0.2 CC[C@H](O)[C@H](O)[C@@H](C)O Amb28321543 [0,1,0,0,0,0|2,0,1]=4 1121 B8R0.2 CC\C(O)=C(\C)C(=O)O Amb27253362 [0,1,0,0,0,0|1,0,2]=4 1122 B8R0.2 CNC(=O)C(C)C(=O)O Amb26367215 [0,1,0,0,0,0|1,0,2]=4 1123 B8R0.2 CNC(=O)C(N)C(C)C Amb33549803 [0,1,0,0,0,0|2,0,0]=3 1124 B8R0.2 CNC(=O)C(N)C(C)C Amb9727630 [0,1,0,0,0,0|2,0,0]=3 1125 B8R0.2 CNC(=O)C(N)C(C)O Amb24705029 [0,1,0,0,0,0|1,0,0]=2 1126 B8R0.2 CNC(=O)C(O)C(C)C Amb24743373 [0,1,0,0,0,0|3,0,0]=4 1127 B8R0.2 CNC(=O)[C@@H](N)C(C)C Amb17231869 [0,1,0,0,0,0|2,0,0]=3 1128 B8R0.2 CNC(=O)[C@@H](N)C(C)C Amb30585154 [0,1,0,0,0,0|2,0,0]=3 1129 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O Amb24671233 [0,1,0,0,0,0|1,0,0]=2 1130 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O Amb30867960 [0,1,0,0,0,0|1,0,0]=2 1131 B8R0.2 CNC(=O)[C@@H](N)[C@H](C)O Amb27782895 [0,1,0,0,0,0|1,0,0]=2 1132 B8R0.2 CNC(=O)[C@H](N)C(C)C Amb32414606 [0,1,0,0,0,0|2,0,0]=3 1133 B8R0.2 CNC(=O)[C@H](N)[C@H](C)O Amb28421858 [0,1,0,0,0,0|1,0,0]=2 1134 B8R0.2 CNC(C)C(C)C(C)=O Amb27202218 [0,1,0,0,0,0|3,0,0]=4 1135 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [0,1,0,0,0,0|1,0,0]=2 1136 B8R0.2 CNC(C)C(O)C(N)=O Amb28366769 [0,1,0,0,0,0|3,0,0]=4 1137 B8R0.2 COC(=N)C(C)C(C)C Amb27261046 [0,1,0,0,0,0|3,0,0]=4 1138 B8R0.2 COC(=O)C(=O)C(C)Br Amb17621489 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.2 COC(=O)C(=O)C(C)C Amb17935756 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.2 COC(=O)C(=O)C(C)Cl Amb27239406 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.2 COC(=O)C(Br)C(C)=O Amb22499701 [0,1,0,0,0,0|1,0,2]=4 1142 B8R0.2 COC(=O)C(Br)C(C)Br Amb495553 [0,1,0,0,0,0|2,0,0]=3 1143 B8R0.2 COC(=O)C(Br)C(C)C Amb6892152 [0,1,0,0,0,0|2,0,0]=3 1144 B8R0.2 COC(=O)C(C)C(=O)O Amb33545071 [0,1,0,0,0,0|1,0,2]=4 1145 B8R0.2 COC(=O)C(C)C(C)=O Amb17939472 [0,1,0,0,0,0|1,0,2]=4 1146 B8R0.2 COC(=O)C(C)C(C)C Amb4044380 [0,1,0,0,0,0|2,0,0]=3 1147 B8R0.2 COC(=O)C(C)C(C)N Amb18642841 [0,1,0,0,0,0|2,0,0]=3 1148 B8R0.2 COC(=O)C(C)C(C)O Amb22059109 [0,1,0,0,0,0|1,0,0]=2 1149 B8R0.2 COC(=O)C(C)C(C)S Amb25682049 [0,1,0,0,0,0|1,1,0]=3 1150 B8R0.2 COC(=O)C(C)N(C)C Amb8455327 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.2 COC(=O)C(C)N(C)O Amb27620113 [0,1,0,0,0,0|2,0,0]=3 1152 B8R0.2 COC(=O)C(C)S(=O)O Amb27858607 [0,1,0,0,0,0|3,0,0]=4 1153 B8R0.2 COC(=O)C(Cl)C(C)Cl Amb5720898 [0,1,0,0,0,0|2,0,0]=3 1154 B8R0.2 COC(=O)C(Cl)C(C)O Amb25269533 [0,1,0,0,0,0|1,0,0]=2 1155 B8R0.2 COC(=O)C(Cl)C(Cl)Cl Amb27444582 [0,1,0,0,0,0|3,0,0]=4 1156 B8R0.2 COC(=O)C(F)C(C)=O Amb25887225 [0,1,0,0,0,0|1,0,2]=4 1157 B8R0.2 COC(=O)C(F)C(C)Cl Amb27955227 [0,1,0,0,0,0|2,0,0]=3 1158 B8R0.2 COC(=O)C(F)C(C)N Amb27625216 [0,1,0,0,0,0|2,0,0]=3 1159 B8R0.2 COC(=O)C(N)=C(C)C Amb28057573 [0,1,0,0,0,0|1,0,2]=4 1160 B8R0.2 COC(=O)C(N)C(=O)O Amb27487566 [0,1,0,0,0,0|0,0,2]=3 1161 B8R0.2 COC(=O)C(N)C(C)=O Amb21520335 [0,1,0,0,0,0|0,0,2]=3 1162 B8R0.2 COC(=O)C(N)C(C)=O Amb22491080 [0,1,0,0,0,0|0,0,2]=3 1163 B8R0.2 COC(=O)C(N)C(C)C Amb16233843 [0,1,0,0,0,0|1,0,0]=2 1164 B8R0.2 COC(=O)C(N)C(C)C Amb2720229 [0,1,0,0,0,0|1,0,0]=2 1165 B8R0.2 COC(=O)C(N)C(C)C Amb9702768 [0,1,0,0,0,0|1,0,0]=2 1166 B8R0.2 COC(=O)C(N)C(C)F Amb27390643 [0,1,0,0,0,0|1,0,0]=2 1167 B8R0.2 COC(=O)C(N)C(C)O Amb4005044 [0,1,0,0,0,0|0,0,0]=1 1168 B8R0.2 COC(=O)C(N)C(C)O Amb9204482 [0,1,0,0,0,0|0,0,0]=1 1169 B8R0.2 COC(=O)C(N)C(F)F Amb25208569 [0,1,0,0,0,0|2,0,0]=3 1170 B8R0.2 COC(=O)C(O)C(C)Br Amb27232794 [0,1,0,0,0,0|2,0,0]=3 1171 B8R0.2 COC(=O)C(O)C(C)C Amb24093829 [0,1,0,0,0,0|2,0,0]=3 1172 B8R0.2 COC(=O)C(O)C(C)N Amb27596094 [0,1,0,0,0,0|2,0,0]=3 1173 B8R0.2 COC(=O)C(O)C(C)O Amb27410609 [0,1,0,0,0,0|1,0,0]=2 1174 B8R0.2 COC(=O)C(O)C(F)F Amb24747328 [0,1,0,0,0,0|3,0,0]=4 1175 B8R0.2 COC(=O)C(S)C(C)C Amb28350746 [0,1,0,0,0,0|2,0,0]=3 1176 B8R0.2 COC(=O)C([NH3+])C(C)O Amb33513068 [0,1,0,0,0,0|0,0,1]=2 1177 B8R0.2 COC(=O)N(C)C(C)C Amb28324612 [0,1,0,0,0,0|3,0,0]=4 1178 B8R0.2 COC(=O)N(N)C(C)C Amb33191565 [0,1,0,0,0,0|2,0,0]=3 1179 B8R0.2 COC(=O)[C@@H](Br)C(C)C Amb27955279 [0,1,0,0,0,0|2,0,0]=3 1180 B8R0.2 COC(=O)[C@@H](Br)[C@@H](C)Cl Amb28436749 [0,1,0,0,0,0|2,0,0]=3 1181 B8R0.2 COC(=O)[C@@H](Cl)[C@@H](C)O Amb27831417 [0,1,0,0,0,0|1,0,0]=2 1182 B8R0.2 COC(=O)[C@@H](Cl)[C@H](C)O Amb33741900 [0,1,0,0,0,0|1,0,0]=2 1183 B8R0.2 COC(=O)[C@@H](N)C(C)C Amb2719737 [0,1,0,0,0,0|1,0,0]=2 1184 B8R0.2 COC(=O)[C@@H](N)C(C)C Amb533666 [0,1,0,0,0,0|1,0,0]=2 1185 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O Amb10844890 [0,1,0,0,0,0|0,0,0]=1 1186 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O Amb6296132 [0,1,0,0,0,0|0,0,0]=1 1187 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O Amb27636193 [0,1,0,0,0,0|0,0,0]=1 1188 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O Amb33483414 [0,1,0,0,0,0|0,0,0]=1 1189 B8R0.2 COC(=O)[C@@H](O)C(C)C Amb22228179 [0,1,0,0,0,0|2,0,0]=3 1190 B8R0.2 COC(=O)[C@@H](O)[C@@H](C)N Amb28075209 [0,1,0,0,0,0|2,0,0]=3 1191 B8R0.2 COC(=O)[C@H](Br)C(C)C Amb27244045 [0,1,0,0,0,0|2,0,0]=3 1192 B8R0.2 COC(=O)[C@H](Br)[C@@H](C)O Amb28121043 [0,1,0,0,0,0|1,0,0]=2 1193 B8R0.2 COC(=O)[C@H](Br)[C@H](C)O Amb27974271 [0,1,0,0,0,0|1,0,0]=2 1194 B8R0.2 COC(=O)[C@H](C)C(C)C Amb27226106 [0,1,0,0,0,0|2,0,0]=3 1195 B8R0.2 COC(=O)[C@H](C)[C@@H](C)Br Amb27607692 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N Amb28124532 [0,1,0,0,0,0|2,0,0]=3 1197 B8R0.2 COC(=O)[C@H](C)[C@@H](C)O Amb27783741 [0,1,0,0,0,0|1,0,0]=2 1198 B8R0.2 COC(=O)[C@H](C)[C@H](C)N Amb27969940 [0,1,0,0,0,0|2,0,0]=3 1199 B8R0.2 COC(=O)[C@H](Cl)[C@@H](C)Cl Amb28366837 [0,1,0,0,0,0|2,0,0]=3 1200 B8R0.2 COC(=O)[C@H](Cl)[C@@H](C)F Amb27401974 [0,1,0,0,0,0|2,0,0]=3 1201 B8R0.2 COC(=O)[C@H](Cl)[C@H](C)F Amb27607693 [0,1,0,0,0,0|2,0,0]=3 1202 B8R0.2 COC(=O)[C@H](N)C(C)C Amb10604149 [0,1,0,0,0,0|1,0,0]=2 1203 B8R0.2 COC(=O)[C@H](N)C(C)C Amb16183873 [0,1,0,0,0,0|1,0,0]=2 1204 B8R0.2 COC(=O)[C@H](N)[C@@H](C)F Amb26452555 [0,1,0,0,0,0|1,0,0]=2 1205 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O Amb22744992 [0,1,0,0,0,0|0,0,0]=1 1206 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O Amb25955119 [0,1,0,0,0,0|0,0,0]=1 1207 B8R0.2 COC(=O)[C@H](N)[C@H](C)F Amb27429857 [0,1,0,0,0,0|1,0,0]=2 1208 B8R0.2 COC(=O)[C@H](N)[C@H](C)O Amb27800278 [0,1,0,0,0,0|0,0,0]=1 1209 B8R0.2 COC(=O)[C@H](N)[C@H](C)O Amb8390421 [0,1,0,0,0,0|0,0,0]=1 1210 B8R0.2 COC(=O)[C@H](O)C(C)C Amb22388621 [0,1,0,0,0,0|2,0,0]=3 1211 B8R0.2 COC(=O)[C@H](O)[C@@H](C)Cl Amb27233486 [0,1,0,0,0,0|2,0,0]=3 1212 B8R0.2 COC(=O)[C@H](O)[C@@H](C)F Amb27210162 [0,1,0,0,0,0|2,0,0]=3 1213 B8R0.2 COC(=O)[C@H](O)[C@H](C)Cl Amb28325667 [0,1,0,0,0,0|2,0,0]=3 1214 B8R0.2 COC(C)C(Br)C(=O)Cl Amb27215381 [0,1,0,0,0,0|2,0,0]=3 1215 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [0,1,0,0,0,0|1,0,0]=2 1216 B8R0.2 COC(C)C(Br)C(C)=O Amb27477738 [0,1,0,0,0,0|2,0,0]=3 1217 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [0,1,0,0,0,0|1,0,0]=2 1218 B8R0.2 COC(C)C(Cl)C(N)=O Amb27614474 [0,1,0,0,0,0|2,0,0]=3 1219 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [0,1,0,0,0,0|0,0,0]=1 1220 B8R0.2 COC(C)C(N)C(N)=O Amb27195568 [0,1,0,0,0,0|1,0,0]=2 1221 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [0,1,0,0,0,0|1,0,0]=2 1222 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [0,1,0,0,0,0|1,0,0]=2 1223 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [0,1,0,0,0,0|0,0,0]=1 1224 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [0,1,0,0,0,0|1,0,0]=2 1225 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [0,1,0,0,0,0|0,0,0]=1 1226 B8R0.2 COC(Cl)C(Cl)C(C)=O Amb27231978 [0,1,0,0,0,0|3,0,0]=4 1227 B8R0.2 CON(C)C(=O)C(=O)O Amb28200907 [0,1,0,0,0,0|2,0,1]=4 1228 B8R0.2 CON(C)C(C)C(=O)O Amb27665034 [0,1,0,0,0,0|2,0,0]=3 1229 B8R0.2 CON(C)C(C)C(N)=O Amb27837566 [0,1,0,0,0,0|3,0,0]=4 1230 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [0,1,0,0,0,0|0,0,0]=1 1231 B8R0.2 CO[C@@H](C)[C@H](Br)C(N)=O Amb27863450 [0,1,0,0,0,0|2,0,0]=3 1232 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [0,1,0,0,0,0|0,0,0]=1 1233 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [0,1,0,0,0,0|1,0,0]=2 1234 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [0,1,0,0,0,0|1,0,0]=2 1235 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [0,1,0,0,0,0|0,0,0]=1 1236 B8R0.2 CO[C@H](C)[C@H](N)C(N)=O Amb32723110 [0,1,0,0,0,0|1,0,0]=2 1237 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [0,1,0,0,0,0|1,0,0]=2 1238 B8R0.2 CO[C@H](Cl)[C@H](Cl)C(C)=O Amb27407718 [0,1,0,0,0,0|3,0,0]=4 1239 B8R0.2 CSC(=O)C(Br)C(C)C Amb27614276 [0,1,0,0,0,0|2,1,0]=4 1240 B8R0.2 CSC(=S)C(C)C(C)O Amb27418412 [0,1,0,0,0,0|1,2,0]=4 1241 B8R0.2 CSC(C)C(Cl)C(=O)Cl Amb28352236 [0,1,0,0,0,0|2,1,0]=4 1242 B8R0.2 CSC(C)C(N)C(N)=O Amb30035540 [0,1,0,0,0,0|1,1,0]=3 1243 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [0,1,0,0,0,0|0,1,0]=2 1244 B8R0.2 C[C@@H](C(=O)O)N(C)C#N Amb35634499 [0,1,0,0,0,0|3,0,0]=4 1245 B8R0.2 C[C@@H](C(=O)O)N(C)N=O Amb27642233 [0,1,0,0,0,0|2,0,1]=4 1246 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [0,1,0,0,0,0|0,0,0]=1 1247 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [0,1,0,0,0,0|0,0,0]=1 1248 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [0,1,0,0,0,0|0,0,0]=1 1249 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)NO Amb28049201 [0,1,0,0,0,0|0,0,0]=1 1250 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)C=O Amb22229972 [0,1,0,0,0,0|1,0,1]=3 1251 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NN Amb27169503 [0,1,0,0,0,0|1,0,0]=2 1252 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,1,0,0,0,0|0,0,0]=1 1253 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,1,0,0,0,0|1,0,0]=2 1254 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,1,0,0,0,0|2,0,0]=3 1255 B8R0.2 C[C@H](Cl)[C@@H](N)C(=O)NO Amb27657831 [0,1,0,0,0,0|1,0,0]=2 1256 B8R0.2 C[C@H](O)[C@@H](C)C(=O)CO Amb28346866 [0,1,0,0,0,0|1,0,0]=2 1257 B8R0.2 C[C@H](O)[C@@H](O)[C@H](O)C=O Amb28285149 [0,1,0,0,0,0|1,0,1]=3 1258 B8R0.2 C[C@H](O)[C@@H](O)[C@H](O)CO Amb27946934 [0,1,0,0,0,0|1,0,2]=4 1259 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)C=O Amb22229973 [0,1,0,0,0,0|1,0,1]=3 1260 B8R0.2 C[C@H](O)[C@H](O)[C@H](O)C=O Amb26490972 [0,1,0,0,0,0|1,0,1]=3 1261 B8R0.2 C[C@H](O)[C@H](O)[C@H](O)CO Amb28207141 [0,1,0,0,0,0|1,0,2]=4 1262 B8R0.2 C\C(=N/O)C(O)C(C)C Amb27763029 [0,1,0,0,0,0|3,0,0]=4 1263 B8R0.2 C\C=C(/C)C(C)C(=O)O Amb27810548 [0,1,0,0,0,0|2,0,1]=4 1264 B8R0.2 C\C=C(/C)C(N)C(=O)O Amb18642706 [0,1,0,0,0,0|1,0,1]=3 1265 B8R0.2 C\C=C(\Br)C(O)C(=O)O Amb27657537 [0,1,0,0,0,0|2,0,1]=4 1266 B8R0.2 C\C=C(\C)C(C)C(=O)O Amb27626047 [0,1,0,0,0,0|2,0,1]=4 1267 B8R0.2 C\C=C(\C)C(N)C(=O)O Amb27634383 [0,1,0,0,0,0|1,0,1]=3 1268 B8R0.2 C\C=C(\C)[C@H](N)C(=O)O Amb28424373 [0,1,0,0,0,0|1,0,1]=3 1269 B8R0.2 NC(=O)[C@@H](F)[C@@H](O)CO Amb27668286 [0,1,0,0,0,0|2,0,0]=3 1270 B8R0.2 NC(=O)[C@H](O)[C@@H](O)CO Amb27814631 [0,1,0,0,0,0|2,0,0]=3 1271 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [0,1,0,0,0,0|1,0,0]=2 1272 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [0,1,0,0,0,0|0,0,0]=1 1273 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [0,1,0,0,0,0|0,0,0]=1 1274 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [0,1,0,0,0,0|0,1,0]=2 1275 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [0,1,0,0,0,0|1,0,0]=2 1276 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,1,0,0,0,0|0,0,0]=1 1277 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,1,0,0,0,0|1,0,0]=2 1278 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,1,0,0,0,0|1,0,0]=2 1279 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,1,0,0,0,0|1,0,0]=2 1280 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,1,0,0,0,0|0,0,0]=1 1281 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,1,0,0,0,0|2,0,0]=3 1282 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [0,1,0,0,0,0|0,0,0]=1 1283 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [0,1,0,0,0,0|0,1,0]=2 1284 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [0,1,0,0,0,0|0,0,0]=1 1285 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [0,1,0,0,0,0|0,0,0]=1 1286 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [0,1,0,0,0,0|0,0,0]=1 1287 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [0,1,0,0,0,0|0,0,0]=1 1288 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [0,1,0,0,0,0|1,0,1]=3 1289 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,0|2,0,0]=3 1290 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [0,1,0,0,0,0|1,0,0]=2 1291 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [0,1,0,0,0,0|1,0,0]=2 1292 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [0,1,0,0,0,0|1,0,0]=2 1293 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [0,1,0,0,0,0|1,0,0]=2 1294 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [0,1,0,0,0,0|1,0,0]=2 1295 B8R0.2 O=C([O-])C(O)C(O)CO Amb22733096 [0,1,0,0,0,0|1,0,1]=3 1296 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb22744783 [0,1,0,0,0,0|1,0,1]=3 1297 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb32414707 [0,1,0,0,0,0|1,0,1]=3 1298 B8R0.2 O=CC(O)C(O)C(=O)O Amb18124399 [0,1,0,0,0,0|1,0,1]=3 1299 B8R0.2 O=C[C@H](O)[C@H](O)C(=O)O Amb27266059 [0,1,0,0,0,0|1,0,1]=3 1300 B8R0.2 OC(O)C(Cl)C(O)CCl Amb28071055 [0,1,0,0,0,0|1,0,2]=4 1301 B8R0.18 C#CC(C(=O)O)C(=O)O Amb27493331 [0,1,0,0,0,0|2,0,1]=4 1302 B8R0.18 C=C(C)C(CC)C(=O)O Amb18642606 [0,1,0,0,0,0|2,0,1]=4 1303 B8R0.18 C=C(C)C(CN)C(=O)O Amb33199955 [0,1,0,0,0,0|1,0,1]=3 1304 B8R0.18 C=C(C)C(NC)C(C)O Amb27482851 [0,1,0,0,0,0|2,0,0]=3 1305 B8R0.18 C=C(C)C(OC)C(=O)O Amb27219440 [0,1,0,0,0,0|2,0,1]=4 1306 B8R0.18 C=C(C)[C@@H](NC)[C@@H](C)O Amb27216072 [0,1,0,0,0,0|2,0,0]=3 1307 B8R0.18 C=CC(C(=O)O)C(=O)O Amb27655691 [0,1,0,0,0,0|2,0,1]=4 1308 B8R0.18 C=CC(C(=O)O)N(C)C Amb27757609 [0,1,0,0,0,0|3,0,0]=4 1309 B8R0.18 C=NC(C(=O)O)C(C)C Amb27409212 [0,1,0,0,0,0|1,0,1]=3 1310 B8R0.18 CC(=O)C(C#N)C(C)C Amb25810486 [0,1,0,0,0,0|2,0,1]=4 1311 B8R0.18 CC(=O)C(CN)C(C)=O Amb28411438 [0,1,0,0,0,0|1,0,2]=4 1312 B8R0.18 CC(C)=C(CN)C(=O)O Amb28368080 [0,1,0,0,0,0|1,0,2]=4 1313 B8R0.18 CC(C)C(C#N)C(=O)Cl Amb27466440 [0,1,0,0,0,0|2,0,1]=4 1314 B8R0.18 CC(C)C(C#N)C(=O)O Amb10066977 [0,1,0,0,0,0|1,0,1]=3 1315 B8R0.18 CC(C)C(CF)C(=O)O Amb26965957 [0,1,0,0,0,0|2,0,0]=3 1316 B8R0.18 CC(C)C(CN)C(=O)O Amb18987935 [0,1,0,0,0,0|1,0,0]=2 1317 B8R0.18 CC(C)C(CN)C(=O)O Amb19375052 [0,1,0,0,0,0|1,0,0]=2 1318 B8R0.18 CC(C)C(CN)C(C)O Amb27475944 [0,1,0,0,0,0|2,0,1]=4 1319 B8R0.18 CC(C)C(CO)C(=O)O Amb24116921 [0,1,0,0,0,0|2,0,0]=3 1320 B8R0.18 CC(C)C(CO)C(=O)[O-] Amb32655908 [0,1,0,0,0,0|2,0,1]=4 1321 B8R0.18 CC(C)C(CS)C(=O)O Amb17593703 [0,1,0,0,0,0|2,0,0]=3 1322 B8R0.18 CC(C)C(NN)C(=O)O Amb18642886 [0,1,0,0,0,0|1,0,0]=2 1323 B8R0.18 CC(C)C(NO)C(=O)O Amb28429830 [0,1,0,0,0,0|1,0,0]=2 1324 B8R0.18 CC(C)C(ON)C(=O)O Amb24477865 [0,1,0,0,0,0|1,0,0]=2 1325 B8R0.18 CC(C)C(ON)C(=O)O Amb32652494 [0,1,0,0,0,0|1,0,0]=2 1326 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756745 [0,1,0,0,0,0|1,0,0]=2 1327 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756747 [0,1,0,0,0,0|1,0,0]=2 1328 B8R0.18 CC(C)[C@@H](NN)C(=O)O Amb27468667 [0,1,0,0,0,0|1,0,0]=2 1329 B8R0.18 CC(C)[C@@H](NO)C(N)=O Amb27469128 [0,1,0,0,0,0|2,0,0]=3 1330 B8R0.18 CC(C)[C@@H](ON)C(=O)O Amb24117143 [0,1,0,0,0,0|1,0,0]=2 1331 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb25283442 [0,1,0,0,0,0|1,0,0]=2 1332 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb32620230 [0,1,0,0,0,0|1,0,0]=2 1333 B8R0.18 CC(C)[C@H](CO)C(=O)O Amb27249807 [0,1,0,0,0,0|2,0,0]=3 1334 B8R0.18 CC(C)[C@H](NN)C(=O)O Amb27946435 [0,1,0,0,0,0|1,0,0]=2 1335 B8R0.18 CC(C)[C@H](NO)C(=O)O Amb27859675 [0,1,0,0,0,0|1,0,0]=2 1336 B8R0.18 CC(O)C(CO)C(C)O Amb4020650 [0,1,0,0,0,0|2,0,1]=4 1337 B8R0.18 CC(O)C(NN)C(=O)O Amb18642940 [0,1,0,0,0,0|0,0,0]=1 1338 B8R0.18 CCC(C(=O)O)C(=O)O Amb6297197 [0,1,0,0,0,0|2,0,1]=4 1339 B8R0.18 CCC(C(=O)O)C(C)C Amb18972345 [0,1,0,0,0,0|2,0,0]=3 1340 B8R0.18 CCC(C(=O)O)C(C)O Amb18990651 [0,1,0,0,0,0|1,0,0]=2 1341 B8R0.18 CCC(C(=O)O)C(F)F Amb33337288 [0,1,0,0,0,0|3,0,0]=4 1342 B8R0.18 CCC(C(=O)O)N(C)C Amb33551144 [0,1,0,0,0,0|3,0,0]=4 1343 B8R0.18 CCC(C(=O)O)N(C)C Amb8455277 [0,1,0,0,0,0|3,0,0]=4 1344 B8R0.18 CCC(C(=O)O)N(C)N Amb25145584 [0,1,0,0,0,0|3,0,0]=4 1345 B8R0.18 CCC(C(=O)O)S(C)=O Amb18290930 [0,1,0,0,0,0|2,0,1]=4 1346 B8R0.18 CCC(C(C)=O)C(C)C Amb3940735 [0,1,0,0,0,0|3,0,0]=4 1347 B8R0.18 CCC(C(C)O)[N+](=O)[O-] Amb8513687 [0,1,0,0,0,0|2,0,1]=4 1348 B8R0.18 CCC([C@@H](C)O)[C@@H](C)O Amb28049193 [0,1,0,0,0,0|2,0,1]=4 1349 B8R0.18 CC[C@@H](C(=O)O)N(C)C Amb25823446 [0,1,0,0,0,0|3,0,0]=4 1350 B8R0.18 CC[C@@H](C(=O)O)N(O)O Amb16233002 [0,1,0,0,0,0|3,0,0]=4 1351 B8R0.18 CC[C@@H](C(=O)O)[C@@H](C)O Amb28410568 [0,1,0,0,0,0|1,0,0]=2 1352 B8R0.18 CC[C@@H](C(C)=O)C(C)C Amb28195024 [0,1,0,0,0,0|3,0,0]=4 1353 B8R0.18 CC[C@@H](C(C)=O)[C@H](C)O Amb27164629 [0,1,0,0,0,0|2,0,0]=3 1354 B8R0.18 CC[C@H](C(=O)O)N(C)C Amb32668789 [0,1,0,0,0,0|3,0,0]=4 1355 B8R0.18 CC[C@H](C(=O)O)[C@H](C)O Amb27655638 [0,1,0,0,0,0|1,0,0]=2 1356 B8R0.18 CC[C@H]([C@H](C)O)[C@@H](C)O Amb27406073 [0,1,0,0,0,0|2,0,1]=4 1357 B8R0.18 CN(C)C(CN)C(=O)O Amb26350112 [0,1,0,0,0,0|2,0,0]=3 1358 B8R0.18 CN(C)C(CO)C(=O)O Amb24407402 [0,1,0,0,0,0|3,0,0]=4 1359 B8R0.18 CN(C)[C@@H](CO)C(=O)O Amb27397686 [0,1,0,0,0,0|3,0,0]=4 1360 B8R0.18 CNC(C(=O)O)C(C)C Amb21961623 [0,1,0,0,0,0|1,0,0]=2 1361 B8R0.18 CNC(C(=O)O)C(C)C Amb4035989 [0,1,0,0,0,0|1,0,0]=2 1362 B8R0.18 CNC(C(=O)O)C(C)F Amb27596009 [0,1,0,0,0,0|1,0,0]=2 1363 B8R0.18 CNC(C(C)=O)C(C)C Amb2369975 [0,1,0,0,0,0|2,0,0]=3 1364 B8R0.18 CNC(C(N)=O)C(C)O Amb30037144 [0,1,0,0,0,0|1,0,0]=2 1365 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22231334 [0,1,0,0,0,0|1,0,0]=2 1366 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22749002 [0,1,0,0,0,0|1,0,0]=2 1367 B8R0.18 CN[C@@H](C(=O)O)C(C)O Amb22800385 [0,1,0,0,0,0|0,0,0]=1 1368 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,1,0,0,0,0|1,0,0]=2 1369 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb33812559 [0,1,0,0,0,0|1,0,0]=2 1370 B8R0.18 CN[C@H](C(=O)O)C(C)O Amb27446656 [0,1,0,0,0,0|0,0,0]=1 1371 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O Amb25887203 [0,1,0,0,0,0|0,0,0]=1 1372 B8R0.18 COC(C(=O)O)C(=O)O Amb27396318 [0,1,0,0,0,0|2,0,1]=4 1373 B8R0.18 COC(C(=O)O)C(C)C Amb33532796 [0,1,0,0,0,0|2,0,0]=3 1374 B8R0.18 COC(C(=O)O)C(C)O Amb26003623 [0,1,0,0,0,0|1,0,0]=2 1375 B8R0.18 CO[C@H](C(=O)O)C(C)C Amb27966715 [0,1,0,0,0,0|2,0,0]=3 1376 B8R0.18 CO[C@H](C(C)=O)C(C)C Amb27453538 [0,1,0,0,0,0|3,0,0]=4 1377 B8R0.18 CSC(C(=O)O)C(=O)O Amb27407760 [0,1,0,0,0,0|2,0,1]=4 1378 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,1,0,0,0,0|2,0,0]=3 1379 B8R0.18 C\C(O)=C(\C#N)C(=O)O Amb27444896 [0,1,0,0,0,0|0,0,3]=4 1380 B8R0.18 NC=C(C(=O)O)C(=O)O Amb27236633 [0,1,0,0,0,0|1,0,2]=4 1381 B8R0.18 NCC(C(=O)O)C(=O)O Amb27408219 [0,1,0,0,0,0|1,0,1]=3 1382 B8R0.18 NCC(C(=O)O)C(F)F Amb27438118 [0,1,0,0,0,0|2,0,0]=3 1383 B8R0.18 O=C(O)C(CO)C(=O)O Amb27849072 [0,1,0,0,0,0|2,0,1]=4 1384 B8R0.18 [C-]#[N+]C(C(=O)O)C(C)C Amb27945578 [0,1,0,0,0,0|1,0,1]=3 1385 B8R0.18 [C-]#[N+]C(C(N)=O)C(C)C Amb27866988 [0,1,0,0,0,0|2,0,1]=4 1386 B8R0.27 C=C(C(=O)O)C(C)(C)C Amb18642653 [0,1,0,0,0,0|2,0,1]=4 1387 B8R0.27 C=C(C(=O)O)C(C)(C)F Amb33271858 [0,1,0,0,0,0|2,0,1]=4 1388 B8R0.27 C=C(C(=O)O)C(C)(F)F Amb32810180 [0,1,0,0,0,0|2,0,1]=4 1389 B8R0.27 CC(=O)C(Br)C(C)(C)C Amb25761464 [0,1,0,0,0,0|3,0,0]=4 1390 B8R0.27 CC(=O)C(Br)C(C)(C)Cl Amb27390172 [0,1,0,0,0,0|3,0,0]=4 1391 B8R0.27 CC(=O)C(C)C(C)(C)N Amb27256781 [0,1,0,0,0,0|3,0,0]=4 1392 B8R0.27 CC(=O)C(C)C(C)(F)F Amb27424690 [0,1,0,0,0,0|3,0,0]=4 1393 B8R0.27 CC(=O)C(Cl)C(C)(C)Cl Amb28137878 [0,1,0,0,0,0|3,0,0]=4 1394 B8R0.27 CC(=O)C(Cl)C(C)(C)F Amb27482514 [0,1,0,0,0,0|3,0,0]=4 1395 B8R0.27 CC(=O)C(Cl)C(C)(C)O Amb25933618 [0,1,0,0,0,0|2,0,0]=3 1396 B8R0.27 CC(=O)C(N)P(=O)(O)O Amb27835752 [0,1,0,0,0,0|1,0,2]=4 1397 B8R0.27 CC(=O)C(O)C(C)(C)C Amb27805300 [0,1,0,0,0,0|3,0,0]=4 1398 B8R0.27 CC(=O)C(O)C(C)(C)N Amb28144996 [0,1,0,0,0,0|3,0,0]=4 1399 B8R0.27 CC(=O)C(O)C(C)(C)O Amb17593385 [0,1,0,0,0,0|2,0,0]=3 1400 B8R0.27 CC(=O)N(N)C(C)(C)C Amb33191324 [0,1,0,0,0,0|3,0,0]=4 1401 B8R0.27 CC(=O)[C@@H](C)C(C)(C)C Amb25060195 [0,1,0,0,0,0|3,0,0]=4 1402 B8R0.27 CC(=O)[C@@H](O)C(C)(C)C Amb27256659 [0,1,0,0,0,0|3,0,0]=4 1403 B8R0.27 CC(C(=O)Cl)C(C)(C)C Amb27450126 [0,1,0,0,0,0|3,0,0]=4 1404 B8R0.27 CC(C(=O)Cl)C(C)(F)F Amb27804031 [0,1,0,0,0,0|3,0,0]=4 1405 B8R0.27 CC(C(=O)O)C(C)(C)C Amb4477144 [0,1,0,0,0,0|2,0,0]=3 1406 B8R0.27 CC(C(=O)O)C(C)(C)F Amb10843986 [0,1,0,0,0,0|2,0,0]=3 1407 B8R0.27 CC(C(=O)O)C(C)(C)N Amb24459511 [0,1,0,0,0,0|2,0,0]=3 1408 B8R0.27 CC(C(=O)O)C(C)(C)O Amb10844263 [0,1,0,0,0,0|1,0,0]=2 1409 B8R0.27 CC(C(=O)O)C(C)(F)F Amb27626900 [0,1,0,0,0,0|2,0,0]=3 1410 B8R0.27 CC(C(=O)O)C(F)(F)F Amb19148979 [0,1,0,0,0,0|3,0,0]=4 1411 B8R0.27 CC(C(=O)O)P(=O)(O)O Amb9814224 [0,1,0,0,0,0|3,0,0]=4 1412 B8R0.27 CC(C(=O)O)S(=O)(=O)O Amb25765487 [0,1,0,0,0,0|3,0,0]=4 1413 B8R0.27 CC(C(=O)O)S(C)(=O)=O Amb6260939 [0,1,0,0,0,0|2,0,1]=4 1414 B8R0.27 CC(C(=O)O)[Si](C)(C)C Amb27945584 [0,1,0,0,0,0|2,1,0]=4 1415 B8R0.27 CC(C)(Br)C(Br)C(=O)O Amb16192461 [0,1,0,0,0,0|2,0,0]=3 1416 B8R0.27 CC(C)(C)C(=O)C(=O)O Amb8384135 [0,1,0,0,0,0|2,0,1]=4 1417 B8R0.27 CC(C)(C)C(Br)C(=O)Cl Amb27222881 [0,1,0,0,0,0|3,0,0]=4 1418 B8R0.27 CC(C)(C)C(Br)C(=O)O Amb18127181 [0,1,0,0,0,0|2,0,0]=3 1419 B8R0.27 CC(C)(C)C(Br)C(N)=O Amb27857005 [0,1,0,0,0,0|3,0,0]=4 1420 B8R0.27 CC(C)(C)C(F)C(=O)O Amb28285305 [0,1,0,0,0,0|2,0,0]=3 1421 B8R0.27 CC(C)(C)C(N)C(=O)O Amb493874 [0,1,0,0,0,0|1,0,0]=2 1422 B8R0.27 CC(C)(C)C(N)C(=O)O Amb9747344 [0,1,0,0,0,0|1,0,0]=2 1423 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,1,0,0,0,0|2,0,0]=3 1424 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,1,0,0,0,0|2,0,0]=3 1425 B8R0.27 CC(C)(C)C(O)C(=O)O Amb19299856 [0,1,0,0,0,0|2,0,0]=3 1426 B8R0.27 CC(C)(C)C(O)C(N)=O Amb27963620 [0,1,0,0,0,0|3,0,0]=4 1427 B8R0.27 CC(C)(C)C(S)C(=O)O Amb27880919 [0,1,0,0,0,0|2,0,0]=3 1428 B8R0.27 CC(C)(C)[C@@H](Br)C(=O)O Amb22746895 [0,1,0,0,0,0|2,0,0]=3 1429 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb22744938 [0,1,0,0,0,0|1,0,0]=2 1430 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb8513330 [0,1,0,0,0,0|1,0,0]=2 1431 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,1,0,0,0,0|2,0,0]=3 1432 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,1,0,0,0,0|2,0,0]=3 1433 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O Amb22225174 [0,1,0,0,0,0|2,0,0]=3 1434 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O Amb22226488 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.27 CC(C)(C)[C@H](Cl)C(=O)O Amb3429554 [0,1,0,0,0,0|2,0,0]=3 1436 B8R0.27 CC(C)(C)[C@H](N)C(=O)O Amb2720519 [0,1,0,0,0,0|1,0,0]=2 1437 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,1,0,0,0,0|2,0,0]=3 1438 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,1,0,0,0,0|2,0,0]=3 1439 B8R0.27 CC(C)(C)[C@H](O)C(=O)O Amb10603129 [0,1,0,0,0,0|2,0,0]=3 1440 B8R0.27 CC(C)(Cl)C(Cl)C(=O)O Amb18126746 [0,1,0,0,0,0|2,0,0]=3 1441 B8R0.27 CC(C)(Cl)C(N)C(N)=O Amb28069484 [0,1,0,0,0,0|2,0,0]=3 1442 B8R0.27 CC(C)(Cl)C(O)C(=O)O Amb27232684 [0,1,0,0,0,0|2,0,0]=3 1443 B8R0.27 CC(C)(F)C(=O)C(=O)O Amb25079631 [0,1,0,0,0,0|2,0,1]=4 1444 B8R0.27 CC(C)(F)C(Br)C(=O)O Amb10605635 [0,1,0,0,0,0|2,0,0]=3 1445 B8R0.27 CC(C)(F)C(N)C(=O)O Amb2695553 [0,1,0,0,0,0|1,0,0]=2 1446 B8R0.27 CC(C)(F)C(O)C(=O)O Amb25868881 [0,1,0,0,0,0|2,0,0]=3 1447 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb27599060 [0,1,0,0,0,0|1,0,0]=2 1448 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb30666687 [0,1,0,0,0,0|1,0,0]=2 1449 B8R0.27 CC(C)(F)[C@@H](O)C(=O)O Amb27660747 [0,1,0,0,0,0|2,0,0]=3 1450 B8R0.27 CC(C)(F)[C@H](N)C(=O)O Amb24369670 [0,1,0,0,0,0|1,0,0]=2 1451 B8R0.27 CC(C)(N)C(F)C(=O)O Amb33036292 [0,1,0,0,0,0|2,0,0]=3 1452 B8R0.27 CC(C)(N)C(O)C(=O)O Amb25075483 [0,1,0,0,0,0|2,0,0]=3 1453 B8R0.27 CC(C)(O)C(Br)C(=O)O Amb17595209 [0,1,0,0,0,0|1,0,0]=2 1454 B8R0.27 CC(C)(O)C(F)C(=O)O Amb32664861 [0,1,0,0,0,0|1,0,0]=2 1455 B8R0.27 CC(C)(O)C(N)C(=O)O Amb18642914 [0,1,0,0,0,0|0,0,0]=1 1456 B8R0.27 CC(C)(O)C(O)C(=O)O Amb25118477 [0,1,0,0,0,0|1,0,0]=2 1457 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O Amb8389457 [0,1,0,0,0,0|0,0,0]=1 1458 B8R0.27 CC(C)(O)[C@@H](O)C(=O)O Amb27974877 [0,1,0,0,0,0|1,0,0]=2 1459 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb33872154 [0,1,0,0,0,0|0,0,0]=1 1460 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb8397144 [0,1,0,0,0,0|0,0,0]=1 1461 B8R0.27 CC(C)(O)[C@H](O)C(=O)O Amb27469612 [0,1,0,0,0,0|1,0,0]=2 1462 B8R0.27 CC(C)(S)C(N)C(=O)O Amb4006839 [0,1,0,0,0,0|0,1,0]=2 1463 B8R0.27 CC(C)(S)C(N)C(=O)O Amb9703216 [0,1,0,0,0,0|0,1,0]=2 1464 B8R0.27 CC(C)(S)C([NH3+])C(=O)[O-] Amb4260371 [0,1,0,0,0,0|0,1,2]=4 1465 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb28524814 [0,1,0,0,0,0|0,1,0]=2 1466 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb533607 [0,1,0,0,0,0|0,1,0]=2 1467 B8R0.27 CC(C)(S)[C@H](N)C(=O)O Amb2709386 [0,1,0,0,0,0|0,1,0]=2 1468 B8R0.27 CC(C)C(N)C(C)(C)O Amb18642849 [0,1,0,0,0,0|2,0,1]=4 1469 B8R0.27 CC(C)C(N)C(C)(C)O Amb32666101 [0,1,0,0,0,0|2,0,1]=4 1470 B8R0.27 CC(C)C(N)P(=O)(O)O Amb2719706 [0,1,0,0,0,0|2,0,0]=3 1471 B8R0.27 CC(C)C(N)S(=O)(=O)O Amb25918816 [0,1,0,0,0,0|2,0,0]=3 1472 B8R0.27 CC(C)C(O)P(=O)(O)O Amb26927015 [0,1,0,0,0,0|3,0,0]=4 1473 B8R0.27 CC(C)C(O)S(=O)(=O)O Amb35753169 [0,1,0,0,0,0|3,0,0]=4 1474 B8R0.27 CC(C)[C@@H](N)C(C)(C)O Amb24579778 [0,1,0,0,0,0|2,0,1]=4 1475 B8R0.27 CC(C)[C@@H](N)P(=O)(O)O Amb8517217 [0,1,0,0,0,0|2,0,0]=3 1476 B8R0.27 CC(C)[C@H](N)C(C)(C)O Amb27215718 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.27 CC(C)[C@H](N)C(C)(C)O Amb32729445 [0,1,0,0,0,0|2,0,1]=4 1478 B8R0.27 CC(C)[C@H](N)P(=O)(O)O Amb8517216 [0,1,0,0,0,0|2,0,0]=3 1479 B8R0.27 CC(F)(F)C(=O)C(=O)O Amb25997735 [0,1,0,0,0,0|2,0,1]=4 1480 B8R0.27 CC(F)(F)C(F)C(=O)O Amb32675224 [0,1,0,0,0,0|2,0,0]=3 1481 B8R0.27 CC(F)(F)C(N)C(=O)O Amb26413853 [0,1,0,0,0,0|1,0,0]=2 1482 B8R0.27 CC(F)(F)C(O)C(=O)O Amb32809793 [0,1,0,0,0,0|2,0,0]=3 1483 B8R0.27 CC(N)C(C)P(=O)(O)O Amb27423372 [0,1,0,0,0,0|3,0,0]=4 1484 B8R0.27 CC(N)C(N)S(=O)(=O)O Amb27202229 [0,1,0,0,0,0|2,0,0]=3 1485 B8R0.27 CC(N)C(O)S(=O)(=O)O Amb24717762 [0,1,0,0,0,0|3,0,0]=4 1486 B8R0.27 CC(O)C(Br)S(C)(=O)=O Amb23510578 [0,1,0,0,0,0|2,0,1]=4 1487 B8R0.27 CC(O)C(C)S(C)(=O)=O Amb18180150 [0,1,0,0,0,0|2,0,1]=4 1488 B8R0.27 CC(O)C(C)S(N)(=O)=O Amb28063889 [0,1,0,0,0,0|2,0,1]=4 1489 B8R0.27 CC(O)C(Cl)S(C)(=O)=O Amb23510536 [0,1,0,0,0,0|2,0,1]=4 1490 B8R0.27 CC(O)C(N)C(F)(F)F Amb24410176 [0,1,0,0,0,0|2,0,1]=4 1491 B8R0.27 CC(O)C(O)P(=O)(O)O Amb25235589 [0,1,0,0,0,0|2,0,0]=3 1492 B8R0.27 CC(O)[C@@H](N)C(F)(F)F Amb27838656 [0,1,0,0,0,0|2,0,1]=4 1493 B8R0.27 CC(O)[C@@H](O)S(C)(=O)=O Amb27945205 [0,1,0,0,0,0|2,0,1]=4 1494 B8R0.27 CP(C)(=O)C(O)C(=O)O Amb22231894 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.27 C[C@@H](C(=O)O)C(C)(C)C Amb10844023 [0,1,0,0,0,0|2,0,0]=3 1496 B8R0.27 C[C@@H](C(=O)O)C(C)(C)Cl Amb28399702 [0,1,0,0,0,0|2,0,0]=3 1497 B8R0.27 C[C@@H](C(=O)O)C(C)(C)O Amb10844262 [0,1,0,0,0,0|1,0,0]=2 1498 B8R0.27 C[C@@H](C(=O)O)C(C)(F)F Amb33728209 [0,1,0,0,0,0|2,0,0]=3 1499 B8R0.27 C[C@@H](C(=O)O)C(F)(F)F Amb24120617 [0,1,0,0,0,0|3,0,0]=4 1500 B8R0.27 C[C@@H](C(=O)O)S(C)(=O)=O Amb27776748 [0,1,0,0,0,0|2,0,1]=4 1501 B8R0.27 C[C@@H](N)[C@@H](O)P(=O)(O)O Amb27813334 [0,1,0,0,0,0|3,0,0]=4 1502 B8R0.27 C[C@@H](O)[C@@H](C)C(C)(C)O Amb28315441 [0,1,0,0,0,0|2,0,1]=4 1503 B8R0.27 C[C@@H](O)[C@@H](C)S(N)(=O)=O Amb28064147 [0,1,0,0,0,0|2,0,1]=4 1504 B8R0.27 C[C@@H](O)[C@@H](N)C(F)(F)F Amb27480982 [0,1,0,0,0,0|2,0,1]=4 1505 B8R0.27 C[C@@H](O)[C@@H](N)P(=O)(O)O Amb28254589 [0,1,0,0,0,0|1,0,0]=2 1506 B8R0.27 C[C@@H](O)[C@H](N)C(C)(C)C Amb27838631 [0,1,0,0,0,0|2,0,1]=4 1507 B8R0.27 C[C@H](C(=O)O)C(C)(C)C Amb10844034 [0,1,0,0,0,0|2,0,0]=3 1508 B8R0.27 C[C@H](C(=O)O)C(C)(F)F Amb33749542 [0,1,0,0,0,0|2,0,0]=3 1509 B8R0.27 C[C@H](C(=O)O)C(F)(F)F Amb26536055 [0,1,0,0,0,0|3,0,0]=4 1510 B8R0.27 C[C@H](C(=O)O)S(=O)(=O)O Amb28385771 [0,1,0,0,0,0|3,0,0]=4 1511 B8R0.27 C[C@H](N)[C@H](O)P(=O)(O)O Amb27244964 [0,1,0,0,0,0|3,0,0]=4 1512 B8R0.27 C[C@H](O)[C@H](N)C(C)(C)O Amb28388930 [0,1,0,0,0,0|1,0,1]=3 1513 B8R0.27 C[C@H](O)[C@H](N)P(=O)(O)O Amb28366442 [0,1,0,0,0,0|1,0,0]=2 1514 B8R0.27 NC(=O)C(N)C(F)(F)F Amb26624320 [0,1,0,0,0,0|3,0,0]=4 1515 B8R0.27 NC(=O)C(N)C(F)(F)F Amb27955525 [0,1,0,0,0,0|3,0,0]=4 1516 B8R0.27 NC(C(=O)O)C(Cl)(Cl)Cl Amb24480186 [0,1,0,0,0,0|2,0,0]=3 1517 B8R0.27 NC(C(=O)O)C(F)(F)F Amb10607071 [0,1,0,0,0,0|2,0,0]=3 1518 B8R0.27 NC(C(=O)O)C(F)(F)F Amb2690712 [0,1,0,0,0,0|2,0,0]=3 1519 B8R0.27 N[C@@H](C(=O)O)C(F)(F)F Amb25378031 [0,1,0,0,0,0|2,0,0]=3 1520 B8R0.27 N[C@H](C(=O)O)C(F)(F)F Amb24650499 [0,1,0,0,0,0|2,0,0]=3 1521 B8R0.27 O=C(O)C(Br)C(F)(F)F Amb22274799 [0,1,0,0,0,0|3,0,0]=4 1522 B8R0.27 O=C(O)C(F)C(F)(F)F Amb2690534 [0,1,0,0,0,0|3,0,0]=4 1523 B8R0.27 O=C(O)C(F)C(F)(F)F Amb32882484 [0,1,0,0,0,0|3,0,0]=4 1524 B8R0.27 O=C(O)C(O)C(Cl)(Cl)Cl Amb24467776 [0,1,0,0,0,0|3,0,0]=4 1525 B8R0.27 O=C(O)C(O)C(F)(F)Br Amb27481079 [0,1,0,0,0,0|3,0,0]=4 1526 B8R0.27 O=C(O)C(O)C(F)(F)F Amb4084805 [0,1,0,0,0,0|3,0,0]=4 1527 B8R0.27 O=C(O)C(O)P(=O)(O)O Amb24117287 [0,1,0,0,0,0|3,0,0]=4 1528 B8R0.27 O=C(O)C(S)C(F)(F)F Amb27409127 [0,1,0,0,0,0|3,0,0]=4 1529 B8R0.37 C=C(C)C(C)(C)C(=O)O Amb15701602 [0,1,0,0,0,0|2,0,1]=4 1530 B8R0.37 C=C(C)[C@@](C)(O)[C@H](C)O Amb27447692 [0,1,0,0,0,0|3,0,0]=4 1531 B8R0.37 CC(=O)C(C)(C)C(=O)O Amb18642784 [0,1,0,0,0,0|1,0,2]=4 1532 B8R0.37 CC(=O)C(C)(C)C(C)C Amb17593353 [0,1,0,0,0,0|3,0,0]=4 1533 B8R0.37 CC(=O)C(C)(Cl)C(C)C Amb27260456 [0,1,0,0,0,0|3,0,0]=4 1534 B8R0.37 CC(=O)C(C)(Cl)C(C)Cl Amb27432792 [0,1,0,0,0,0|3,0,0]=4 1535 B8R0.37 CC(=O)C(C)(O)C(=O)O Amb18642870 [0,1,0,0,0,0|1,0,2]=4 1536 B8R0.37 CC(=O)C(C)(O)C(C)O Amb28246397 [0,1,0,0,0,0|2,0,0]=3 1537 B8R0.37 CC(=O)C(F)(Cl)C(C)C Amb27478248 [0,1,0,0,0,0|3,0,0]=4 1538 B8R0.37 CC(=O)[C@@](C)(O)[C@H](C)O Amb28321993 [0,1,0,0,0,0|2,0,0]=3 1539 B8R0.37 CC(Br)C(C)(Br)C(=O)O Amb2612513 [0,1,0,0,0,0|2,0,0]=3 1540 B8R0.37 CC(C)(C(=O)O)C(=O)O Amb2613653 [0,1,0,0,0,0|2,0,1]=4 1541 B8R0.37 CC(C)(C(=O)O)C(Cl)Cl Amb27461230 [0,1,0,0,0,0|3,0,0]=4 1542 B8R0.37 CC(C)(C(=O)O)C(F)F Amb28935029 [0,1,0,0,0,0|3,0,0]=4 1543 B8R0.37 CC(C)C(C)(C)C(=O)Cl Amb27174630 [0,1,0,0,0,0|3,0,0]=4 1544 B8R0.37 CC(C)C(C)(C)C(=O)O Amb17593377 [0,1,0,0,0,0|2,0,0]=3 1545 B8R0.37 CC(C)C(C)(N)C(=O)O Amb4134845 [0,1,0,0,0,0|1,0,0]=2 1546 B8R0.37 CC(C)C(C)(N)C(N)=O Amb8384332 [0,1,0,0,0,0|2,0,0]=3 1547 B8R0.37 CC(C)C(C)(N)C(N)=S Amb28388346 [0,1,0,0,0,0|2,1,0]=4 1548 B8R0.37 CC(C)C(C)(O)C(=O)O Amb18286212 [0,1,0,0,0,0|2,0,0]=3 1549 B8R0.37 CC(C)C(C)(O)C(N)=O Amb27948725 [0,1,0,0,0,0|3,0,0]=4 1550 B8R0.37 CC(C)C(F)(F)C(=O)O Amb26019477 [0,1,0,0,0,0|2,0,0]=3 1551 B8R0.37 CC(C)[C@@](C)(N)C(=O)O Amb16183901 [0,1,0,0,0,0|1,0,0]=2 1552 B8R0.37 CC(C)[C@@](C)(N)C(N)=O Amb25886638 [0,1,0,0,0,0|2,0,0]=3 1553 B8R0.37 CC(C)[C@](C)(N)C(=O)O Amb10603127 [0,1,0,0,0,0|1,0,0]=2 1554 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,1,0,0,0,0|2,0,0]=3 1555 B8R0.37 CC(C)[C@](C)(O)C(=O)O Amb16231522 [0,1,0,0,0,0|2,0,0]=3 1556 B8R0.37 CC(Cl)C(C)(C)C(=O)Cl Amb27407817 [0,1,0,0,0,0|3,0,0]=4 1557 B8R0.37 CC(Cl)C(C)(O)C(=O)O Amb27243989 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.37 CC(Cl)C(Cl)(Cl)C(=O)O Amb22168920 [0,1,0,0,0,0|2,0,0]=3 1559 B8R0.37 CC(Cl)C(Cl)(Cl)C(N)=O Amb28384163 [0,1,0,0,0,0|3,0,0]=4 1560 B8R0.37 CC(F)C(F)(F)C(=O)O Amb26315929 [0,1,0,0,0,0|2,0,0]=3 1561 B8R0.37 CC(F)C(F)(F)C(N)=O Amb27640183 [0,1,0,0,0,0|3,0,0]=4 1562 B8R0.37 CC(N)(C(=O)O)C(=O)O Amb28347069 [0,1,0,0,0,0|1,0,1]=3 1563 B8R0.37 CC(N)(C(=O)O)C(F)F Amb26502497 [0,1,0,0,0,0|2,0,0]=3 1564 B8R0.37 CC(N)(C(=O)O)C(F)F Amb33328723 [0,1,0,0,0,0|2,0,0]=3 1565 B8R0.37 CC(N)(C(N)=O)C(=O)O Amb27593792 [0,1,0,0,0,0|1,0,2]=4 1566 B8R0.37 CC(N)(C(N)=O)C(F)F Amb27236529 [0,1,0,0,0,0|3,0,0]=4 1567 B8R0.37 CC(N)C(C)(C)C(=O)O Amb24681858 [0,1,0,0,0,0|2,0,0]=3 1568 B8R0.37 CC(N)C(F)(F)C(=O)O Amb25188946 [0,1,0,0,0,0|2,0,0]=3 1569 B8R0.37 CC(O)C(C)(C)C(=O)O Amb18961474 [0,1,0,0,0,0|1,0,0]=2 1570 B8R0.37 CC(O)C(C)(C)[N+](=O)[O-] Amb22361103 [0,1,0,0,0,0|2,0,1]=4 1571 B8R0.37 CC(O)C(C)(N)C(=O)O Amb2780038 [0,1,0,0,0,0|0,0,0]=1 1572 B8R0.37 CC(O)C(C)(N)C(=O)O Amb30585196 [0,1,0,0,0,0|0,0,0]=1 1573 B8R0.37 CC(O)C(C)(O)C(=O)O Amb18124401 [0,1,0,0,0,0|1,0,0]=2 1574 B8R0.37 CC(O)C(C)(O)C(C)O Amb26454147 [0,1,0,0,0,0|2,0,1]=4 1575 B8R0.37 CC(O)C(C)(O)[C@H](C)O Amb28399008 [0,1,0,0,0,0|2,0,1]=4 1576 B8R0.37 CC(O)C(F)(F)C(=O)O Amb30623506 [0,1,0,0,0,0|1,0,0]=2 1577 B8R0.37 CN(C)C(C)(C)C(=O)O Amb33550826 [0,1,0,0,0,0|3,0,0]=4 1578 B8R0.37 CN(C)C(C)(C)C(=O)O Amb3976483 [0,1,0,0,0,0|3,0,0]=4 1579 B8R0.37 CN(Cl)C(C)(C)C(=O)O Amb28137981 [0,1,0,0,0,0|3,0,0]=4 1580 B8R0.37 C[C@@H](F)[C@@](C)(N)C(=O)O Amb26917123 [0,1,0,0,0,0|1,0,0]=2 1581 B8R0.37 C[C@@H](O)C(C)(C)[C@@H](C)O Amb27956623 [0,1,0,0,0,0|2,0,1]=4 1582 B8R0.37 C[C@@H](O)[C@@](C)(N)C(=O)O Amb26458741 [0,1,0,0,0,0|0,0,0]=1 1583 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O Amb27776914 [0,1,0,0,0,0|0,0,0]=1 1584 B8R0.37 C[C@@](N)(C(=O)O)C(F)F Amb25107781 [0,1,0,0,0,0|2,0,0]=3 1585 B8R0.37 C[C@H](N)C(F)(F)C(=O)O Amb28457233 [0,1,0,0,0,0|2,0,0]=3 1586 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O Amb22232016 [0,1,0,0,0,0|0,0,0]=1 1587 B8R0.37 C[C@H](O)[C@](C)(N)C(=O)O Amb26390846 [0,1,0,0,0,0|0,0,0]=1 1588 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O Amb27974163 [0,1,0,0,0,0|1,0,0]=2 1589 B8R0.37 O=C(O)C(Cl)(Cl)C(=O)O Amb17594338 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.37 O=C(O)C(F)(F)C(=O)O Amb24088375 [0,1,0,0,0,0|2,0,1]=4 1591 B8R0.37 O=C(O)C(F)(F)C(F)Br Amb10839241 [0,1,0,0,0,0|3,0,0]=4 1592 B8R0.37 O=C(O)C(F)(F)C(F)Cl Amb17594051 [0,1,0,0,0,0|3,0,0]=4 1593 B8R0.37 O=C(O)C(F)(F)C(F)F Amb2690535 [0,1,0,0,0,0|3,0,0]=4 1594 B8R0.37 O=C(O)C(O)(Br)C(=O)O Amb27634888 [0,1,0,0,0,0|2,0,1]=4 1595 B8R0.37 O=C(O)C(O)(O)C(=O)O Amb22002022 [0,1,0,0,0,0|2,0,1]=4 1596 B8R1.29 CC1(C)CC(=O)C1Br Amb28458511 [0,0,0,1,0,0|3,0,0]=4 1597 B8R1.29 CC1(C)NC(=O)[C@H]1N Amb28066066 [0,0,0,1,0,0|2,0,0]=3 1598 B8R1.29 CC1(C)OC(=O)C1Cl Amb27232959 [0,0,0,1,0,0|2,0,0]=3 1599 B8R1.29 CC1(C)SC(=O)C1N Amb25836418 [0,0,0,1,0,0|1,1,0]=3 1600 B8R1.29 CC1(C)SC(=O)C1N Amb33330064 [0,0,0,1,0,0|1,1,0]=3 1601 B8R1.29 CC1(C)SC(=O)[C@@H]1N Amb26580763 [0,0,0,1,0,0|1,1,0]=3 1602 B8R1.29 CC1(C)SC(=O)[C@@H]1N Amb33465336 [0,0,0,1,0,0|1,1,0]=3 1603 B8R1.29 CC1(C)SC(=O)[C@H]1N Amb27169489 [0,0,0,1,0,0|1,1,0]=3 1604 B8R1.29 CC1C(=O)CC1(C)C Amb28122376 [0,0,0,1,0,0|3,0,0]=4 1605 B8R1.30 C=C1CC1(C)C(C)O Amb27858571 [0,0,0,1,0,0|3,0,0]=4 1606 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [0,0,0,1,0,0|1,0,1]=3 1607 B8R1.30 C=C1C[C@@]1(C)[C@@H](C)O Amb27198006 [0,0,0,1,0,0|3,0,0]=4 1608 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1C Amb28131473 [0,0,0,1,0,0|3,0,0]=4 1609 B8R1.30 CC(=O)[C@]1(C)C[C@H]1C Amb28054445 [0,0,0,1,0,0|3,0,0]=4 1610 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Cl Amb27965058 [0,0,0,1,0,0|3,0,0]=4 1611 B8R1.30 CC(O)[C@]1(C)O[C@@H]1C Amb27662429 [0,0,0,1,0,0|2,0,1]=4 1612 B8R1.30 CC1(C(=O)Cl)CC1Br Amb27637734 [0,0,0,1,0,0|3,0,0]=4 1613 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,0,0,1,0,0|2,0,0]=3 1614 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,0,0,1,0,0|2,0,0]=3 1615 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,0,0,1,0,0|2,0,0]=3 1616 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,0,0,1,0,0|2,0,0]=3 1617 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,0,0,1,0,0|2,0,0]=3 1618 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,0,0,1,0,0|1,0,0]=2 1619 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [0,0,0,1,0,0|2,0,0]=3 1620 B8R1.30 C[C@@H](O)[C@@]1(C)O[C@@H]1C Amb27804524 [0,0,0,1,0,0|2,0,1]=4 1621 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,0,0,1,0,0|2,0,0]=3 1622 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [0,0,0,1,0,0|2,0,0]=3 1623 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,0,0,1,0,0|2,0,0]=3 1624 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,0,0,1,0,0|1,0,0]=2 1625 B8R1.30 C[C@@H]1O[C@]1(C)[C@@H](C)O Amb27981720 [0,0,0,1,0,0|2,0,1]=4 1626 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,0,0,1,0,0|2,0,0]=3 1627 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,0,0,1,0,0|2,0,0]=3 1628 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,0,0,1,0,0|2,0,0]=3 1629 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,0,0,1,0,0|2,0,0]=3 1630 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,0,0,1,0,0|2,0,0]=3 1631 B8R1.30 C[C@H](O)[C@]1(C)O[C@@H]1C Amb27463940 [0,0,0,1,0,0|2,0,1]=4 1632 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,0,0,1,0,0|2,0,0]=3 1633 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,0,0,1,0,0|2,0,0]=3 1634 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,0,0,1,0,0|1,0,0]=2 1635 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [0,0,0,1,0,0|2,0,0]=3 1636 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,0,0,1,0,0|2,0,0]=3 1637 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,0,0,1,0,0|2,0,0]=3 1638 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,0,0,1,0,0|2,0,0]=3 1639 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [0,0,0,1,0,0|1,0,0]=2 1640 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [0,0,0,1,0,0|1,0,0]=2 1641 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [0,0,0,1,0,0|1,0,0]=2 1642 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [0,0,0,1,0,0|1,0,0]=2 1643 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [0,0,0,1,0,0|1,0,0]=2 1644 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [0,0,0,1,0,0|1,0,0]=2 1645 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [0,0,0,1,0,0|1,0,0]=2 1646 B8R1.31 C=C(C)C1CCC1O Amb25993078 [0,0,0,1,0,0|3,0,0]=4 1647 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,0,0,1,0,0|2,0,1]=4 1648 B8R1.31 CC(=O)C1CCC1O Amb33213172 [0,0,0,1,0,0|2,0,0]=3 1649 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,0,0,1,0,0|3,0,0]=4 1650 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,0,0,1,0,0|3,0,0]=4 1651 B8R1.31 CC(C)C1CCC1=O Amb26599211 [0,0,0,1,0,0|3,0,0]=4 1652 B8R1.31 CC(C)C1CNC1=O Amb28252476 [0,0,0,1,0,0|3,0,0]=4 1653 B8R1.31 CC(C)C1OCC1=O Amb23456090 [0,0,0,1,0,0|3,0,0]=4 1654 B8R1.31 CC(O)C1CNC1=O Amb27872309 [0,0,0,1,0,0|2,0,0]=3 1655 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,1,0,0|2,0,0]=3 1656 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,0,0,1,0,0|2,0,0]=3 1657 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,0,0,1,0,0|3,0,0]=4 1658 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,0,0,1,0,0|3,0,0]=4 1659 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,0,0,1,0,0|3,0,0]=4 1660 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,1,0,0|2,0,0]=3 1661 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,0,0,1,0,0|1,0,0]=2 1662 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,0,0,1,0,0|1,0,0]=2 1663 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,0,0,1,0,0|2,0,0]=3 1664 B8R1.31 C[C@H](N)[C@@H]1CNC1=O Amb27446546 [0,0,0,1,0,0|3,0,0]=4 1665 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,0,0,1,0,0|3,0,0]=4 1666 B8R1.31 NC(=O)C1CCC1F Amb32943793 [0,0,0,1,0,0|3,0,0]=4 1667 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,0,0,1,0,0|3,0,0]=4 1668 B8R1.31 NC(=O)C1NOC1=O Amb27202973 [0,0,0,1,0,0|1,0,2]=4 1669 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,0,0,1,0,0|3,0,0]=4 1670 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,0,0,1,0,0|2,0,0]=3 1671 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,0,0,1,0,0|2,0,0]=3 1672 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,0,0,1,0,0|3,0,0]=4 1673 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,0,0,1,0,0|2,0,0]=3 1674 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,0,0,1,0,0|2,0,0]=3 1675 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,0,0,1,0,0|2,0,0]=3 1676 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,0,0,1,0,0|2,0,0]=3 1677 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,0,0,1,0,0|2,0,0]=3 1678 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,0,0,1,0,0|2,0,0]=3 1679 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,0,0,1,0,0|2,0,0]=3 1680 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,0,0,1,0,0|2,0,0]=3 1681 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,0,0,1,0,0|2,0,0]=3 1682 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,0,0,1,0,0|2,0,0]=3 1683 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,0,0,1,0,0|2,0,0]=3 1684 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [0,0,0,1,0,0|2,0,1]=4 1685 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [0,0,0,1,0,0|1,0,1]=3 1686 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,0,0,1,0,0|2,0,0]=3 1687 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,0,0,1,0,0|2,0,0]=3 1688 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,0,0,1,0,0|1,0,0]=2 1689 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,0,0,1,0,0|1,0,0]=2 1690 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,0,0,1,0,0|1,0,0]=2 1691 B8R1.31 O=C1CNC1C(F)F Amb27752340 [0,0,0,1,0,0|3,0,0]=4 1692 B8R1.31 [C@@H]1([C@@H](C)O)CNC1=O Amb17843592 [0,0,0,1,0,0|2,0,0]=3 1693 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,0,0,1,0,0|2,0,1]=4 1694 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,0,0,1,0,0|1,0,1]=3 1695 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,0,0,1,0,0|1,0,1]=3 1696 B8R1.50 C=C1CCC(O)C1C Amb27858013 [0,0,0,1,0,0|3,0,0]=4 1697 B8R1.50 C=C1COC(C)C1C Amb29856199 [0,0,0,1,0,0|3,0,0]=4 1698 B8R1.50 CC1=C(O)COC1=O Amb2611869 [0,0,0,1,0,0|1,0,2]=4 1699 B8R1.50 CC1=NNC(=O)C1N Amb32664286 [0,0,0,1,0,0|2,0,1]=4 1700 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,0,0,1,0,0|2,0,1]=4 1701 B8R1.50 CC1C(=O)COC1=O Amb4035239 [0,0,0,1,0,0|1,0,2]=4 1702 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,0,0,1,0,0|1,0,0]=2 1703 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,0,0,1,0,0|1,0,0]=2 1704 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,0,0,1,0,0|3,0,0]=4 1705 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,0,0,1,0,0|2,0,0]=3 1706 B8R1.50 CC1CCC(O)C1N Amb26505400 [0,0,0,1,0,0|2,0,1]=4 1707 B8R1.50 CC1CNC(=O)C1C Amb24334186 [0,0,0,1,0,0|3,0,0]=4 1708 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,0,0,1,0,0|2,0,1]=4 1709 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,0,0,1,0,0|2,0,0]=3 1710 B8R1.50 CC1NNC(=O)C1C Amb35693716 [0,0,0,1,0,0|3,0,0]=4 1711 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,0,0,1,0,0|2,0,0]=3 1712 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,0,0,1,0,0|2,0,0]=3 1713 B8R1.50 CC1OCC(N)C1N Amb27230142 [0,0,0,1,0,0|2,0,1]=4 1714 B8R1.50 CC1OCC(O)C1C Amb35730974 [0,0,0,1,0,0|2,0,1]=4 1715 B8R1.50 CC1[C@H](O)CC[C@H]1O Amb27457757 [0,0,0,1,0,0|2,0,1]=4 1716 B8R1.50 CN1C(=O)CCC1O Amb17615583 [0,0,0,1,0,0|3,0,0]=4 1717 B8R1.50 C[C@@H]1C(=O)C=C[C@H]1O Amb27785473 [0,0,0,1,0,0|2,0,1]=4 1718 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,0,0,1,0,0|2,0,0]=3 1719 B8R1.50 C[C@@H]1C(=O)NC[C@H]1O Amb27881742 [0,0,0,1,0,0|2,0,0]=3 1720 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,0,0,1,0,0|2,0,0]=3 1721 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,0,0,1,0,0|2,0,0]=3 1722 B8R1.50 C[C@@H]1CNC(=O)[C@H]1C Amb27437481 [0,0,0,1,0,0|3,0,0]=4 1723 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,0,0,1,0,0|2,0,0]=3 1724 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,0,0,1,0,0|2,0,0]=3 1725 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1Cl Amb27881804 [0,0,0,1,0,0|3,0,0]=4 1726 B8R1.50 C[C@H]1CC[C@H](O)[C@@H]1N Amb28132647 [0,0,0,1,0,0|2,0,1]=4 1727 B8R1.50 C[C@H]1CNC(=O)[C@@H]1C Amb27783966 [0,0,0,1,0,0|3,0,0]=4 1728 B8R1.50 N=C1COC(=O)C1N Amb27839054 [0,0,0,1,0,0|1,0,1]=3 1729 B8R1.50 NC1=C(O)CCC1=O Amb27203866 [0,0,0,1,0,0|1,0,2]=4 1730 B8R1.50 NC1=C(O)COC1=O Amb27830449 [0,0,0,1,0,0|0,0,2]=3 1731 B8R1.50 NC1C(=O)CCC1=O Amb27409660 [0,0,0,1,0,0|1,0,2]=4 1732 B8R1.50 NC1C(O)CCC1Cl Amb27755050 [0,0,0,1,0,0|2,0,1]=4 1733 B8R1.50 NC1CNC(=O)C1N Amb18641832 [0,0,0,1,0,0|2,0,0]=3 1734 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O Amb27420900 [0,0,0,1,0,0|1,0,0]=2 1735 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O Amb28289413 [0,0,0,1,0,0|1,0,0]=2 1736 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [0,0,0,1,0,0|0,0,0]=1 1737 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [0,0,0,1,0,0|0,0,0]=1 1738 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [0,0,0,1,0,0|0,0,0]=1 1739 B8R1.50 N[C@H]1C(=O)NC[C@H]1O Amb28346232 [0,0,0,1,0,0|1,0,0]=2 1740 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [0,0,0,1,0,0|0,0,0]=1 1741 B8R1.50 O=C1C=CC(O)C1Cl Amb27863645 [0,0,0,1,0,0|2,0,1]=4 1742 B8R1.50 O=C1C=C[C@@H](O)[C@@H]1Cl Amb28324060 [0,0,0,1,0,0|2,0,1]=4 1743 B8R1.50 O=C1CCC(F)C1Br Amb27875964 [0,0,0,1,0,0|3,0,0]=4 1744 B8R1.50 O=C1CCC(O)N1O Amb27214701 [0,0,0,1,0,0|3,0,0]=4 1745 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,0,0,1,0,0|2,0,0]=3 1746 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [0,0,0,1,0,0|1,0,2]=4 1747 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [0,0,0,1,0,0|1,0,2]=4 1748 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,0,0,1,0,0|2,0,0]=3 1749 B8R1.50 O=C1OC=C(O)C1Cl Amb28396605 [0,0,0,1,0,0|1,0,2]=4 1750 B8R1.50 O=C1OCC(O)=C1Br Amb5751200 [0,0,0,1,0,0|1,0,2]=4 1751 B8R1.50 O=C1OCC(O)=C1F Amb27812981 [0,0,0,1,0,0|1,0,2]=4 1752 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,0,0,1,0,0|1,0,2]=4 1753 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,0,0,1,0,0|1,0,0]=2 1754 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,0,0,1,0,0|1,0,0]=2 1755 B8R1.50 O=C1OC[C@@H](O)[C@H]1Br Amb32414616 [0,0,0,1,0,0|1,0,0]=2 1756 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,0,0,1,0,0|1,0,0]=2 1757 B8R1.50 O=C1OC[C@H](O)[C@@H]1Br Amb10067848 [0,0,0,1,0,0|1,0,0]=2 1758 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,0,0,1,0,0|1,0,0]=2 1759 B8R1.50 O=C1OC[C@H](O)[C@H]1Br Amb27634828 [0,0,0,1,0,0|1,0,0]=2 1760 B8R1.50 O=C1OC[C@H](O)[C@H]1F Amb27775907 [0,0,0,1,0,0|1,0,0]=2 1761 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,0,0,1,0,0|1,0,0]=2 1762 B8R1.50 O=C1ON=C(O)C1F Amb27193869 [0,0,0,1,0,0|2,0,1]=4 1763 B8R1.50 OC1CNC(O)C1O Amb27794824 [0,0,0,1,0,0|2,0,1]=4 1764 B8R1.50 OC1OC[C@H](O)[C@H]1O Amb24737731 [0,0,0,1,0,0|1,0,2]=4 1765 B8R1.50 OC1[C@H](O)CC[C@H]1O Amb28077602 [0,0,0,1,0,0|2,0,1]=4 1766 B8R1.50 O[C@@H]1CO[C@@H](O)[C@@H]1O Amb27968599 [0,0,0,1,0,0|1,0,2]=4 1767 B8R1.50 O[C@@H]1NC[C@@H](O)[C@H]1O Amb28133854 [0,0,0,1,0,0|2,0,1]=4 1768 B8R1.50 O[C@H]1CO[C@@H](O)[C@H]1O Amb28079143 [0,0,0,1,0,0|1,0,2]=4 1769 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [0,0,0,1,0,0|2,0,1]=4 1770 B8R1.54 C=C(C)C(N)C1CC1 Amb27234544 [0,0,0,1,0,0|3,0,0]=4 1771 B8R1.54 CC(=O)C(C)C1CC1 Amb25798488 [0,0,0,1,0,0|3,0,0]=4 1772 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [0,0,0,1,0,0|2,0,0]=3 1773 B8R1.54 CC(=O)N(N)C1CC1 Amb33191631 [0,0,0,1,0,0|3,0,0]=4 1774 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,0,0,1,0,0|2,0,0]=3 1775 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,0,0,1,0,0|2,0,0]=3 1776 B8R1.54 C[C@@H](O)[C@@H](C)[C@H]1CO1 Amb28318842 [0,0,0,1,0,0|2,0,1]=4 1777 B8R1.54 C[C@@H](O)[C@@H](N)C1CC1 Amb28132696 [0,0,0,1,0,0|2,0,1]=4 1778 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,0,0,1,0,0|2,0,0]=3 1779 B8R1.54 C[C@H](O)[C@@H](N)C1CC1 Amb28429788 [0,0,0,1,0,0|2,0,1]=4 1780 B8R1.54 C[C@H](O)[C@@H](O)[C@H]1CO1 Amb27196482 [0,0,0,1,0,0|2,0,1]=4 1781 B8R1.54 N=C(N)C(N)C1CC1 Amb28142515 [0,0,0,1,0,0|3,0,0]=4 1782 B8R1.54 NC(=O)C(Cl)C1CC1 Amb26875098 [0,0,0,1,0,0|3,0,0]=4 1783 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [0,0,0,1,0,0|2,0,0]=3 1784 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [0,0,0,1,0,0|2,0,0]=3 1785 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,0,0,1,0,0|3,0,0]=4 1786 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [0,0,0,1,0,0|2,0,0]=3 1787 B8R1.54 NC(=S)C(N)C1CC1 Amb27858041 [0,0,0,1,0,0|2,1,0]=4 1788 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [0,0,0,1,0,0|1,0,0]=2 1789 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [0,0,0,1,0,0|1,0,0]=2 1790 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [0,0,0,1,0,0|1,0,0]=2 1791 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [0,0,0,1,0,0|1,0,0]=2 1792 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [0,0,0,1,0,0|1,0,0]=2 1793 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [0,0,0,1,0,0|2,0,1]=4 1794 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [0,0,0,1,0,0|2,0,0]=3 1795 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [0,0,0,1,0,0|2,0,0]=3 1796 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|3,0,0]=4 1797 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,0,0,1,0,0|2,0,0]=3 1798 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,0,0,1,0,0|3,0,0]=4 1799 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|2,0,0]=3 1800 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,0,0,1,0,0|3,0,0]=4 1801 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|2,0,0]=3 1802 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,0,0,1,0,0|3,0,0]=4 1803 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|2,0,0]=3 1804 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,0,0,1,0,0|3,0,0]=4 1805 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,0,0,1,0,0|3,0,0]=4 1806 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|2,0,0]=3 1807 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,0,0,1,0,0|3,0,0]=4 1808 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|2,0,0]=3 1809 B8R1.77 O=C(O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,0|3,0,0]=4 1810 B8R1.77 O=C(O)C1CC1(F)Br Amb25952257 [0,0,0,1,0,0|3,0,0]=4 1811 B8R1.77 O=C(O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,0|3,0,0]=4 1812 B8R1.77 O=C(O)C1CC1(F)F Amb2691845 [0,0,0,1,0,0|3,0,0]=4 1813 B8R1.77 O=C(O)[C@@H]1CC1(F)F Amb30869365 [0,0,0,1,0,0|3,0,0]=4 1814 B8R1.77 O=C(O)[C@@H]1C[C@@]1(F)Cl Amb28252683 [0,0,0,1,0,0|3,0,0]=4 1815 B8R1.77 O=C(O)[C@H]1CC1(Cl)Cl Amb27444143 [0,0,0,1,0,0|3,0,0]=4 1816 B8R1.77 O=C(O)[C@H]1CC1(F)F Amb33802940 [0,0,0,1,0,0|3,0,0]=4 1817 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,0,0,0,0,1|2,0,1]=4 1818 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,0,0,0,0,1|1,0,2]=4 1819 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,0,0,0,0,1|1,0,2]=4 1820 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,0,0,0,0,1|1,0,2]=4 1821 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,0,0,0,0,1|2,0,1]=4 1822 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,0,0,0,0,1|1,0,1]=3 1823 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,0,0,0,0,1|2,0,1]=4 1824 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,0,0,0,0,1|2,0,1]=4 1825 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,0,0,0,0,1|2,0,1]=4 1826 B8R0.23 C=C(C)CC(C)C(C)O Amb28063256 [0,0,0,0,0,1|3,0,0]=4 1827 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,0,0,0,0,1|1,0,1]=3 1828 B8R0.23 C=C(C)CC(N)C(C)C Amb27595590 [0,0,0,0,0,1|3,0,0]=4 1829 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,0,0,0,0,1|2,0,1]=4 1830 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,0,0,0,0,1|2,0,1]=4 1831 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,0,0,0,0,1|2,0,1]=4 1832 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,0,0,0,0,1|1,0,1]=3 1833 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,0,0,0,0,1|2,0,1]=4 1834 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,0,0,0,0,1|1,0,1]=3 1835 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,0,0,0,0,1|2,0,1]=4 1836 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,0,0,0,0,1|2,0,1]=4 1837 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,0,0,0,0,1|2,0,1]=4 1838 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,0,0,0,0,1|2,0,1]=4 1839 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,0,0,0,0,1|2,0,1]=4 1840 B8R0.23 C=C(Cl)CC(C)C(C)O Amb33212811 [0,0,0,0,0,1|3,0,0]=4 1841 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,0,0,0,0,1|1,0,2]=4 1842 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,0,0,0,0,1|1,0,2]=4 1843 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,0,0,0,0,1|1,0,2]=4 1844 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,0,0,0,0,1|1,0,2]=4 1845 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,0,0,0,0,1|1,0,2]=4 1846 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,0,0,0,0,1|1,0,2]=4 1847 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,0,0,0,0,1|1,0,2]=4 1848 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,0,0,0,0,1|3,0,0]=4 1849 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,0,0,0,0,1|1,0,2]=4 1850 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,0,0,0,0,1|1,0,2]=4 1851 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,0,0,0,0,1|3,0,0]=4 1852 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,0,0,0,0,1|2,0,0]=3 1853 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,0,0,0,0,1|0,0,2]=3 1854 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,0,0,0,0,1|1,0,2]=4 1855 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,0,0,0,0,1|1,0,2]=4 1856 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,0,0,0,0,1|3,0,0]=4 1857 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,0,0,0,0,1|3,0,0]=4 1858 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,0,0,0,0,1|1,0,2]=4 1859 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,0,0,0,0,1|0,0,2]=3 1860 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,0,0,0,0,1|0,0,2]=3 1861 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,0,0,0,0,1|2,0,0]=3 1862 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,0,0,0,0,1|1,0,2]=4 1863 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,0,0,0,0,1|1,0,2]=4 1864 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,0,0,0,0,1|0,0,2]=3 1865 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,0,0,0,0,1|1,0,2]=4 1866 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,0,0,0,0,1|3,0,0]=4 1867 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,0,0,0,0,1|1,0,2]=4 1868 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,0,0,0,0,1|3,0,0]=4 1869 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,0,0,0,0,1|0,0,2]=3 1870 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,0,0,0,0,1|1,0,2]=4 1871 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,0,0,0,0,1|1,0,2]=4 1872 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,0,0,0,0,1|1,0,2]=4 1873 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,0,0,0,0,1|1,0,2]=4 1874 B8R0.23 CC(=O)OC(=O)C(C)O Amb28049127 [0,0,0,0,0,1|2,0,1]=4 1875 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,0,0,0,0,1|1,0,2]=4 1876 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [0,0,0,0,0,1|2,0,0]=3 1877 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,0,0,0,0,1|1,0,2]=4 1878 B8R0.23 CC(=O)O[C@@H](C)[C@@H](C)Br Amb24558149 [0,0,0,0,0,1|3,0,0]=4 1879 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [0,0,0,0,0,1|2,0,0]=3 1880 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,0,0,0,0,1|1,0,2]=4 1881 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [0,0,0,0,0,1|2,0,0]=3 1882 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,0,0,0,0,1|1,0,2]=4 1883 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,0,0,0,0,1|1,0,2]=4 1884 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,0,0,0,0,1|2,0,0]=3 1885 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,0,0,0,0,1|1,0,2]=4 1886 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,0,0,0,0,1|1,0,2]=4 1887 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,0,0,0,0,1|3,0,0]=4 1888 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,0,0,0,0,1|1,0,2]=4 1889 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,0,0,0,0,1|2,0,0]=3 1890 B8R0.23 CC(=O)\C(C)=C/C(C)O Amb27838725 [0,0,0,0,0,1|2,0,1]=4 1891 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,0,0,0,0,1|0,0,3]=4 1892 B8R0.23 CC(=O)\C=C(/N)C(C)C Amb27477023 [0,0,0,0,0,1|2,0,1]=4 1893 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,0,0,0,0,1|1,1,1]=4 1894 B8R0.23 CC(Br)C(C)NC(N)=O Amb27233701 [0,0,0,0,0,1|3,0,0]=4 1895 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,0,0,0,0,1|2,0,1]=4 1896 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,0,0,0,0,1|2,0,0]=3 1897 B8R0.23 CC(C)=CC(C)C(C)O Amb27956545 [0,0,0,0,0,1|3,0,0]=4 1898 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,0,0,0,0,1|2,0,1]=4 1899 B8R0.23 CC(C)=C[C@@H](C)[C@H](C)O Amb28049133 [0,0,0,0,0,1|3,0,0]=4 1900 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,0,0,0,0,1|2,0,1]=4 1901 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,0,0,0,0,1|2,0,1]=4 1902 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,0,0,0,0,1|2,0,0]=3 1903 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,0,0,0,0,1|3,0,0]=4 1904 B8R0.23 CC(C)C(C)NC(=O)Cl Amb35637133 [0,0,0,0,0,1|3,0,0]=4 1905 B8R0.23 CC(C)C(C)NC(N)=O Amb7761978 [0,0,0,0,0,1|3,0,0]=4 1906 B8R0.23 CC(C)C(C)OC(=O)Cl Amb27835399 [0,0,0,0,0,1|3,0,0]=4 1907 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,0,0,0,0,1|2,0,0]=3 1908 B8R0.23 CC(C)C(Cl)OC(=O)Cl Amb8515447 [0,0,0,0,0,1|3,0,0]=4 1909 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,0,0,0,0,1|1,0,0]=2 1910 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,0,0,0,0,1|1,0,0]=2 1911 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,0,0,0,0,1|2,0,0]=3 1912 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,0,0,0,0,1|2,0,0]=3 1913 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,0,0,0,0,1|1,0,2]=4 1914 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,0,0,0,0,1|2,0,1]=4 1915 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,0,0,0,0,1|3,0,0]=4 1916 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,0,0,0,0,1|2,0,0]=3 1917 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,0,0,0,0,1|2,0,0]=3 1918 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,0,0,0,0,1|3,0,0]=4 1919 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,0,0,0,0,1|2,0,0]=3 1920 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,0,0,0,0,1|2,0,0]=3 1921 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,0,0,0,0,1|1,0,0]=2 1922 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,0,0,0,0,1|2,0,1]=4 1923 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,0,0,0,0,1|2,0,0]=3 1924 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,0,0,0,0,1|2,0,0]=3 1925 B8R0.23 CC(C)CC(N)C(N)=S Amb28292675 [0,0,0,0,0,1|2,1,0]=4 1926 B8R0.23 CC(C)CC(N)C(O)O Amb27970496 [0,0,0,0,0,1|1,0,2]=4 1927 B8R0.23 CC(C)CC(N)P(O)O Amb27231724 [0,0,0,0,0,1|2,0,1]=4 1928 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,0,0,0,0,1|2,0,0]=3 1929 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,0,0,0,0,1|2,0,0]=3 1930 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,0,0,0,0,1|2,0,1]=4 1931 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,0,0,0,0,1|3,0,0]=4 1932 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,0,0,0,0,1|2,0,0]=3 1933 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,0,0,0,0,1|3,0,0]=4 1934 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,0,0,0,0,1|2,0,0]=3 1935 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,0,0,0,0,1|2,0,0]=3 1936 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,0,0,0,0,1|2,0,0]=3 1937 B8R0.23 CC(C)C[C@@H](N)B(O)O Amb27978098 [0,0,0,0,0,1|2,0,1]=4 1938 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,0,0,0,0,1|1,0,0]=2 1939 B8R0.23 CC(C)C[C@@H](N)C(C)O Amb28201191 [0,0,0,0,0,1|2,0,1]=4 1940 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,0,0,0,0,1|2,0,0]=3 1941 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,0,0,0,0,1|2,0,0]=3 1942 B8R0.23 CC(C)C[C@@H](N)C(N)=S Amb27450783 [0,0,0,0,0,1|2,1,0]=4 1943 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)O Amb27593782 [0,0,0,0,0,1|2,0,1]=4 1944 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,0,0,0,0,1|2,0,0]=3 1945 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,0,0,0,0,1|2,0,0]=3 1946 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,0,0,0,0,1|2,0,0]=3 1947 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,0,0,0,0,1|3,0,0]=4 1948 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,0,0,0,0,1|2,0,0]=3 1949 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,0,0,0,0,1|3,0,0]=4 1950 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,0,0,0,0,1|2,0,0]=3 1951 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,0,0,0,0,1|2,0,0]=3 1952 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,0,0,0,0,1|2,0,1]=4 1953 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,0,0,0,0,1|1,0,0]=2 1954 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,0,0,0,0,1|1,1,0]=3 1955 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,0,0,0,0,1|2,0,0]=3 1956 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,0,0,0,0,1|2,0,0]=3 1957 B8R0.23 CC(C)C[C@H](N)C(N)=S Amb28285298 [0,0,0,0,0,1|2,1,0]=4 1958 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,0,0,0,0,1|2,0,0]=3 1959 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,0,0,0,0,1|3,0,0]=4 1960 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,0,0,0,0,1|3,0,0]=4 1961 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,0,0,0,0,1|2,0,1]=4 1962 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,0,0,0,0,1|2,0,0]=3 1963 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,0,0,0,0,1|2,0,0]=3 1964 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,0,0,0,0,1|2,0,0]=3 1965 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,0,0,0,0,1|2,0,0]=3 1966 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,0,0,0,0,1|2,0,1]=4 1967 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,0,0,0,0,1|2,0,1]=4 1968 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,0,0,0,0,1|2,0,0]=3 1969 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,0,0,0,0,1|2,0,1]=4 1970 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,0,0,0,0,1|2,0,0]=3 1971 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,0,0,0,0,1|3,0,0]=4 1972 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,0,0,0,0,1|2,0,0]=3 1973 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,0,0,0,0,1|2,0,0]=3 1974 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,0,0,0,0,1|1,0,0]=2 1975 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,0,0,0,0,1|1,0,0]=2 1976 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,0,0,0,0,1|2,0,0]=3 1977 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,0,0,0,0,1|2,0,0]=3 1978 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,0,0,0,0,1|3,0,0]=4 1979 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,0,0,0,0,1|1,0,0]=2 1980 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,0,0,0,0,1|1,0,0]=2 1981 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,0,0,0,0,1|2,0,0]=3 1982 B8R0.23 CC(C)[C@H](N)C[C@H](C)O Amb27457995 [0,0,0,0,0,1|2,0,1]=4 1983 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,0,0,0,0,1|2,0,0]=3 1984 B8R0.23 CC(C)\C(N)=C\C(N)=O Amb27413103 [0,0,0,0,0,1|2,0,1]=4 1985 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,0,0,0,0,1|2,0,1]=4 1986 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,0,0,0,0,1|2,0,1]=4 1987 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,0,0,0,0,1|2,0,1]=4 1988 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,0,0,0,0,1|2,0,1]=4 1989 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,0,0,0,0,1|3,0,0]=4 1990 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,0,0,0,0,1|3,0,0]=4 1991 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,0,0,0,0,1|3,0,0]=4 1992 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,0,0,0,0,1|3,0,0]=4 1993 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,0,0,0,0,1|2,0,0]=3 1994 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,0,0,0,0,1|3,0,0]=4 1995 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,0,0,0,0,1|3,0,0]=4 1996 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,0,0,0,0,1|3,0,0]=4 1997 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,0,0,0,0,1|3,0,0]=4 1998 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,0,0,0,0,1|3,0,0]=4 1999 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,0,0,0,0,1|2,0,1]=4 2000 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,0,0,0,0,1|3,0,0]=4 2001 B8R0.23 CC(Cl)C(C)OC(=O)Cl Amb27831442 [0,0,0,0,0,1|3,0,0]=4 2002 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,0,0,0,0,1|1,0,0]=2 2003 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,0,0,0,0,1|2,0,1]=4 2004 B8R0.23 CC(N)C(C)NC(N)=O Amb27427383 [0,0,0,0,0,1|3,0,0]=4 2005 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,0,0,0,0,1|2,0,0]=3 2006 B8R0.23 CC(N)C(O)CC(N)=O Amb28184577 [0,0,0,0,0,1|3,0,0]=4 2007 B8R0.23 CC(N)C(O)C[PH](=O)O Amb28130506 [0,0,0,0,0,1|3,0,0]=4 2008 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,0,0,0,0,1|1,0,0]=2 2009 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,0,0,0,0,1|2,0,0]=3 2010 B8R0.23 CC(N)[C@@H](O)C[PH](=O)O Amb27841881 [0,0,0,0,0,1|3,0,0]=4 2011 B8R0.23 CC(O)C(=O)NC(N)=O Amb9421397 [0,0,0,0,0,1|2,0,1]=4 2012 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [0,0,0,0,0,1|2,0,0]=3 2013 B8R0.23 CC(O)C(C)OC(N)=O Amb27644455 [0,0,0,0,0,1|2,0,0]=3 2014 B8R0.23 CC(O)C(C)OP(O)O Amb28049277 [0,0,0,0,0,1|2,0,1]=4 2015 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,0,0,0,0,1|0,0,0]=1 2016 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,0,0,0,0,1|1,0,0]=2 2017 B8R0.23 CC(O)C(N)CN(C)C Amb18203169 [0,0,0,0,0,1|3,0,0]=4 2018 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,0,0,0,0,1|1,0,1]=3 2019 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,0,0,0,0,1|0,0,0]=1 2020 B8R0.23 CC(O)CC(N)C(C)C Amb27956567 [0,0,0,0,0,1|2,0,1]=4 2021 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,0,0,0,0,1|1,0,0]=2 2022 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,0,0,0,0,1|0,0,0]=1 2023 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,0,0,0,0,1|0,0,0]=1 2024 B8R0.23 CC(OC(F)F)C(=O)O Amb24358717 [0,0,0,0,0,1|3,0,0]=4 2025 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,0,0,0,0,1|2,0,0]=3 2026 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,0,0,0,0,1|2,0,0]=3 2027 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,0,0,0,0,1|2,0,0]=3 2028 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,0,0,0,0,1|3,0,0]=4 2029 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,0,0,0,0,1|3,0,0]=4 2030 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,0,0,0,0,1|2,0,0]=3 2031 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,0,0,0,0,1|2,0,0]=3 2032 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,0,0,0,0,1|2,0,0]=3 2033 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,0,0,0,0,1|3,0,0]=4 2034 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,0,0,0,0,1|2,0,0]=3 2035 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,0,0,0,0,1|1,0,1]=3 2036 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,0,0,0,0,1|2,0,1]=4 2037 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,0,0,0,0,1|1,0,1]=3 2038 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,0,0,0,0,1|1,0,1]=3 2039 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,0,0,0,0,1|2,0,1]=4 2040 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,0,0,0,0,1|3,0,0]=4 2041 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,0,0,0,0,1|1,0,0]=2 2042 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,0,0,0,0,1|0,0,0]=1 2043 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,0,0,0,0,1|0,0,0]=1 2044 B8R0.23 C[C@@H](OC(F)F)C(=O)O Amb24389309 [0,0,0,0,0,1|3,0,0]=4 2045 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,0,0,0,0,1|2,0,1]=4 2046 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,0,0,0,0,1|3,0,0]=4 2047 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,0,0,0,0,1|2,0,1]=4 2048 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,0,0,0,0,1|3,0,0]=4 2049 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,0,0,0,0,1|2,0,0]=3 2050 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,0,0,0,0,1|2,0,0]=3 2051 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,0,0,0,0,1|1,0,0]=2 2052 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,0,0,0,0,1|2,0,0]=3 2053 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,0,0,0,0,1|2,0,0]=3 2054 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,0,0,0,0,1|2,0,1]=4 2055 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,0,0,0,0,1|0,0,0]=1 2056 B8R0.23 C[C@H](O)[C@@H](N)CN(C)C Amb25114644 [0,0,0,0,0,1|3,0,0]=4 2057 B8R0.23 C[C@H](OC(F)F)C(=O)O Amb26499188 [0,0,0,0,0,1|3,0,0]=4 2058 B8R0.23 C[C@H](OC(N)=O)[C@@H](C)Cl Amb27875080 [0,0,0,0,0,1|3,0,0]=4 2059 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,0,0,0,0,1|1,0,1]=3 2060 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,0,0,0,0,1|1,0,1]=3 2061 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,0,0,0,0,1|1,0,1]=3 2062 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,0,0,0,0,1|2,0,1]=4 2063 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,0,0,0,0,1|2,0,1]=4 2064 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,0,0,0,0,1|2,0,1]=4 2065 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,0,0,0,0,1|2,0,1]=4 2066 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,0,0,0,0,1|2,0,1]=4 2067 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,0,0,0,0,1|1,0,2]=4 2068 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,0,0,0,0,1|1,0,2]=4 2069 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,0,0,0,0,1|1,0,2]=4 2070 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [0,0,0,0,0,1|3,0,0]=4 2071 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,0,0,0,0,1|1,0,2]=4 2072 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,0,0,0,0,1|1,0,2]=4 2073 B8R0.23 NC(=O)CC(N)C(F)F Amb32418214 [0,0,0,0,0,1|3,0,0]=4 2074 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,0,0,0,0,1|1,0,2]=4 2075 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,0,0,0,0,1|1,0,2]=4 2076 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,0,0,0,0,1|1,0,2]=4 2077 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,0,0,0,0,1|1,0,2]=4 2078 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,0,0,0,0,1|1,0,2]=4 2079 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,0,0,0,0,1|1,0,2]=4 2080 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,0,0,0,0,1|1,0,2]=4 2081 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,0,0,0,0,1|1,0,2]=4 2082 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [0,0,0,0,0,1|3,0,0]=4 2083 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,0,0,0,0,1|1,1,1]=4 2084 B8R0.23 NC(C=C(Cl)Cl)C(=O)O Amb22350718 [0,0,0,0,0,1|2,0,1]=4 2085 B8R0.23 NC(C=S(=O)=O)C(=O)O Amb27231764 [0,0,0,0,0,1|2,0,1]=4 2086 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,0,0,0,0,1|2,0,0]=3 2087 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,0,0,0,0,1|2,0,0]=3 2088 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,0,0,0,0,1|1,0,1]=3 2089 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,0,0,0,0,1|1,0,2]=4 2090 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,0,0,0,0,1|1,0,2]=4 2091 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,0,0,0,0,1|2,0,0]=3 2092 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,0,0,0,0,1|2,0,0]=3 2093 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,0,0,0,0,1|2,0,0]=3 2094 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,0,0,0,0,1|2,0,0]=3 2095 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,0,0,0,0,1|2,0,0]=3 2096 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,0,0,0,0,1|2,0,0]=3 2097 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,0,0,0,0,1|1,0,1]=3 2098 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,0,0,0,0,1|1,0,1]=3 2099 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,0,0,0,0,1|1,0,2]=4 2100 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,0,0,0,0,1|1,0,2]=4 2101 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,0,0,0,0,1|1,0,2]=4 2102 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,0,0,0,0,1|2,0,0]=3 2103 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,0,0,0,0,1|2,0,0]=3 2104 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,0,0,0,0,1|2,0,0]=3 2105 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,0,0,0,0,1|2,0,0]=3 2106 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,0,0,0,0,1|2,0,1]=4 2107 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,0,0,0,0,1|1,0,1]=3 2108 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,0,0,0,0,1|2,0,0]=3 2109 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,0,0,0,0,1|2,0,0]=3 2110 B8R0.23 N\C(=C/C(=O)O)C(F)F Amb27607399 [0,0,0,0,0,1|2,0,1]=4 2111 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,0,0,0,0,1|3,0,0]=4 2112 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,0,0,0,0,1|2,0,0]=3 2113 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,0,0,0,0,1|2,0,1]=4 2114 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,0,0,0,0,1|2,0,1]=4 2115 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,0,0,0,0,1|2,0,1]=4 2116 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,0,0,0,0,1|3,0,0]=4 2117 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,0,0,0,0,1|2,0,1]=4 2118 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,0,0,0,0,1|2,0,1]=4 2119 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,0,0,0,0,1|2,0,1]=4 2120 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,0,0,0,0,1|2,0,1]=4 2121 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,0,0,0,0,1|2,0,1]=4 2122 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,0,0,0,0,1|3,0,0]=4 2123 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,0,0,0,0,1|2,0,1]=4 2124 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,0,0,0,0,1|2,0,1]=4 2125 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,0,0,0,0,1|2,0,1]=4 2126 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,0,0,0,0,1|2,0,1]=4 2127 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,0,0,0,0,1|3,0,0]=4 2128 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,0,0,0,0,1|3,0,0]=4 2129 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|2,0,0]=4 2130 B5R0.1 C#CCC(=O)O Amb33532662 [2,0,0,0,0,0|0,0,2]=4 2131 B5R0.1 C#CCC(C)O Amb8517580 [2,0,0,0,0,0|1,0,1]=4 2132 B5R0.1 C#CC[C@@H](C)O Amb28461325 [2,0,0,0,0,0|1,0,1]=4 2133 B5R0.1 C#CC[C@H](C)O Amb8390123 [2,0,0,0,0,0|1,0,1]=4 2134 B5R0.1 C=C(Br)CCO Amb4014497 [2,0,0,0,0,0|2,0,0]=4 2135 B5R0.1 C=C(C)CC=O Amb28202583 [2,0,0,0,0,0|1,0,1]=4 2136 B5R0.1 C=C(C)CCC Amb8513259 [2,0,0,0,0,0|2,0,0]=4 2137 B5R0.1 C=C(C)CCO Amb34916534 [2,0,0,0,0,0|2,0,0]=4 2138 B5R0.1 C=C(C)CCO Amb8513522 [2,0,0,0,0,0|2,0,0]=4 2139 B5R0.1 C=CCC(=O)O Amb3940098 [2,0,0,0,0,0|0,0,2]=4 2140 B5R0.1 C=CCC(C)Br Amb26870150 [2,0,0,0,0,0|2,0,0]=4 2141 B5R0.1 C=CCC(C)C Amb8513260 [2,0,0,0,0,0|2,0,0]=4 2142 B5R0.1 C=CCC(C)Cl Amb26588784 [2,0,0,0,0,0|2,0,0]=4 2143 B5R0.1 C=CCC(C)N Amb17673480 [2,0,0,0,0,0|2,0,0]=4 2144 B5R0.1 C=CCC(C)N Amb19515336 [2,0,0,0,0,0|2,0,0]=4 2145 B5R0.1 C=CCC(C)O Amb33539328 [2,0,0,0,0,0|1,0,0]=3 2146 B5R0.1 C=CC[C@@H](C)O Amb22225370 [2,0,0,0,0,0|1,0,0]=3 2147 B5R0.1 C=CC[C@H](C)N Amb28315904 [2,0,0,0,0,0|2,0,0]=4 2148 B5R0.1 C=CC[C@H](C)O Amb22226758 [2,0,0,0,0,0|1,0,0]=3 2149 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 2150 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|2,0,0]=4 2151 B5R0.1 CC(=O)CCCl Amb2720823 [2,0,0,0,0,0|2,0,0]=4 2152 B5R0.1 CC(=O)CCF Amb26427773 [2,0,0,0,0,0|2,0,0]=4 2153 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|2,0,0]=4 2154 B5R0.1 CC(=O)CCN Amb33544540 [2,0,0,0,0,0|2,0,0]=4 2155 B5R0.1 CC(=O)CCO Amb836357 [2,0,0,0,0,0|1,0,0]=3 2156 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [2,0,0,0,0,0|2,0,0]=4 2157 B5R0.1 CC(=O)CNO Amb28049954 [2,0,0,0,0,0|2,0,0]=4 2158 B5R0.1 CC(=O)NCO Amb8516057 [2,0,0,0,0,0|2,0,0]=4 2159 B5R0.1 CC(=O)SCO Amb27255261 [2,0,0,0,0,0|2,0,0]=4 2160 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|1,0,0]=3 2161 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|1,0,1]=4 2162 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|2,0,0]=4 2163 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|2,0,0]=4 2164 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|2,0,0]=4 2165 B5R0.1 CC(Cl)CCO Amb27625144 [2,0,0,0,0,0|1,0,1]=4 2166 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,0]=3 2167 B5R0.1 CC(F)CCO Amb21951900 [2,0,0,0,0,0|1,0,1]=4 2168 B5R0.1 CC(N)CCO Amb2697504 [2,0,0,0,0,0|1,0,1]=4 2169 B5R0.1 CC(N)CCO Amb32666060 [2,0,0,0,0,0|1,0,1]=4 2170 B5R0.1 CC(O)CC#N Amb8516858 [2,0,0,0,0,0|1,0,1]=4 2171 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|0,0,0]=2 2172 B5R0.1 CC(O)CCBr Amb33548043 [2,0,0,0,0,0|1,0,1]=4 2173 B5R0.1 CC(O)CCCl Amb24551052 [2,0,0,0,0,0|1,0,1]=4 2174 B5R0.1 CC(O)CCF Amb26449397 [2,0,0,0,0,0|1,0,1]=4 2175 B5R0.1 CC(O)CCN Amb32666140 [2,0,0,0,0,0|1,0,1]=4 2176 B5R0.1 CC(O)CCN Amb33537908 [2,0,0,0,0,0|1,0,1]=4 2177 B5R0.1 CC(O)CCO Amb6608662 [2,0,0,0,0,0|0,0,1]=3 2178 B5R0.1 CC(O)CNN Amb33622274 [2,0,0,0,0,0|2,0,0]=4 2179 B5R0.1 CC(O)CNN Amb844968 [2,0,0,0,0,0|2,0,0]=4 2180 B5R0.1 CC(O)CON Amb21962618 [2,0,0,0,0,0|2,0,0]=4 2181 B5R0.1 CC(O)NC=O Amb28049622 [2,0,0,0,0,0|1,0,0]=3 2182 B5R0.1 CC(S)CCO Amb19148316 [2,0,0,0,0,0|0,1,1]=4 2183 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|1,0,1]=4 2184 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 2185 B5R0.1 CCCC(=N)N Amb2695914 [2,0,0,0,0,0|2,0,0]=4 2186 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 2187 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,0]=3 2188 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,0]=2 2189 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,1]=3 2190 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 2191 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,0]=3 2192 B5R0.1 CCCC(C)O Amb4605839 [2,0,0,0,0,0|1,0,1]=4 2193 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,0]=3 2194 B5R0.1 CCCC(N)=S Amb6245403 [2,0,0,0,0,0|1,1,0]=4 2195 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [2,0,0,0,0,0|2,0,0]=4 2196 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,0]=3 2197 B5R0.1 CCCC(O)Cl Amb22552567 [2,0,0,0,0,0|1,0,1]=4 2198 B5R0.1 CCCC(O)O Amb26364594 [2,0,0,0,0,0|0,0,2]=4 2199 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|2,0,0]=4 2200 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 2201 B5R0.1 CCCS(=O)[O-] Amb19929119 [2,0,0,0,0,0|1,0,1]=4 2202 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 2203 B5R0.1 CCC[C@@H](C)O Amb8628178 [2,0,0,0,0,0|1,0,1]=4 2204 B5R0.1 CCC[C@@H](N)O Amb28074861 [2,0,0,0,0,0|1,0,1]=4 2205 B5R0.1 CCC[C@H](C)O Amb8389338 [2,0,0,0,0,0|1,0,1]=4 2206 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [2,0,0,0,0,0|1,0,1]=4 2207 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 2208 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|2,0,0]=4 2209 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|2,0,0]=4 2210 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 2211 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,0]=3 2212 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|2,0,0]=4 2213 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 2214 B5R0.1 CCO[PH](=O)O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 2215 B5R0.1 CCO[Si](=O)O Amb26569259 [2,0,0,0,0,0|1,1,0]=4 2216 B5R0.1 CCSC(=O)Cl Amb8516064 [2,0,0,0,0,0|2,0,0]=4 2217 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|2,0,0]=4 2218 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|2,0,0]=4 2219 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|1,0,0]=3 2220 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|1,0,0]=3 2221 B5R0.1 CNCC(=O)[O-] Amb20246714 [2,0,0,0,0,0|1,0,1]=4 2222 B5R0.1 CNCC(C)=O Amb17621974 [2,0,0,0,0,0|2,0,0]=4 2223 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 2224 B5R0.1 CNCC(C)O Amb32666238 [2,0,0,0,0,0|2,0,0]=4 2225 B5R0.1 CNCC(C)O Amb9247471 [2,0,0,0,0,0|2,0,0]=4 2226 B5R0.1 CNCC(N)=O Amb19134307 [2,0,0,0,0,0|2,0,0]=4 2227 B5R0.1 CNCC(N)=O Amb3940074 [2,0,0,0,0,0|2,0,0]=4 2228 B5R0.1 CNCC(N)=O Amb9151172 [2,0,0,0,0,0|2,0,0]=4 2229 B5R0.1 CNC[C@@H](C)O Amb26972484 [2,0,0,0,0,0|2,0,0]=4 2230 B5R0.1 CNC[C@@H](C)O Amb32652763 [2,0,0,0,0,0|2,0,0]=4 2231 B5R0.1 CNC[C@H](C)O Amb27596614 [2,0,0,0,0,0|2,0,0]=4 2232 B5R0.1 CNC[C@H](C)O Amb32652861 [2,0,0,0,0,0|2,0,0]=4 2233 B5R0.1 COCC(=O)Cl Amb3939326 [2,0,0,0,0,0|2,0,0]=4 2234 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,0]=3 2235 B5R0.1 COCC(C)=O Amb8513767 [2,0,0,0,0,0|2,0,0]=4 2236 B5R0.1 COCC(C)O Amb33544397 [2,0,0,0,0,0|2,0,0]=4 2237 B5R0.1 COCC(N)=O Amb1153776 [2,0,0,0,0,0|2,0,0]=4 2238 B5R0.1 COC[C@@H](C)O Amb8383545 [2,0,0,0,0,0|2,0,0]=4 2239 B5R0.1 COC[C@H](C)O Amb8515770 [2,0,0,0,0,0|2,0,0]=4 2240 B5R0.1 CS(=O)CCO Amb28075364 [2,0,0,0,0,0|2,0,0]=4 2241 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 2242 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 2243 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 2244 B5R0.1 CSCC(C)O Amb20622311 [2,0,0,0,0,0|2,0,0]=4 2245 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 2246 B5R0.1 CSC[C@@H](C)O Amb24408899 [2,0,0,0,0,0|2,0,0]=4 2247 B5R0.1 CSC[C@H](C)O Amb24699036 [2,0,0,0,0,0|2,0,0]=4 2248 B5R0.1 C[C@@H](N)CCO Amb19515999 [2,0,0,0,0,0|1,0,1]=4 2249 B5R0.1 C[C@@H](N)CCO Amb22746127 [2,0,0,0,0,0|1,0,1]=4 2250 B5R0.1 C[C@@H](O)CC#N Amb22224888 [2,0,0,0,0,0|1,0,1]=4 2251 B5R0.1 C[C@@H](O)CCBr Amb27392288 [2,0,0,0,0,0|1,0,1]=4 2252 B5R0.1 C[C@@H](O)CCF Amb33376906 [2,0,0,0,0,0|1,0,1]=4 2253 B5R0.1 C[C@@H](O)CCI Amb27594639 [2,0,0,0,0,0|1,0,1]=4 2254 B5R0.1 C[C@@H](O)CCN Amb22736702 [2,0,0,0,0,0|1,0,1]=4 2255 B5R0.1 C[C@@H](O)CCN Amb28555327 [2,0,0,0,0,0|1,0,1]=4 2256 B5R0.1 C[C@@H](O)CCO Amb4166294 [2,0,0,0,0,0|0,0,1]=3 2257 B5R0.1 C[C@@H](O)CON Amb26019757 [2,0,0,0,0,0|2,0,0]=4 2258 B5R0.1 C[C@@H](S)CCO Amb27255216 [2,0,0,0,0,0|0,1,1]=4 2259 B5R0.1 C[C@H](F)CCO Amb28428651 [2,0,0,0,0,0|1,0,1]=4 2260 B5R0.1 C[C@H](N)CCO Amb19515998 [2,0,0,0,0,0|1,0,1]=4 2261 B5R0.1 C[C@H](N)CCO Amb24055217 [2,0,0,0,0,0|1,0,1]=4 2262 B5R0.1 C[C@H](O)CC#N Amb22736701 [2,0,0,0,0,0|1,0,1]=4 2263 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|0,0,0]=2 2264 B5R0.1 C[C@H](O)CCBr Amb28367228 [2,0,0,0,0,0|1,0,1]=4 2265 B5R0.1 C[C@H](O)CCF Amb33376900 [2,0,0,0,0,0|1,0,1]=4 2266 B5R0.1 C[C@H](O)CCN Amb22736705 [2,0,0,0,0,0|1,0,1]=4 2267 B5R0.1 C[C@H](O)CCN Amb34159890 [2,0,0,0,0,0|1,0,1]=4 2268 B5R0.1 C[C@H](O)CCO Amb4166300 [2,0,0,0,0,0|0,0,1]=3 2269 B5R0.1 C[C@H](O)CNN Amb27589718 [2,0,0,0,0,0|2,0,0]=4 2270 B5R0.1 C[C@H](O)CON Amb24557560 [2,0,0,0,0,0|2,0,0]=4 2271 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [2,0,0,0,0,0|2,0,0]=4 2272 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,2]=4 2273 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,2]=4 2274 B5R0.1 C\C=C\C(C)O Amb2721243 [2,0,0,0,0,0|1,0,1]=4 2275 B5R0.1 N#CCC(=O)O Amb2609022 [2,0,0,0,0,0|1,0,1]=4 2276 B5R0.1 N=C(N)CCO Amb2696134 [2,0,0,0,0,0|2,0,0]=4 2277 B5R0.1 N=C(N)CCO Amb8630168 [2,0,0,0,0,0|2,0,0]=4 2278 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 2279 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 2280 B5R0.1 NC(=O)CCF Amb28289353 [2,0,0,0,0,0|2,0,0]=4 2281 B5R0.1 NC(=O)CCI Amb27966778 [2,0,0,0,0,0|2,0,0]=4 2282 B5R0.1 NC(=O)CCO Amb9421407 [2,0,0,0,0,0|1,0,0]=3 2283 B5R0.1 NC(=O)CCS Amb27154802 [2,0,0,0,0,0|1,1,0]=4 2284 B5R0.1 NC(=O)NCO Amb17674341 [2,0,0,0,0,0|2,0,0]=4 2285 B5R0.1 NC(=S)CCO Amb8855295 [2,0,0,0,0,0|1,1,0]=4 2286 B5R0.1 NC(O)CCO Amb28252327 [2,0,0,0,0,0|1,0,1]=4 2287 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 2288 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,0]=3 2289 B5R0.1 NCCC(=O)[O-] Amb28991330 [2,0,0,0,0,0|1,0,1]=4 2290 B5R0.1 NCCC(N)=O Amb1137251 [2,0,0,0,0,0|2,0,0]=4 2291 B5R0.1 NCCC(N)=O Amb9147573 [2,0,0,0,0,0|2,0,0]=4 2292 B5R0.1 NCCS(=O)O Amb6600043 [2,0,0,0,0,0|2,0,0]=4 2293 B5R0.1 NCC[PH](=O)O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 2294 B5R0.1 NCC[PH](=O)O Amb35788864 [2,0,0,0,0,0|2,0,0]=4 2295 B5R0.1 NNCC(=O)O Amb32751165 [2,0,0,0,0,0|2,0,0]=4 2296 B5R0.1 NNCC(=O)O Amb6740299 [2,0,0,0,0,0|2,0,0]=4 2297 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 2298 B5R0.1 NOCC(=O)O Amb4324355 [2,0,0,0,0,0|2,0,0]=4 2299 B5R0.1 NOCC(=O)O Amb8513076 [2,0,0,0,0,0|2,0,0]=4 2300 B5R0.1 NS(=O)CCO Amb32720357 [2,0,0,0,0,0|2,0,0]=4 2301 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 2302 B5R0.1 O=C(Cl)CCBr Amb3941484 [2,0,0,0,0,0|2,0,0]=4 2303 B5R0.1 O=C(Cl)CCCl Amb3939313 [2,0,0,0,0,0|2,0,0]=4 2304 B5R0.1 O=C(Cl)CCF Amb27148631 [2,0,0,0,0,0|2,0,0]=4 2305 B5R0.1 O=C(Cl)CCI Amb28454579 [2,0,0,0,0,0|2,0,0]=4 2306 B5R0.1 O=C(Cl)CCO Amb27270014 [2,0,0,0,0,0|1,0,0]=3 2307 B5R0.1 O=C(F)CCCl Amb27257545 [2,0,0,0,0,0|2,0,0]=4 2308 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,0]=3 2309 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,0]=3 2310 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,0]=3 2311 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,0]=3 2312 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|0,0,0]=2 2313 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|0,1,0]=3 2314 B5R0.1 O=C(O)CNO Amb24120360 [2,0,0,0,0,0|1,0,0]=3 2315 B5R0.1 O=C(O)\C=C\O Amb26055842 [2,0,0,0,0,0|0,0,2]=4 2316 B5R0.1 O=C(O)\C=N\O Amb20671938 [2,0,0,0,0,0|1,0,1]=4 2317 B5R0.1 O=C(S)CCCl Amb27461454 [2,0,0,0,0,0|1,1,0]=4 2318 B5R0.1 O=C([O-])CCO Amb22055495 [2,0,0,0,0,0|0,0,1]=3 2319 B5R0.1 O=CCB(O)O Amb27449470 [2,0,0,0,0,0|2,0,0]=4 2320 B5R0.1 O=CCC(=O)O Amb22169407 [2,0,0,0,0,0|0,0,2]=4 2321 B5R0.1 O=CCC(Cl)Cl Amb27749867 [2,0,0,0,0,0|2,0,0]=4 2322 B5R0.1 O=CCC(F)F Amb27234494 [2,0,0,0,0,0|2,0,0]=4 2323 B5R0.1 O=S(Cl)CCO Amb32720404 [2,0,0,0,0,0|2,0,0]=4 2324 B5R0.1 O=S(O)CCO Amb25937057 [2,0,0,0,0,0|1,0,0]=3 2325 B5R0.1 O=S([O-])CCO Amb32754124 [2,0,0,0,0,0|1,0,1]=4 2326 B5R0.1 O=[N+]([O-])CCO Amb3940447 [2,0,0,0,0,0|1,0,1]=4 2327 B5R0.1 OCCC(O)Cl Amb26052481 [2,0,0,0,0,0|1,0,1]=4 2328 B5R0.3 C#CC(N)CC Amb26316205 [2,0,0,0,0,0|1,0,1]=4 2329 B5R0.3 C#CC(N)CC Amb33164073 [2,0,0,0,0,0|1,0,1]=4 2330 B5R0.3 C#CC(N)CO Amb26985041 [2,0,0,0,0,0|1,0,1]=4 2331 B5R0.3 C#CC(N)CO Amb33551336 [2,0,0,0,0,0|1,0,1]=4 2332 B5R0.3 C#C[C@@H](N)CC Amb27837716 [2,0,0,0,0,0|1,0,1]=4 2333 B5R0.3 C#C[C@H](N)CO Amb28345581 [2,0,0,0,0,0|1,0,1]=4 2334 B5R0.3 C=C(C=O)CC Amb17940102 [2,0,0,0,0,0|1,0,1]=4 2335 B5R0.3 C=CC(Br)CO Amb25888060 [2,0,0,0,0,0|2,0,0]=4 2336 B5R0.3 C=CC(C)CC Amb8513436 [2,0,0,0,0,0|2,0,0]=4 2337 B5R0.3 C=CC(C)CO Amb22347861 [2,0,0,0,0,0|2,0,0]=4 2338 B5R0.3 C=CC(Cl)CO Amb26946125 [2,0,0,0,0,0|2,0,0]=4 2339 B5R0.3 C=CC(I)CO Amb28291610 [2,0,0,0,0,0|2,0,0]=4 2340 B5R0.3 C=CC(N)CC Amb26349978 [2,0,0,0,0,0|1,0,0]=3 2341 B5R0.3 C=CC(N)CC Amb31291608 [2,0,0,0,0,0|1,0,0]=3 2342 B5R0.3 C=CC(N)CF Amb27593895 [2,0,0,0,0,0|2,0,0]=4 2343 B5R0.3 C=CC(N)CO Amb19374935 [2,0,0,0,0,0|1,0,0]=3 2344 B5R0.3 C=CC(N)CO Amb28555332 [2,0,0,0,0,0|1,0,0]=3 2345 B5R0.3 C=CC(N)CS Amb18120558 [2,0,0,0,0,0|1,1,0]=4 2346 B5R0.3 C=CC(O)CC Amb3940382 [2,0,0,0,0,0|2,0,0]=4 2347 B5R0.3 C=CC(O)CO Amb17610151 [2,0,0,0,0,0|2,0,0]=4 2348 B5R0.3 C=CC(S)CO Amb27960052 [2,0,0,0,0,0|2,0,0]=4 2349 B5R0.3 C=C[C@@H](N)CO Amb19886656 [2,0,0,0,0,0|1,0,0]=3 2350 B5R0.3 C=C[C@@H](N)CO Amb27247092 [2,0,0,0,0,0|1,0,0]=3 2351 B5R0.3 C=C[C@@H](O)CC Amb27813799 [2,0,0,0,0,0|2,0,0]=4 2352 B5R0.3 C=C[C@H](C)CO Amb27470174 [2,0,0,0,0,0|2,0,0]=4 2353 B5R0.3 C=C[C@H](N)CO Amb25147462 [2,0,0,0,0,0|1,0,0]=3 2354 B5R0.3 C=C[C@H](N)CO Amb8631419 [2,0,0,0,0,0|1,0,0]=3 2355 B5R0.3 C=C[C@H](O)CO Amb19888350 [2,0,0,0,0,0|2,0,0]=4 2356 B5R0.3 CC(C=O)CF Amb24638421 [2,0,0,0,0,0|2,0,0]=4 2357 B5R0.3 CC(CO)CO Amb9788669 [2,0,0,0,0,0|1,0,1]=4 2358 B5R0.3 CC(CO)N=O Amb28365917 [2,0,0,0,0,0|2,0,0]=4 2359 B5R0.3 CC(CO)NO Amb27471121 [2,0,0,0,0,0|2,0,0]=4 2360 B5R0.3 CCC(=O)C=O Amb22228532 [2,0,0,0,0,0|1,0,1]=4 2361 B5R0.3 CCC(Br)C=O Amb18124003 [2,0,0,0,0,0|1,0,0]=3 2362 B5R0.3 CCC(Br)CO Amb27637663 [2,0,0,0,0,0|1,0,1]=4 2363 B5R0.3 CCC(C)C=O Amb3939899 [2,0,0,0,0,0|1,0,0]=3 2364 B5R0.3 CCC(C)CO Amb3939046 [2,0,0,0,0,0|1,0,1]=4 2365 B5R0.3 CCC(Cl)C=O Amb18122610 [2,0,0,0,0,0|1,0,0]=3 2366 B5R0.3 CCC(Cl)CO Amb22011826 [2,0,0,0,0,0|1,0,1]=4 2367 B5R0.3 CCC(F)CO Amb27454301 [2,0,0,0,0,0|1,0,1]=4 2368 B5R0.3 CCC(N)C#N Amb10203825 [2,0,0,0,0,0|1,0,1]=4 2369 B5R0.3 CCC(N)C#N Amb1136995 [2,0,0,0,0,0|1,0,1]=4 2370 B5R0.3 CCC(N)CBr Amb26491532 [2,0,0,0,0,0|1,0,1]=4 2371 B5R0.3 CCC(N)CC Amb3939864 [2,0,0,0,0,0|1,0,1]=4 2372 B5R0.3 CCC(N)CCl Amb28313277 [2,0,0,0,0,0|1,0,1]=4 2373 B5R0.3 CCC(N)CF Amb26601671 [2,0,0,0,0,0|1,0,1]=4 2374 B5R0.3 CCC(N)CF Amb32652398 [2,0,0,0,0,0|1,0,1]=4 2375 B5R0.3 CCC(N)CN Amb33534078 [2,0,0,0,0,0|1,0,1]=4 2376 B5R0.3 CCC(N)CN Amb9380664 [2,0,0,0,0,0|1,0,1]=4 2377 B5R0.3 CCC(N)CO Amb9703106 [2,0,0,0,0,0|0,0,1]=3 2378 B5R0.3 CCC(N)CS Amb18122513 [2,0,0,0,0,0|0,1,1]=4 2379 B5R0.3 CCC(N)CS Amb32693424 [2,0,0,0,0,0|0,1,1]=4 2380 B5R0.3 CCC(N)[SH]=O Amb28241197 [2,0,0,0,0,0|1,0,0]=3 2381 B5R0.3 CCC(O)CO Amb8517157 [2,0,0,0,0,0|1,0,1]=4 2382 B5R0.3 CCC(S)CO Amb27211706 [2,0,0,0,0,0|1,0,1]=4 2383 B5R0.3 CCN(C)C=O Amb20627285 [2,0,0,0,0,0|2,0,0]=4 2384 B5R0.3 CCN(N)C=O Amb24428031 [2,0,0,0,0,0|1,0,0]=3 2385 B5R0.3 CC[C@@H](Br)CO Amb27863418 [2,0,0,0,0,0|1,0,1]=4 2386 B5R0.3 CC[C@@H](C)C=O Amb27759282 [2,0,0,0,0,0|1,0,0]=3 2387 B5R0.3 CC[C@@H](C)CO Amb22799907 [2,0,0,0,0,0|1,0,1]=4 2388 B5R0.3 CC[C@@H](N)C#N Amb25024729 [2,0,0,0,0,0|1,0,1]=4 2389 B5R0.3 CC[C@@H](N)C#N Amb27949151 [2,0,0,0,0,0|1,0,1]=4 2390 B5R0.3 CC[C@@H](N)CF Amb33624248 [2,0,0,0,0,0|1,0,1]=4 2391 B5R0.3 CC[C@@H](N)CO Amb3940043 [2,0,0,0,0,0|0,0,1]=3 2392 B5R0.3 CC[C@@H](O)CO Amb20241381 [2,0,0,0,0,0|1,0,1]=4 2393 B5R0.3 CC[C@H](C)C=O Amb27837733 [2,0,0,0,0,0|1,0,0]=3 2394 B5R0.3 CC[C@H](C)CO Amb10844611 [2,0,0,0,0,0|1,0,1]=4 2395 B5R0.3 CC[C@H](N)C#N Amb25887559 [2,0,0,0,0,0|1,0,1]=4 2396 B5R0.3 CC[C@H](N)C#N Amb26415160 [2,0,0,0,0,0|1,0,1]=4 2397 B5R0.3 CC[C@H](N)C=O Amb27460588 [2,0,0,0,0,0|0,0,0]=2 2398 B5R0.3 CC[C@H](N)CO Amb3939341 [2,0,0,0,0,0|0,0,1]=3 2399 B5R0.3 CC[C@H](O)CO Amb20241380 [2,0,0,0,0,0|1,0,1]=4 2400 B5R0.3 CC\C(N)=N/O Amb10609125 [2,0,0,0,0,0|1,0,1]=4 2401 B5R0.3 CC\C(N)=N\O Amb1125701 [2,0,0,0,0,0|1,0,1]=4 2402 B5R0.3 CC\C(N)=N\O Amb19883708 [2,0,0,0,0,0|1,0,1]=4 2403 B5R0.3 CN(C=O)CO Amb27253133 [2,0,0,0,0,0|2,0,0]=4 2404 B5R0.3 COC(C)C=O Amb27875195 [2,0,0,0,0,0|2,0,0]=4 2405 B5R0.3 CO[C@@H](C)C=O Amb28121215 [2,0,0,0,0,0|2,0,0]=4 2406 B5R0.3 CO[C@H](C)C=O Amb28284155 [2,0,0,0,0,0|2,0,0]=4 2407 B5R0.3 CSC(C)C=O Amb27454927 [2,0,0,0,0,0|2,0,0]=4 2408 B5R0.3 CSC(Cl)C=O Amb27233402 [2,0,0,0,0,0|2,0,0]=4 2409 B5R0.3 C[C@@H](C=O)CBr Amb28200669 [2,0,0,0,0,0|2,0,0]=4 2410 B5R0.3 C[C@@H](C=O)CO Amb27455063 [2,0,0,0,0,0|1,0,0]=3 2411 B5R0.3 N#CC(N)CO Amb19372799 [2,0,0,0,0,0|1,0,1]=4 2412 B5R0.3 N#CC(N)CO Amb28555331 [2,0,0,0,0,0|1,0,1]=4 2413 B5R0.3 N#C[C@H](N)CO Amb28399707 [2,0,0,0,0,0|1,0,1]=4 2414 B5R0.3 NC(C=O)C=O Amb22751007 [2,0,0,0,0,0|0,0,2]=4 2415 B5R0.3 NC(C=O)CS Amb27626007 [2,0,0,0,0,0|0,1,0]=3 2416 B5R0.3 NC(CO)CF Amb20622637 [2,0,0,0,0,0|1,0,1]=4 2417 B5R0.3 NC(CO)CF Amb25734803 [2,0,0,0,0,0|1,0,1]=4 2418 B5R0.3 NC(CO)CO Amb3939868 [2,0,0,0,0,0|0,0,1]=3 2419 B5R0.3 NC(CO)CO Amb8396812 [2,0,0,0,0,0|0,0,1]=3 2420 B5R0.3 NCC(N)CO Amb24117147 [2,0,0,0,0,0|1,0,1]=4 2421 B5R0.3 NCC(N)CO Amb33292549 [2,0,0,0,0,0|1,0,1]=4 2422 B5R0.3 NC[C@@H](N)CO Amb19374894 [2,0,0,0,0,0|1,0,1]=4 2423 B5R0.3 NC[C@@H](N)CO Amb32990166 [2,0,0,0,0,0|1,0,1]=4 2424 B5R0.3 NC[C@H](F)C=O Amb27204919 [2,0,0,0,0,0|2,0,0]=4 2425 B5R0.3 NC[C@H](N)CO Amb26390006 [2,0,0,0,0,0|1,0,1]=4 2426 B5R0.3 NC[C@H](N)CO Amb32789590 [2,0,0,0,0,0|1,0,1]=4 2427 B5R0.3 N[C@@H](CO)CF Amb33376913 [2,0,0,0,0,0|1,0,1]=4 2428 B5R0.3 N[C@H](C=O)CO Amb27170308 [2,0,0,0,0,0|0,0,0]=2 2429 B5R0.3 N[C@H](CO)CF Amb33376914 [2,0,0,0,0,0|1,0,1]=4 2430 B5R0.3 N[C@H](CO)CF Amb33620306 [2,0,0,0,0,0|1,0,1]=4 2431 B5R0.3 N\C(C=O)=C/O Amb28315747 [2,0,0,0,0,0|0,0,2]=4 2432 B5R0.3 N\C(CO)=N\O Amb2695931 [2,0,0,0,0,0|1,0,1]=4 2433 B5R0.3 O=CC(=O)CO Amb17593031 [2,0,0,0,0,0|1,0,1]=4 2434 B5R0.3 O=CC(Br)CBr Amb17670591 [2,0,0,0,0,0|2,0,0]=4 2435 B5R0.3 O=CC(Br)CCl Amb18647566 [2,0,0,0,0,0|2,0,0]=4 2436 B5R0.3 O=CC(Cl)CO Amb17593122 [2,0,0,0,0,0|1,0,0]=3 2437 B5R0.3 O=CC(F)CF Amb28051572 [2,0,0,0,0,0|2,0,0]=4 2438 B5R0.3 O=CC(F)CO Amb28043006 [2,0,0,0,0,0|1,0,0]=3 2439 B5R0.3 O=CC(O)CO Amb3940759 [2,0,0,0,0,0|1,0,0]=3 2440 B5R0.3 O=CC(S)CO Amb4020723 [2,0,0,0,0,0|1,0,0]=3 2441 B5R0.3 O=C[C@@H](O)CF Amb28247090 [2,0,0,0,0,0|2,0,0]=4 2442 B5R0.3 O=C[C@@H](O)CO Amb16232009 [2,0,0,0,0,0|1,0,0]=3 2443 B5R0.3 O=C[C@H](O)CO Amb20242417 [2,0,0,0,0,0|1,0,0]=3 2444 B5R0.3 O=NC(Cl)CO Amb27232983 [2,0,0,0,0,0|2,0,0]=4 2445 B5R0.3 OCC(Cl)CO Amb17611073 [2,0,0,0,0,0|1,0,1]=4 2446 B5R0.3 OCC(F)CO Amb25918777 [2,0,0,0,0,0|1,0,1]=4 2447 B5R0.3 OCC(O)CO Amb33719574 [2,0,0,0,0,0|1,0,1]=4 2448 B5R0.3 OCC(O)CO Amb6608790 [2,0,0,0,0,0|1,0,1]=4 2449 B5R0.3 OCC(S)CO Amb28321614 [2,0,0,0,0,0|1,0,1]=4 2450 B5R0.5 C=C(C)C(=O)O Amb6608998 [2,0,0,0,0,0|1,0,1]=4 2451 B5R0.5 C=C(C)C(C)O Amb28282626 [2,0,0,0,0,0|1,0,1]=4 2452 B5R0.5 C=C(C)[C@@H](C)N Amb33199904 [2,0,0,0,0,0|2,0,0]=4 2453 B5R0.5 C=C(C)[C@@H](C)O Amb25834912 [2,0,0,0,0,0|1,0,1]=4 2454 B5R0.5 C=C(C)[C@H](C)N Amb33199903 [2,0,0,0,0,0|2,0,0]=4 2455 B5R0.5 C=C(C)[C@H](C)O Amb25294556 [2,0,0,0,0,0|1,0,1]=4 2456 B5R0.5 CC(=O)C(=O)O Amb932807 [2,0,0,0,0,0|1,0,1]=4 2457 B5R0.5 CC(=O)C(C)Br Amb8384405 [2,0,0,0,0,0|2,0,0]=4 2458 B5R0.5 CC(=O)C(C)C Amb4605987 [2,0,0,0,0,0|2,0,0]=4 2459 B5R0.5 CC(=O)C(C)Cl Amb9702838 [2,0,0,0,0,0|2,0,0]=4 2460 B5R0.5 CC(=O)C(C)F Amb10841897 [2,0,0,0,0,0|2,0,0]=4 2461 B5R0.5 CC(=O)C(C)I Amb28315734 [2,0,0,0,0,0|2,0,0]=4 2462 B5R0.5 CC(=O)C(C)N Amb17593029 [2,0,0,0,0,0|1,0,0]=3 2463 B5R0.5 CC(=O)C(C)N Amb19148817 [2,0,0,0,0,0|1,0,0]=3 2464 B5R0.5 CC(=O)C(C)O Amb6608962 [2,0,0,0,0,0|1,0,1]=4 2465 B5R0.5 CC(=O)C(C)S Amb8393169 [2,0,0,0,0,0|2,0,0]=4 2466 B5R0.5 CC(=O)C(O)O Amb22436762 [2,0,0,0,0,0|2,0,0]=4 2467 B5R0.5 CC(=O)N(C)N Amb17593037 [2,0,0,0,0,0|2,0,0]=4 2468 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [2,0,0,0,0,0|1,0,0]=3 2469 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [2,0,0,0,0,0|1,0,0]=3 2470 B5R0.5 CC(=S)C(=O)O Amb27424126 [2,0,0,0,0,0|1,0,1]=4 2471 B5R0.5 CC(Br)C(=O)Br Amb7969424 [2,0,0,0,0,0|2,0,0]=4 2472 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [2,0,0,0,0,0|2,0,0]=4 2473 B5R0.5 CC(Br)C(=O)O Amb2795764 [2,0,0,0,0,0|1,0,0]=3 2474 B5R0.5 CC(Br)C(N)=O Amb2779903 [2,0,0,0,0,0|1,0,1]=4 2475 B5R0.5 CC(C)C(=O)Br Amb22731066 [2,0,0,0,0,0|2,0,0]=4 2476 B5R0.5 CC(C)C(=O)Cl Amb3939052 [2,0,0,0,0,0|2,0,0]=4 2477 B5R0.5 CC(C)C(=O)F Amb25848493 [2,0,0,0,0,0|2,0,0]=4 2478 B5R0.5 CC(C)C(=O)I Amb26992316 [2,0,0,0,0,0|2,0,0]=4 2479 B5R0.5 CC(C)C(=O)O Amb3939822 [2,0,0,0,0,0|1,0,0]=3 2480 B5R0.5 CC(C)C(=O)S Amb33482574 [2,0,0,0,0,0|1,1,0]=4 2481 B5R0.5 CC(C)C(C)N Amb3939835 [2,0,0,0,0,0|1,0,1]=4 2482 B5R0.5 CC(C)C(C)O Amb9748261 [2,0,0,0,0,0|1,0,1]=4 2483 B5R0.5 CC(C)C(N)=O Amb1153145 [2,0,0,0,0,0|1,0,1]=4 2484 B5R0.5 CC(C)N(=O)O Amb33789630 [2,0,0,0,0,0|2,0,0]=4 2485 B5R0.5 CC(C)S(=O)O Amb27245066 [2,0,0,0,0,0|2,0,0]=4 2486 B5R0.5 CC(C)S(N)=O Amb25675545 [2,0,0,0,0,0|2,0,0]=4 2487 B5R0.5 CC(C)[C@@H](C)N Amb10844612 [2,0,0,0,0,0|1,0,1]=4 2488 B5R0.5 CC(C)[C@@H](C)N Amb30628646 [2,0,0,0,0,0|1,0,1]=4 2489 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [2,0,0,0,0,0|1,0,1]=4 2490 B5R0.5 CC(C)[C@H](C)N Amb3939620 [2,0,0,0,0,0|1,0,1]=4 2491 B5R0.5 CC(C)[C@H](C)O Amb6366846 [2,0,0,0,0,0|1,0,1]=4 2492 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [2,0,0,0,0,0|2,0,0]=4 2493 B5R0.5 CC(Cl)C(=O)F Amb27863699 [2,0,0,0,0,0|2,0,0]=4 2494 B5R0.5 CC(Cl)C(=O)O Amb3940363 [2,0,0,0,0,0|1,0,0]=3 2495 B5R0.5 CC(Cl)C(N)=O Amb9745753 [2,0,0,0,0,0|1,0,1]=4 2496 B5R0.5 CC(Cl)C(O)Cl Amb28239766 [2,0,0,0,0,0|2,0,0]=4 2497 B5R0.5 CC(Cl)S(=O)O Amb27983761 [2,0,0,0,0,0|2,0,0]=4 2498 B5R0.5 CC(Cl)S(N)=O Amb32720330 [2,0,0,0,0,0|2,0,0]=4 2499 B5R0.5 CC(F)C(=O)O Amb10605770 [2,0,0,0,0,0|1,0,0]=3 2500 B5R0.5 CC(F)C(N)=O Amb28248497 [2,0,0,0,0,0|1,0,1]=4 2501 B5R0.5 CC(I)C(=O)O Amb26450528 [2,0,0,0,0,0|1,0,0]=3 2502 B5R0.5 CC(I)C(N)=O Amb25684673 [2,0,0,0,0,0|1,0,1]=4 2503 B5R0.5 CC(N)B(O)O Amb25844423 [2,0,0,0,0,0|1,0,1]=4 2504 B5R0.5 CC(N)C(=O)O Amb32724352 [2,0,0,0,0,0|0,0,0]=2 2505 B5R0.5 CC(N)C(=O)O Amb5716847 [2,0,0,0,0,0|0,0,0]=2 2506 B5R0.5 CC(N)C(=O)S Amb27175379 [2,0,0,0,0,0|0,1,0]=3 2507 B5R0.5 CC(N)C(C)Br Amb24474359 [2,0,0,0,0,0|1,0,1]=4 2508 B5R0.5 CC(N)C(C)Br Amb32667597 [2,0,0,0,0,0|1,0,1]=4 2509 B5R0.5 CC(N)C(C)F Amb28434496 [2,0,0,0,0,0|1,0,1]=4 2510 B5R0.5 CC(N)C(C)N Amb22330596 [2,0,0,0,0,0|1,0,1]=4 2511 B5R0.5 CC(N)C(C)N Amb33473133 [2,0,0,0,0,0|1,0,1]=4 2512 B5R0.5 CC(N)C(C)O Amb33801453 [2,0,0,0,0,0|0,0,1]=3 2513 B5R0.5 CC(N)C(C)O Amb8630303 [2,0,0,0,0,0|0,0,1]=3 2514 B5R0.5 CC(N)C(C)S Amb27447203 [2,0,0,0,0,0|0,1,1]=4 2515 B5R0.5 CC(N)C(N)=O Amb21958673 [2,0,0,0,0,0|1,0,0]=3 2516 B5R0.5 CC(N)C(N)=O Amb33532935 [2,0,0,0,0,0|1,0,0]=3 2517 B5R0.5 CC(N)C(N)=S Amb19374914 [2,0,0,0,0,0|1,1,0]=4 2518 B5R0.5 CC(N)C(N)=S Amb33527239 [2,0,0,0,0,0|1,1,0]=4 2519 B5R0.5 CC(O)C(=N)N Amb22587521 [2,0,0,0,0,0|1,0,1]=4 2520 B5R0.5 CC(O)C(=N)N Amb2696133 [2,0,0,0,0,0|1,0,1]=4 2521 B5R0.5 CC(O)C(=O)O Amb9703100 [2,0,0,0,0,0|1,0,0]=3 2522 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [2,0,0,0,0,0|1,0,1]=4 2523 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [2,0,0,0,0,0|1,0,1]=4 2524 B5R0.5 CC(O)C(C)Br Amb17593818 [2,0,0,0,0,0|1,0,1]=4 2525 B5R0.5 CC(O)C(C)Cl Amb4036583 [2,0,0,0,0,0|1,0,1]=4 2526 B5R0.5 CC(O)C(C)O Amb8515777 [2,0,0,0,0,0|1,0,0]=3 2527 B5R0.5 CC(O)C(C)S Amb8393167 [2,0,0,0,0,0|1,0,1]=4 2528 B5R0.5 CC(O)C(F)F Amb24428187 [2,0,0,0,0,0|2,0,0]=4 2529 B5R0.5 CC(O)C(N)=O Amb6394657 [2,0,0,0,0,0|0,0,1]=3 2530 B5R0.5 CC(O)C(N)O Amb28341329 [2,0,0,0,0,0|0,0,0]=2 2531 B5R0.5 CC(O)C(O)[SiH3] Amb27219045 [2,0,0,0,0,0|1,0,0]=3 2532 B5R0.5 CC(O)[C@@H](C)N Amb30010753 [2,0,0,0,0,0|0,0,1]=3 2533 B5R0.5 CC(O)[C@H](C)N Amb35713820 [2,0,0,0,0,0|0,0,1]=3 2534 B5R0.5 CC(S)C(=O)O Amb6608753 [2,0,0,0,0,0|1,0,0]=3 2535 B5R0.5 CN(C)C(=O)O Amb22348477 [2,0,0,0,0,0|2,0,0]=4 2536 B5R0.5 CN(N)C(N)=O Amb27167382 [2,0,0,0,0,0|2,0,0]=4 2537 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [2,0,0,0,0,0|2,0,0]=4 2538 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [2,0,0,0,0,0|2,0,0]=4 2539 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [2,0,0,0,0,0|1,0,0]=3 2540 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [2,0,0,0,0,0|2,0,0]=4 2541 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [2,0,0,0,0,0|1,0,0]=3 2542 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [2,0,0,0,0,0|1,0,0]=3 2543 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [2,0,0,0,0,0|1,0,1]=4 2544 B5R0.5 C[C@@H](N)B(O)O Amb27662188 [2,0,0,0,0,0|1,0,1]=4 2545 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [2,0,0,0,0,0|0,0,0]=2 2546 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [2,0,0,0,0,0|1,0,0]=3 2547 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [2,0,0,0,0,0|1,0,0]=3 2548 B5R0.5 C[C@@H](N)[C@@H](C)N Amb22800310 [2,0,0,0,0,0|1,0,1]=4 2549 B5R0.5 C[C@@H](N)[C@@H](C)O Amb26068187 [2,0,0,0,0,0|0,0,1]=3 2550 B5R0.5 C[C@@H](O)C(=N)N Amb22587056 [2,0,0,0,0,0|1,0,1]=4 2551 B5R0.5 C[C@@H](O)C(=N)N Amb8630521 [2,0,0,0,0,0|1,0,1]=4 2552 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [2,0,0,0,0,0|1,0,1]=4 2553 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [2,0,0,0,0,0|1,0,0]=3 2554 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [2,0,0,0,0,0|1,0,1]=4 2555 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [2,0,0,0,0,0|1,0,1]=4 2556 B5R0.5 C[C@@H](O)C(F)F Amb33337781 [2,0,0,0,0,0|2,0,0]=4 2557 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [2,0,0,0,0,0|0,0,1]=3 2558 B5R0.5 C[C@@H](O)[C@@H](C)Br Amb28144209 [2,0,0,0,0,0|1,0,1]=4 2559 B5R0.5 C[C@@H](O)[C@@H](C)O Amb8514566 [2,0,0,0,0,0|1,0,0]=3 2560 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [2,0,0,0,0,0|1,0,0]=3 2561 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [2,0,0,0,0,0|2,0,0]=4 2562 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [2,0,0,0,0,0|2,0,0]=4 2563 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [2,0,0,0,0,0|1,0,0]=3 2564 B5R0.5 C[C@H](Cl)[C@@H](C)N Amb28401487 [2,0,0,0,0,0|1,0,1]=4 2565 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [2,0,0,0,0,0|1,0,0]=3 2566 B5R0.5 C[C@H](F)[C@@H](C)O Amb27256100 [2,0,0,0,0,0|1,0,1]=4 2567 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [2,0,0,0,0,0|0,0,0]=2 2568 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [2,0,0,0,0,0|0,0,0]=2 2569 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [2,0,0,0,0,0|0,1,0]=3 2570 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [2,0,0,0,0,0|1,0,0]=3 2571 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [2,0,0,0,0,0|1,0,0]=3 2572 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [2,0,0,0,0,0|1,0,0]=3 2573 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [2,0,0,0,0,0|1,0,0]=3 2574 B5R0.5 C[C@H](N)[C@@H](C)Br Amb27774580 [2,0,0,0,0,0|1,0,1]=4 2575 B5R0.5 C[C@H](N)[C@H](C)O Amb28126703 [2,0,0,0,0,0|0,0,1]=3 2576 B5R0.5 C[C@H](N)[C@H](C)O Amb35789596 [2,0,0,0,0,0|0,0,1]=3 2577 B5R0.5 C[C@H](O)C(=N)N Amb22587541 [2,0,0,0,0,0|1,0,1]=4 2578 B5R0.5 C[C@H](O)C(=N)N Amb34912477 [2,0,0,0,0,0|1,0,1]=4 2579 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [2,0,0,0,0,0|1,0,0]=3 2580 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [2,0,0,0,0,0|1,0,1]=4 2581 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [2,0,0,0,0,0|1,0,1]=4 2582 B5R0.5 C[C@H](O)C(F)F Amb33337783 [2,0,0,0,0,0|2,0,0]=4 2583 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [2,0,0,0,0,0|0,0,1]=3 2584 B5R0.5 C[C@H](O)C(O)O Amb27394850 [2,0,0,0,0,0|1,0,0]=3 2585 B5R0.5 C[C@H](O)[C@@H](C)Br Amb27865467 [2,0,0,0,0,0|1,0,1]=4 2586 B5R0.5 C[C@H](O)[C@H](C)O Amb8393638 [2,0,0,0,0,0|1,0,0]=3 2587 B5R0.5 C[C@H](O)[C@H](N)O Amb28066298 [2,0,0,0,0,0|0,0,0]=2 2588 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [2,0,0,0,0,0|1,0,0]=3 2589 B5R0.5 NC(=O)C(=O)O Amb32666615 [2,0,0,0,0,0|0,0,2]=4 2590 B5R0.5 NC(=O)C(=O)O Amb3940455 [2,0,0,0,0,0|0,0,2]=4 2591 B5R0.5 NC(Br)C(=O)O Amb25724348 [2,0,0,0,0,0|1,0,0]=3 2592 B5R0.5 NC(O)C(=O)O Amb24663706 [2,0,0,0,0,0|0,0,0]=2 2593 B5R0.5 NC(S)C(=O)O Amb27253385 [2,0,0,0,0,0|0,1,0]=3 2594 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [2,0,0,0,0,0|0,1,0]=3 2595 B5R0.5 O=C(O)C(=O)O Amb10608980 [2,0,0,0,0,0|1,0,1]=4 2596 B5R0.5 O=C(O)C(=O)O Amb19374136 [2,0,0,0,0,0|1,0,1]=4 2597 B5R0.5 O=C(O)C(=O)O Amb22231343 [2,0,0,0,0,0|1,0,1]=4 2598 B5R0.5 O=C(O)C(=O)O Amb22394874 [2,0,0,0,0,0|1,0,1]=4 2599 B5R0.5 O=C(O)C(=O)O Amb22436461 [2,0,0,0,0,0|1,0,1]=4 2600 B5R0.5 O=C(O)C(=O)O Amb7755827 [2,0,0,0,0,0|1,0,1]=4 2601 B5R0.5 O=C(O)C(=O)O Amb8513282 [2,0,0,0,0,0|1,0,1]=4 2602 B5R0.5 O=C(O)C(Br)I Amb17610018 [2,0,0,0,0,0|2,0,0]=4 2603 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [2,0,0,0,0,0|2,0,0]=4 2604 B5R0.5 O=C(O)C(Cl)I Amb17610937 [2,0,0,0,0,0|2,0,0]=4 2605 B5R0.5 O=C(O)C(F)Br Amb10841090 [2,0,0,0,0,0|2,0,0]=4 2606 B5R0.5 O=C(O)C(F)Cl Amb10838714 [2,0,0,0,0,0|2,0,0]=4 2607 B5R0.5 O=C(O)C(F)F Amb1953492 [2,0,0,0,0,0|2,0,0]=4 2608 B5R0.5 O=C(O)C(F)I Amb10838458 [2,0,0,0,0,0|2,0,0]=4 2609 B5R0.5 O=C(O)C(I)I Amb17612865 [2,0,0,0,0,0|2,0,0]=4 2610 B5R0.5 O=C(O)C(O)O Amb6608986 [2,0,0,0,0,0|1,0,0]=3 2611 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [2,0,0,0,0,0|2,0,0]=4 2612 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [2,0,0,0,0,0|2,0,0]=4 2613 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [2,0,0,0,0,0|2,0,0]=4 2614 B5R0.5 O=C([O-])C(O)O Amb33512886 [2,0,0,0,0,0|1,0,1]=4 2615 B5R0.5 OC(Cl)C(O)Cl Amb28436904 [2,0,0,0,0,0|2,0,0]=4 2616 B7R0.2 C#CC(=O)CC(C)C Amb28345618 [1,1,0,0,0,0|2,0,0]=4 2617 B7R0.2 C#CC(=O)CC(C)N Amb28285224 [1,1,0,0,0,0|2,0,0]=4 2618 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [1,1,0,0,0,0|1,0,0]=3 2619 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [1,1,0,0,0,0|0,0,1]=3 2620 B7R0.2 C#C[C@H](O)C[C@@H](C)O Amb27979326 [1,1,0,0,0,0|1,0,1]=4 2621 B7R0.2 C=C(Br)CC(O)CO Amb27206509 [1,1,0,0,0,0|2,0,0]=4 2622 B7R0.2 C=C(Br)C[C@@H](C)CO Amb28069642 [1,1,0,0,0,0|2,0,0]=4 2623 B7R0.2 C=C(Br)C[C@H](C)CO Amb27196706 [1,1,0,0,0,0|2,0,0]=4 2624 B7R0.2 C=C(C)CC(O)CN Amb33199504 [1,1,0,0,0,0|2,0,0]=4 2625 B7R0.2 C=C(CBr)CC(C)O Amb27955823 [1,1,0,0,0,0|2,0,0]=4 2626 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|1,0,1]=4 2627 B7R0.2 C=C(CC)CC(C)O Amb27477686 [1,1,0,0,0,0|2,0,0]=4 2628 B7R0.2 C=C(CO)CC(C)C Amb25889172 [1,1,0,0,0,0|2,0,0]=4 2629 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [1,1,0,0,0,0|2,0,0]=4 2630 B7R0.2 C=C=C(C)C[C@@H](C)O Amb27981629 [1,1,0,0,0,0|2,0,0]=4 2631 B7R0.2 C=CC(=C)C[C@H](C)O Amb27978244 [1,1,0,0,0,0|2,0,0]=4 2632 B7R0.2 C=CC(=O)CC(C)C Amb27412805 [1,1,0,0,0,0|2,0,0]=4 2633 B7R0.2 C=CC(=O)CC(C)N Amb28342099 [1,1,0,0,0,0|2,0,0]=4 2634 B7R0.2 C=CC(=O)CC(C)O Amb27861172 [1,1,0,0,0,0|1,0,0]=3 2635 B7R0.2 C=CC(=O)C[C@@H](C)O Amb28316225 [1,1,0,0,0,0|1,0,0]=3 2636 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,1,0,0,0,0|1,0,0]=3 2637 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [1,1,0,0,0,0|2,0,0]=4 2638 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [1,1,0,0,0,0|2,0,0]=4 2639 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [1,1,0,0,0,0|1,0,1]=4 2640 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [1,1,0,0,0,0|1,0,1]=4 2641 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [1,1,0,0,0,0|0,0,1]=3 2642 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,1,0,0,0,0|1,0,0]=3 2643 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [1,1,0,0,0,0|1,0,1]=4 2644 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [1,1,0,0,0,0|1,0,1]=4 2645 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,1,0,0,0,0|1,0,0]=3 2646 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [1,1,0,0,0,0|0,0,2]=4 2647 B7R0.2 CC(=O)CC(C)C#N Amb18124227 [1,1,0,0,0,0|2,0,0]=4 2648 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [1,1,0,0,0,0|2,0,0]=4 2649 B7R0.2 CC(=O)CC(C)CN Amb18251072 [1,1,0,0,0,0|2,0,0]=4 2650 B7R0.2 CC(=O)CC(N)CO Amb27240210 [1,1,0,0,0,0|2,0,0]=4 2651 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [1,1,0,0,0,0|1,0,0]=3 2652 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,1,0,0,0,0|1,0,1]=4 2653 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [1,1,0,0,0,0|1,0,0]=3 2654 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 2655 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [1,1,0,0,0,0|1,0,0]=3 2656 B7R0.2 CC(=O)C\C(C)=N\O Amb26568890 [1,1,0,0,0,0|1,0,1]=4 2657 B7R0.2 CC(=O)NC(C)CO Amb9276356 [1,1,0,0,0,0|2,0,0]=4 2658 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [1,1,0,0,0,0|2,0,0]=4 2659 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [1,1,0,0,0,0|2,0,0]=4 2660 B7R0.2 CC(=O)OC(O)CN Amb27839430 [1,1,0,0,0,0|2,0,0]=4 2661 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,1,0,0,0,0|1,0,0]=3 2662 B7R0.2 CC(C#N)CC(=O)[O-] Amb32952895 [1,1,0,0,0,0|1,0,1]=4 2663 B7R0.2 CC(C)CC(=O)C#N Amb4019436 [1,1,0,0,0,0|2,0,0]=4 2664 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|1,0,1]=4 2665 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [1,1,0,0,0,0|2,0,0]=4 2666 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [1,1,0,0,0,0|2,0,0]=4 2667 B7R0.2 CC(C)CC(=O)CF Amb23454719 [1,1,0,0,0,0|2,0,0]=4 2668 B7R0.2 CC(C)CC(=O)CN Amb18641847 [1,1,0,0,0,0|2,0,0]=4 2669 B7R0.2 CC(C)CC(=O)CN Amb30982570 [1,1,0,0,0,0|2,0,0]=4 2670 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|1,0,0]=3 2671 B7R0.2 CC(C)CC(=O)CS Amb28316226 [1,1,0,0,0,0|1,1,0]=4 2672 B7R0.2 CC(C)CC(=O)NN Amb1154207 [1,1,0,0,0,0|2,0,0]=4 2673 B7R0.2 CC(C)CC(=O)NO Amb6280209 [1,1,0,0,0,0|1,0,0]=3 2674 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|1,0,1]=4 2675 B7R0.2 CC(C)C\C(N)=N/O Amb2696576 [1,1,0,0,0,0|2,0,0]=4 2676 B7R0.2 CC(C)C\C(N)=N\O Amb8384557 [1,1,0,0,0,0|2,0,0]=4 2677 B7R0.2 CC(C)NC(=O)CO Amb5798170 [1,1,0,0,0,0|2,0,0]=4 2678 B7R0.2 CC(C)NC(=O)NO Amb27838415 [1,1,0,0,0,0|2,0,0]=4 2679 B7R0.2 CC(C)OC(=O)CO Amb3941003 [1,1,0,0,0,0|2,0,0]=4 2680 B7R0.2 CC(CC(=O)O)NN Amb28346224 [1,1,0,0,0,0|1,0,0]=3 2681 B7R0.2 CC(CC(=O)O)NN Amb33141007 [1,1,0,0,0,0|1,0,0]=3 2682 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [1,1,0,0,0,0|2,0,0]=4 2683 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,1,0,0,0,0|1,0,0]=3 2684 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,1,0,0,0,0|1,0,0]=3 2685 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,1,0,0,0,0|1,0,0]=3 2686 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,1,0,0,0,0|1,0,0]=3 2687 B7R0.2 CC(CN)CC(N)=O Amb18641899 [1,1,0,0,0,0|2,0,0]=4 2688 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,1,0,0,0,0|0,0,0]=2 2689 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [1,1,0,0,0,0|0,0,1]=3 2690 B7R0.2 CC(CO)OC(N)=O Amb26402233 [1,1,0,0,0,0|2,0,0]=4 2691 B7R0.2 CC(Cl)CC(=O)CN Amb28048961 [1,1,0,0,0,0|2,0,0]=4 2692 B7R0.2 CC(Cl)CC(=O)CN Amb33473605 [1,1,0,0,0,0|2,0,0]=4 2693 B7R0.2 CC(N)C\C(N)=N\O Amb25947803 [1,1,0,0,0,0|2,0,0]=4 2694 B7R0.2 CC(O)CC(=O)NN Amb6548973 [1,1,0,0,0,0|1,0,0]=3 2695 B7R0.2 CC(O)CC(O)CF Amb27978648 [1,1,0,0,0,0|1,0,1]=4 2696 B7R0.2 CC(O)CN(C)N=O Amb27595565 [1,1,0,0,0,0|2,0,0]=4 2697 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [1,1,0,0,0,0|1,0,1]=4 2698 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [1,1,0,0,0,0|0,0,2]=4 2699 B7R0.2 CC(O)C\C(N)=N\O Amb33328422 [1,1,0,0,0,0|1,0,0]=3 2700 B7R0.2 CC(O)NC(=O)CS Amb27838336 [1,1,0,0,0,0|1,1,0]=4 2701 B7R0.2 CC(S)CC(=O)NN Amb27970702 [1,1,0,0,0,0|1,1,0]=4 2702 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|0,0,2]=4 2703 B7R0.2 CCC(=O)CC(C)C Amb17138363 [1,1,0,0,0,0|2,0,0]=4 2704 B7R0.2 CCC(=O)CC(O)O Amb28316114 [1,1,0,0,0,0|2,0,0]=4 2705 B7R0.2 CCC(=O)C[C@@H](C)O Amb28316195 [1,1,0,0,0,0|1,0,0]=3 2706 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|2,0,0]=4 2707 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|1,0,0]=3 2708 B7R0.2 CCC(C)CC(C)=O Amb10608208 [1,1,0,0,0,0|2,0,0]=4 2709 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|2,0,0]=4 2710 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [1,1,0,0,0,0|2,0,0]=4 2711 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|1,0,0]=3 2712 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|1,0,0]=3 2713 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|2,0,0]=4 2714 B7R0.2 CCC(N)CC(C)=O Amb26895708 [1,1,0,0,0,0|2,0,0]=4 2715 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|2,0,0]=4 2716 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|0,0,0]=2 2717 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|1,0,0]=3 2718 B7R0.2 CCC(O)CC(C)O Amb26515705 [1,1,0,0,0,0|1,0,1]=4 2719 B7R0.2 CCC(O)CS(C)=O Amb28457838 [1,1,0,0,0,0|2,0,0]=4 2720 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [1,1,0,0,0,0|1,0,1]=4 2721 B7R0.2 CCC(O)OC(C)=O Amb28256771 [1,1,0,0,0,0|2,0,0]=4 2722 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|2,0,0]=4 2723 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|2,0,0]=4 2724 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|1,0,0]=3 2725 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,1]=4 2726 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|1,0,0]=3 2727 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|1,0,0]=3 2728 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|1,0,0]=3 2729 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|0,0,0]=2 2730 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|1,0,0]=3 2731 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [1,1,0,0,0,0|1,0,1]=4 2732 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [1,1,0,0,0,0|1,0,1]=4 2733 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|1,0,0]=3 2734 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|1,0,0]=3 2735 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|1,0,0]=3 2736 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|0,0,0]=2 2737 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [1,1,0,0,0,0|1,0,0]=3 2738 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [1,1,0,0,0,0|1,0,1]=4 2739 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [1,1,0,0,0,0|0,0,2]=4 2740 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [1,1,0,0,0,0|1,0,1]=4 2741 B7R0.2 CN(CO)CC(=O)O Amb27663224 [1,1,0,0,0,0|1,0,0]=3 2742 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [1,1,0,0,0,0|0,0,2]=4 2743 B7R0.2 CNC(=O)CC(C)N Amb18949898 [1,1,0,0,0,0|2,0,0]=4 2744 B7R0.2 CNC(=O)CC(C)N Amb33548084 [1,1,0,0,0,0|2,0,0]=4 2745 B7R0.2 CNC(=O)CC(C)O Amb24525315 [1,1,0,0,0,0|1,0,0]=3 2746 B7R0.2 CNC(=O)C[C@H](C)N Amb27400875 [1,1,0,0,0,0|2,0,0]=4 2747 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|1,0,0]=3 2748 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|1,0,0]=3 2749 B7R0.2 CNC(C)CC(N)=O Amb17231826 [1,1,0,0,0,0|2,0,0]=4 2750 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 2751 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|1,0,0]=3 2752 B7R0.2 COC(=N)CC(C)C Amb26515773 [1,1,0,0,0,0|2,0,0]=4 2753 B7R0.2 COC(=N)CC(C)C Amb32658736 [1,1,0,0,0,0|2,0,0]=4 2754 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|0,0,2]=4 2755 B7R0.2 COC(=O)CC(C)=O Amb6608655 [1,1,0,0,0,0|0,0,2]=4 2756 B7R0.2 COC(=O)CC(C)Br Amb10603675 [1,1,0,0,0,0|1,0,0]=3 2757 B7R0.2 COC(=O)CC(C)C Amb9241810 [1,1,0,0,0,0|1,0,0]=3 2758 B7R0.2 COC(=O)CC(C)Cl Amb4017877 [1,1,0,0,0,0|1,0,0]=3 2759 B7R0.2 COC(=O)CC(C)N Amb2371489 [1,1,0,0,0,0|1,0,0]=3 2760 B7R0.2 COC(=O)CC(C)N Amb461639 [1,1,0,0,0,0|1,0,0]=3 2761 B7R0.2 COC(=O)CC(C)O Amb9277785 [1,1,0,0,0,0|0,0,0]=2 2762 B7R0.2 COC(=O)CC(C)S Amb19515267 [1,1,0,0,0,0|0,1,0]=3 2763 B7R0.2 COC(=O)CC(F)F Amb26627959 [1,1,0,0,0,0|2,0,0]=4 2764 B7R0.2 COC(=O)CN(C)C Amb7755999 [1,1,0,0,0,0|2,0,0]=4 2765 B7R0.2 COC(=O)CN(C)O Amb28411029 [1,1,0,0,0,0|1,0,0]=3 2766 B7R0.2 COC(=O)CS(C)=O Amb20626166 [1,1,0,0,0,0|1,0,1]=4 2767 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [1,1,0,0,0,0|1,0,0]=3 2768 B7R0.2 COC(=O)C[C@@H](C)N Amb8395866 [1,1,0,0,0,0|1,0,0]=3 2769 B7R0.2 COC(=O)C[C@@H](C)O Amb2725551 [1,1,0,0,0,0|0,0,0]=2 2770 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [1,1,0,0,0,0|1,0,0]=3 2771 B7R0.2 COC(=O)C[C@H](C)N Amb33847401 [1,1,0,0,0,0|1,0,0]=3 2772 B7R0.2 COC(=O)C[C@H](C)O Amb8397299 [1,1,0,0,0,0|0,0,0]=2 2773 B7R0.2 COC(=O)NC(C)C Amb17861698 [1,1,0,0,0,0|2,0,0]=4 2774 B7R0.2 COC(=O)OC(C)C Amb22049510 [1,1,0,0,0,0|2,0,0]=4 2775 B7R0.2 COC(=O)OC(C)Cl Amb28320721 [1,1,0,0,0,0|2,0,0]=4 2776 B7R0.2 COC(=O)OC(C)F Amb28251346 [1,1,0,0,0,0|2,0,0]=4 2777 B7R0.2 COC(=O)OC(C)O Amb28207359 [1,1,0,0,0,0|1,0,0]=3 2778 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|0,0,0]=2 2779 B7R0.2 COC(C)CC(C)=O Amb26512071 [1,1,0,0,0,0|1,0,0]=3 2780 B7R0.2 COC(C)CC(C)O Amb22757067 [1,1,0,0,0,0|1,0,1]=4 2781 B7R0.2 COC(C)CC(N)=O Amb27838372 [1,1,0,0,0,0|1,0,0]=3 2782 B7R0.2 COC(C)CS(=O)Cl Amb32720528 [1,1,0,0,0,0|2,0,0]=4 2783 B7R0.2 COC(C)CS(=O)[O-] Amb25690482 [1,1,0,0,0,0|1,0,1]=4 2784 B7R0.2 COC(C)CS(N)=O Amb32720534 [1,1,0,0,0,0|2,0,0]=4 2785 B7R0.2 COC(C)NC(C)=O Amb27839138 [1,1,0,0,0,0|2,0,0]=4 2786 B7R0.2 CON(C)CC(=O)O Amb8010467 [1,1,0,0,0,0|1,0,0]=3 2787 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|0,0,0]=2 2788 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [1,1,0,0,0,0|1,0,0]=3 2789 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [1,1,0,0,0,0|0,0,2]=4 2790 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [1,1,0,0,0,0|0,0,2]=4 2791 B7R0.2 CS(=O)CC(O)CN Amb24482487 [1,1,0,0,0,0|2,0,0]=4 2792 B7R0.2 CS(=O)CC(O)CN Amb32683521 [1,1,0,0,0,0|2,0,0]=4 2793 B7R0.2 CSC(=S)CC(C)O Amb27164064 [1,1,0,0,0,0|0,2,0]=4 2794 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|0,1,0]=3 2795 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|1,1,0]=4 2796 B7R0.2 CSC(C)CC(N)=O Amb27838848 [1,1,0,0,0,0|1,1,0]=4 2797 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|0,1,0]=3 2798 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [1,1,0,0,0,0|2,0,0]=4 2799 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,1,0,0,0,0|1,0,0]=3 2800 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,1,0,0,0,0|1,0,0]=3 2801 B7R0.2 C[C@@H](O)CC(=O)NN Amb27452910 [1,1,0,0,0,0|1,0,0]=3 2802 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,1,0,0,0,0|1,0,0]=3 2803 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,1,0,0,0,0|1,0,0]=3 2804 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,1,0,0,0,0|0,0,0]=2 2805 B7R0.2 C[C@H](O)CC(=O)NN Amb27409334 [1,1,0,0,0,0|1,0,0]=3 2806 B7R0.2 C[C@H](O)CN(C)N=O Amb27843043 [1,1,0,0,0,0|2,0,0]=4 2807 B7R0.2 C[C@H](O)C[C@H](O)CCl Amb27668776 [1,1,0,0,0,0|1,0,1]=4 2808 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [1,1,0,0,0,0|0,0,2]=4 2809 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [1,1,0,0,0,0|0,0,2]=4 2810 B7R0.2 C\C(C=O)=C\C(C)O Amb27802195 [1,1,0,0,0,0|1,0,1]=4 2811 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [1,1,0,0,0,0|0,0,1]=3 2812 B7R0.2 C\C(CC(C)C)=N/O Amb26630838 [1,1,0,0,0,0|2,0,0]=4 2813 B7R0.2 C\C(CC(C)C)=N\O Amb27624178 [1,1,0,0,0,0|2,0,0]=4 2814 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,1,0,0,0,0|1,0,1]=4 2815 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [1,1,0,0,0,0|1,0,1]=4 2816 B7R0.2 N#CC(O)CC(N)=O Amb28063048 [1,1,0,0,0,0|1,0,1]=4 2817 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [1,1,0,0,0,0|2,0,0]=4 2818 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [1,1,0,0,0,0|2,0,0]=4 2819 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|1,0,0]=3 2820 B7R0.2 NC(=O)CN(O)CBr Amb27863565 [1,1,0,0,0,0|2,0,0]=4 2821 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [1,1,0,0,0,0|1,0,0]=3 2822 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [1,1,0,0,0,0|1,0,0]=3 2823 B7R0.2 NC(=S)CC(O)CF Amb26626569 [1,1,0,0,0,0|1,1,0]=4 2824 B7R0.2 NC(=S)CC(O)CO Amb27793984 [1,1,0,0,0,0|1,1,0]=4 2825 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,1,0,0,0,0|1,0,1]=4 2826 B7R0.2 NC(CF)CC(=O)O Amb24428065 [1,1,0,0,0,0|1,0,0]=3 2827 B7R0.2 NC(CS)CC(=O)O Amb25090412 [1,1,0,0,0,0|1,0,0]=3 2828 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [1,1,0,0,0,0|2,0,0]=4 2829 B7R0.2 NCC(N)CC(=O)O Amb19515145 [1,1,0,0,0,0|1,0,0]=3 2830 B7R0.2 NCC(N)CC(=O)O Amb21858324 [1,1,0,0,0,0|1,0,0]=3 2831 B7R0.2 NCC(N)CC(N)=O Amb27603845 [1,1,0,0,0,0|2,0,0]=4 2832 B7R0.2 NCC(O)CC(=O)O Amb32663899 [1,1,0,0,0,0|0,0,0]=2 2833 B7R0.2 NCC(O)CC(=O)O Amb33544754 [1,1,0,0,0,0|0,0,0]=2 2834 B7R0.2 NCC(O)CS(=O)O Amb27831981 [1,1,0,0,0,0|1,0,0]=3 2835 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [1,1,0,0,0,0|1,0,0]=3 2836 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [1,1,0,0,0,0|2,0,0]=4 2837 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [1,1,0,0,0,0|2,0,0]=4 2838 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [1,1,0,0,0,0|1,0,0]=3 2839 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [1,1,0,0,0,0|0,0,0]=2 2840 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [1,1,0,0,0,0|0,0,0]=2 2841 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [1,1,0,0,0,0|1,0,0]=3 2842 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [1,1,0,0,0,0|1,0,0]=3 2843 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [1,1,0,0,0,0|2,0,0]=4 2844 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [1,1,0,0,0,0|0,0,0]=2 2845 B7R0.2 NC[C@H](O)CP(=O)=O Amb28249133 [1,1,0,0,0,0|1,0,1]=4 2846 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [1,1,0,0,0,0|1,0,0]=3 2847 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [1,1,0,0,0,0|1,0,0]=3 2848 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,1,0,0,0,0|1,0,1]=4 2849 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [1,1,0,0,0,0|1,0,0]=3 2850 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [1,1,0,0,0,0|1,0,0]=3 2851 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [1,1,0,0,0,0|1,0,1]=4 2852 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|0,0,2]=4 2853 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [1,1,0,0,0,0|0,0,0]=2 2854 B7R0.2 O=C(O)CC(O)CF Amb26557587 [1,1,0,0,0,0|0,0,0]=2 2855 B7R0.2 O=C(O)CC(O)CO Amb28120003 [1,1,0,0,0,0|0,0,0]=2 2856 B7R0.2 O=C(O)CC(O)CS Amb27244674 [1,1,0,0,0,0|0,0,0]=2 2857 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [1,1,0,0,0,0|0,0,0]=2 2858 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [1,1,0,0,0,0|0,0,0]=2 2859 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [1,1,0,0,0,0|0,0,0]=2 2860 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [1,1,0,0,0,0|0,0,0]=2 2861 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [1,1,0,0,0,0|0,0,0]=2 2862 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [1,1,0,0,0,0|0,0,2]=4 2863 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [1,1,0,0,0,0|0,0,1]=3 2864 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [1,1,0,0,0,0|1,0,1]=4 2865 B7R0.2 O=[N+]([O-])CC(O)CCl Amb28133599 [1,1,0,0,0,0|1,0,1]=4 2866 B7R0.9 C=C(C)CC(C)(C)O Amb22052674 [1,1,0,0,0,0|2,0,0]=4 2867 B7R0.9 CC(=O)CC(C)(C)C Amb4605984 [1,1,0,0,0,0|2,0,0]=4 2868 B7R0.9 CC(=O)CC(C)(C)Cl Amb27861037 [1,1,0,0,0,0|2,0,0]=4 2869 B7R0.9 CC(=O)CC(C)(C)N Amb3940544 [1,1,0,0,0,0|2,0,0]=4 2870 B7R0.9 CC(=O)CC(C)(C)N Amb4136360 [1,1,0,0,0,0|2,0,0]=4 2871 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [1,1,0,0,0,0|1,0,0]=3 2872 B7R0.9 CC(=O)CC(C)(C)S Amb17593394 [1,1,0,0,0,0|1,1,0]=4 2873 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [1,1,0,0,0,0|2,0,0]=4 2874 B7R0.9 CC(=O)OC(C)(O)Cl Amb27756319 [1,1,0,0,0,0|2,0,0]=4 2875 B7R0.9 CC(C)(Br)CC(=O)Cl Amb32665504 [1,1,0,0,0,0|2,0,0]=4 2876 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [1,1,0,0,0,0|1,0,0]=3 2877 B7R0.9 CC(C)(C)CC(=O)Cl Amb3939309 [1,1,0,0,0,0|2,0,0]=4 2878 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [1,1,0,0,0,0|1,0,0]=3 2879 B7R0.9 CC(C)(C)CC(N)=O Amb3886534 [1,1,0,0,0,0|2,0,0]=4 2880 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [1,1,0,0,0,0|1,0,0]=3 2881 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [1,1,0,0,0,0|1,0,0]=3 2882 B7R0.9 CC(C)(N)CC(=O)Cl Amb27173472 [1,1,0,0,0,0|2,0,0]=4 2883 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [1,1,0,0,0,0|1,0,0]=3 2884 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [1,1,0,0,0,0|1,0,0]=3 2885 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [1,1,0,0,0,0|1,0,0]=3 2886 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [1,1,0,0,0,0|2,0,0]=4 2887 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [1,1,0,0,0,0|2,0,0]=4 2888 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [1,1,0,0,0,0|0,0,0]=2 2889 B7R0.9 CC(C)(O)CC(=O)[O-] Amb17678748 [1,1,0,0,0,0|0,0,1]=3 2890 B7R0.9 CC(C)(O)CC(=O)[O-] Amb22729769 [1,1,0,0,0,0|0,0,1]=3 2891 B7R0.9 CC(C)(O)CC(N)=O Amb25889946 [1,1,0,0,0,0|1,0,0]=3 2892 B7R0.9 CC(C)(O)C[N+](=O)[O-] Amb2586533 [1,1,0,0,0,0|1,0,1]=4 2893 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [1,1,0,0,0,0|0,1,0]=3 2894 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [1,1,0,0,0,0|2,0,0]=4 2895 B7R0.9 CC(F)(F)CC(=O)Cl Amb27596822 [1,1,0,0,0,0|2,0,0]=4 2896 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [1,1,0,0,0,0|1,0,0]=3 2897 B7R0.9 CC(N)CP(=O)(O)O Amb27592463 [1,1,0,0,0,0|2,0,0]=4 2898 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [1,1,0,0,0,0|0,0,0]=2 2899 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [1,1,0,0,0,0|0,0,0]=2 2900 B7R0.9 CC(O)(O)CC(N)=O Amb27882731 [1,1,0,0,0,0|1,0,0]=3 2901 B7R0.9 CC(O)(O)OC(N)=O Amb27233889 [1,1,0,0,0,0|2,0,0]=4 2902 B7R0.9 CC(O)CC(C)(C)O Amb8386003 [1,1,0,0,0,0|1,0,1]=4 2903 B7R0.9 CC(O)CS(=O)(=O)Cl Amb25032356 [1,1,0,0,0,0|1,0,1]=4 2904 B7R0.9 CC(O)CS(=O)(=O)F Amb33098549 [1,1,0,0,0,0|1,0,1]=4 2905 B7R0.9 CC(O)CS(=O)(=O)O Amb17593541 [1,1,0,0,0,0|1,0,0]=3 2906 B7R0.9 CC(O)CS(C)(=O)=O Amb21988449 [1,1,0,0,0,0|1,0,1]=4 2907 B7R0.9 CC(O)CS(N)(=O)=O Amb27409415 [1,1,0,0,0,0|1,0,1]=4 2908 B7R0.9 CP(=O)(O)CC(=O)O Amb3371772 [1,1,0,0,0,0|1,0,0]=3 2909 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [1,1,0,0,0,0|1,0,1]=4 2910 B7R0.9 CS(=O)(=O)CC(=O)O Amb3939888 [1,1,0,0,0,0|1,0,1]=4 2911 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [1,1,0,0,0,0|2,0,0]=4 2912 B7R0.9 C[C@@H](O)CC(C)(C)O Amb10606102 [1,1,0,0,0,0|1,0,1]=4 2913 B7R0.9 C[C@@H](O)CS(=O)(=O)[O-] Amb27768826 [1,1,0,0,0,0|1,0,1]=4 2914 B7R0.9 C[C@@H](O)CS(C)(=O)=O Amb33055943 [1,1,0,0,0,0|1,0,1]=4 2915 B7R0.9 C[C@H](N)CP(=O)(O)O Amb27647907 [1,1,0,0,0,0|2,0,0]=4 2916 B7R0.9 C[C@H](N)CS(=O)(=O)O Amb25760668 [1,1,0,0,0,0|2,0,0]=4 2917 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [1,1,0,0,0,0|1,0,1]=4 2918 B7R0.9 C[C@H](O)CS(C)(=O)=O Amb33055944 [1,1,0,0,0,0|1,0,1]=4 2919 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [1,1,0,0,0,0|2,0,0]=4 2920 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [1,1,0,0,0,0|2,0,0]=4 2921 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [1,1,0,0,0,0|1,1,0]=4 2922 B7R0.9 NC(O)CS(=O)(=O)O Amb27882330 [1,1,0,0,0,0|2,0,0]=4 2923 B7R0.9 O=C(O)CC(Cl)(Cl)Cl Amb27955278 [1,1,0,0,0,0|2,0,0]=4 2924 B7R0.9 O=C(O)CC(F)(F)Br Amb24373833 [1,1,0,0,0,0|2,0,0]=4 2925 B7R0.9 O=C(O)CC(F)(F)F Amb2691112 [1,1,0,0,0,0|2,0,0]=4 2926 B7R0.9 O=C(O)CP(=O)(O)O Amb4489433 [1,1,0,0,0,0|2,0,0]=4 2927 B7R0.9 O=C(O)CS(=O)(=O)O Amb16232248 [1,1,0,0,0,0|2,0,0]=4 2928 B7R0.9 O=C(O)C[SH](=O)([O-])O Amb27231739 [1,1,0,0,0,0|2,0,0]=4 2929 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [1,1,0,0,0,0|1,0,1]=4 2930 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [1,1,0,0,0,0|0,0,1]=3 2931 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [1,1,0,0,0,0|0,0,1]=3 2932 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [1,1,0,0,0,0|1,0,1]=4 2933 B7R0.5 C#CCC(N)C(C)O Amb35743443 [1,1,0,0,0,0|1,0,1]=4 2934 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [1,1,0,0,0,0|1,0,1]=4 2935 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [1,1,0,0,0,0|1,0,1]=4 2936 B7R0.5 C#CCC(N)[PH](=O)O Amb27838345 [1,1,0,0,0,0|1,0,1]=4 2937 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [1,1,0,0,0,0|1,0,1]=4 2938 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [1,1,0,0,0,0|0,0,1]=3 2939 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [1,1,0,0,0,0|0,0,1]=3 2940 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [1,1,0,0,0,0|1,0,1]=4 2941 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [1,1,0,0,0,0|1,0,1]=4 2942 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [1,1,0,0,0,0|0,0,1]=3 2943 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [1,1,0,0,0,0|1,0,1]=4 2944 B7R0.5 C=C(C)C(N)CCO Amb27391185 [1,1,0,0,0,0|2,0,0]=4 2945 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,1,0,0,0,0|1,0,1]=4 2946 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [1,1,0,0,0,0|1,0,1]=4 2947 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [1,1,0,0,0,0|1,0,1]=4 2948 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,1,0,0,0,0|1,0,1]=4 2949 B7R0.5 C=C(COC)C(=O)O Amb26978134 [1,1,0,0,0,0|1,0,1]=4 2950 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [1,1,0,0,0,0|1,0,1]=4 2951 B7R0.5 C=C=CC(O)C(C)O Amb27659570 [1,1,0,0,0,0|2,0,0]=4 2952 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,1,0,0,0,0|1,0,1]=4 2953 B7R0.5 C=CCC(C)C(C)O Amb26435224 [1,1,0,0,0,0|2,0,0]=4 2954 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,1,0,0,0,0|1,0,1]=4 2955 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,1,0,0,0,0|1,0,1]=4 2956 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [1,1,0,0,0,0|1,0,1]=4 2957 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,1,0,0,0,0|0,0,1]=3 2958 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,1,0,0,0,0|0,0,1]=3 2959 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [1,1,0,0,0,0|1,0,1]=4 2960 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [1,1,0,0,0,0|1,0,1]=4 2961 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,1,0,0,0,0|0,0,1]=3 2962 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,1,0,0,0,0|0,0,1]=3 2963 B7R0.5 C=CC[C@@H](N)C(C)C Amb27815025 [1,1,0,0,0,0|2,0,0]=4 2964 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [1,1,0,0,0,0|1,0,1]=4 2965 B7R0.5 C=CC[C@H](C)C(C)O Amb28350029 [1,1,0,0,0,0|2,0,0]=4 2966 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [1,1,0,0,0,0|1,0,1]=4 2967 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,1,0,0,0,0|0,0,1]=3 2968 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,1,0,0,0,0|0,0,1]=3 2969 B7R0.5 C=CC[C@H](O)[C@H](C)O Amb28366034 [1,1,0,0,0,0|2,0,0]=4 2970 B7R0.5 C=COC(C)C(C)O Amb27405290 [1,1,0,0,0,0|2,0,0]=4 2971 B7R0.5 C=CS[C@@H](C)[C@@H](C)O Amb28079099 [1,1,0,0,0,0|2,0,0]=4 2972 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,1,0,0,0,0|1,0,1]=4 2973 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,1,0,0,0,0|1,0,1]=4 2974 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [1,1,0,0,0,0|2,0,0]=4 2975 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,1,0,0,0,0|2,0,0]=4 2976 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [1,1,0,0,0,0|2,0,0]=4 2977 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [1,1,0,0,0,0|2,0,0]=4 2978 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,1,0,0,0,0|2,0,0]=4 2979 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [1,1,0,0,0,0|2,0,0]=4 2980 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|2,0,0]=4 2981 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,1,0,0,0,0|2,0,0]=4 2982 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [1,1,0,0,0,0|2,0,0]=4 2983 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [1,1,0,0,0,0|2,0,0]=4 2984 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|1,0,0]=3 2985 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|2,0,0]=4 2986 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,1,0,0,0,0|1,0,0]=3 2987 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|2,0,0]=4 2988 B7R0.5 CC(C)C(C)\C=N\O Amb27184671 [1,1,0,0,0,0|2,0,0]=4 2989 B7R0.5 CC(C)C(Cl)\C=N\O Amb27424666 [1,1,0,0,0,0|2,0,0]=4 2990 B7R0.5 CC(C)C(N)CC=O Amb27628058 [1,1,0,0,0,0|1,0,0]=3 2991 B7R0.5 CC(C)C(N)CCO Amb1993950 [1,1,0,0,0,0|1,0,1]=4 2992 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [1,1,0,0,0,0|2,0,0]=4 2993 B7R0.5 CC(C)[C@@H](N)CCO Amb26864199 [1,1,0,0,0,0|1,0,1]=4 2994 B7R0.5 CC(C)[C@H](N)CCO Amb28284336 [1,1,0,0,0,0|1,0,1]=4 2995 B7R0.5 CC(C)[C@H](N)NC=O Amb28187220 [1,1,0,0,0,0|1,0,0]=3 2996 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [1,1,0,0,0,0|1,0,1]=4 2997 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,1,0,0,0,0|1,0,1]=4 2998 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [1,1,0,0,0,0|2,0,0]=4 2999 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,1,0,0,0,0|1,0,0]=3 3000 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 3001 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,1,0,0,0,0|1,0,0]=3 3002 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,1,0,0,0,0|1,0,0]=3 3003 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,1,0,0,0,0|1,0,0]=3 3004 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,1,0,0,0,0|1,0,0]=3 3005 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,1,0,0,0,0|1,0,1]=4 3006 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,1,0,0,0,0|2,0,0]=4 3007 B7R0.5 CC(CNO)C(=O)O Amb28315956 [1,1,0,0,0,0|1,0,0]=3 3008 B7R0.5 CC(CSS)C(=O)O Amb27437183 [1,1,0,0,0,0|1,1,0]=4 3009 B7R0.5 CC(Cl)C(C)OC=O Amb28245214 [1,1,0,0,0,0|2,0,0]=4 3010 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,1,0,0,0,0|1,0,0]=3 3011 B7R0.5 CC(O)\C(N)=C\C#N Amb27216189 [1,1,0,0,0,0|1,0,1]=4 3012 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [1,1,0,0,0,0|2,0,0]=4 3013 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,1,0,0,0,0|1,0,1]=4 3014 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [1,1,0,0,0,0|2,0,0]=4 3015 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|1,0,0]=3 3016 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [1,1,0,0,0,0|2,0,0]=4 3017 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [1,1,0,0,0,0|2,0,0]=4 3018 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|1,0,0]=3 3019 B7R0.5 CCCC(C)C(C)=O Amb4034597 [1,1,0,0,0,0|2,0,0]=4 3020 B7R0.5 CCCC(C)C(N)=O Amb3886535 [1,1,0,0,0,0|2,0,0]=4 3021 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|1,0,0]=3 3022 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|1,0,0]=3 3023 B7R0.5 CCCC(F)C(C)=O Amb28316211 [1,1,0,0,0,0|2,0,0]=4 3024 B7R0.5 CCCC(F)C(N)=O Amb28127390 [1,1,0,0,0,0|2,0,0]=4 3025 B7R0.5 CCCC(N)C(=N)N Amb27222841 [1,1,0,0,0,0|2,0,0]=4 3026 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|0,0,0]=2 3027 B7R0.5 CCCC(N)C(C)=O Amb27838289 [1,1,0,0,0,0|1,0,0]=3 3028 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 3029 B7R0.5 CCCC(N)C(N)=O Amb9514970 [1,1,0,0,0,0|1,0,0]=3 3030 B7R0.5 CCCC(N)C(N)=S Amb28121515 [1,1,0,0,0,0|1,1,0]=4 3031 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|1,0,0]=3 3032 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|2,0,0]=4 3033 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|2,0,0]=4 3034 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|1,0,0]=3 3035 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,1,0,0,0,0|2,0,0]=4 3036 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|1,0,0]=3 3037 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|1,0,0]=3 3038 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|0,0,0]=2 3039 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [1,1,0,0,0,0|1,0,0]=3 3040 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [1,1,0,0,0,0|1,0,1]=4 3041 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 3042 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 3043 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|1,0,0]=3 3044 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|1,0,0]=3 3045 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|1,0,0]=3 3046 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [1,1,0,0,0,0|2,0,0]=4 3047 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|1,0,0]=3 3048 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|0,0,0]=2 3049 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|0,0,0]=2 3050 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [1,1,0,0,0,0|1,0,0]=3 3051 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [1,1,0,0,0,0|1,0,1]=4 3052 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [1,1,0,0,0,0|1,0,0]=3 3053 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [1,1,0,0,0,0|1,0,0]=3 3054 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [1,1,0,0,0,0|1,0,1]=4 3055 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|1,0,0]=3 3056 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|2,0,0]=4 3057 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|1,0,0]=3 3058 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,1,0,0,0,0|1,0,1]=4 3059 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|1,0,0]=3 3060 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|1,0,0]=3 3061 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 3062 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,1,0,0,0,0|2,0,0]=4 3063 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|1,0,0]=3 3064 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|1,0,0]=3 3065 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|1,0,0]=3 3066 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|1,0,1]=4 3067 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,0]=3 3068 B7R0.5 CCOC(C)C(C)=O Amb9666103 [1,1,0,0,0,0|2,0,0]=4 3069 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 3070 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [1,1,0,0,0,0|2,0,0]=4 3071 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [1,1,0,0,0,0|2,0,0]=4 3072 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,0]=3 3073 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [1,1,0,0,0,0|1,0,1]=4 3074 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,0]=3 3075 B7R0.5 CCSC(C)C(N)=O Amb27830179 [1,1,0,0,0,0|2,0,0]=4 3076 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [1,1,0,0,0,0|2,0,0]=4 3077 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,1,0,0,0,0|1,0,1]=4 3078 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,1,0,0,0,0|1,0,1]=4 3079 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,1,0,0,0,0|1,0,1]=4 3080 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|1,0,0]=3 3081 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|1,0,0]=3 3082 B7R0.5 CNCC(C)C(N)=O Amb8943991 [1,1,0,0,0,0|2,0,0]=4 3083 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|0,0,0]=2 3084 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|1,0,0]=3 3085 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|0,0,0]=2 3086 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|0,0,0]=2 3087 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [1,1,0,0,0,0|2,0,0]=4 3088 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|1,0,0]=3 3089 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|1,0,0]=3 3090 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|2,0,0]=4 3091 B7R0.5 COCC(C)C(C)O Amb24746662 [1,1,0,0,0,0|1,0,1]=4 3092 B7R0.5 COCC(C)C(N)=O Amb27401584 [1,1,0,0,0,0|2,0,0]=4 3093 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|1,0,0]=3 3094 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|0,0,0]=2 3095 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|0,0,0]=2 3096 B7R0.5 COCC(N)C(C)=O Amb27468401 [1,1,0,0,0,0|1,0,0]=3 3097 B7R0.5 COCC(N)C(C)C Amb18202679 [1,1,0,0,0,0|1,0,1]=4 3098 B7R0.5 COCC(N)C(C)C Amb21954041 [1,1,0,0,0,0|1,0,1]=4 3099 B7R0.5 COCC(N)C(C)O Amb18124266 [1,1,0,0,0,0|0,0,1]=3 3100 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|1,0,0]=3 3101 B7R0.5 COCC(N)C(N)=O Amb32693410 [1,1,0,0,0,0|1,0,0]=3 3102 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|1,0,0]=3 3103 B7R0.5 COCC(O)C(N)=O Amb28069186 [1,1,0,0,0,0|2,0,0]=4 3104 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|1,0,0]=3 3105 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|1,0,0]=3 3106 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|0,0,0]=2 3107 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|0,0,0]=2 3108 B7R0.5 COC[C@@H](N)C(C)C Amb17061638 [1,1,0,0,0,0|1,0,1]=4 3109 B7R0.5 COC[C@@H](N)[C@H](C)O Amb27843279 [1,1,0,0,0,0|0,0,1]=3 3110 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|1,0,0]=3 3111 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|0,0,0]=2 3112 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|0,0,0]=2 3113 B7R0.5 COC[C@H](N)C(C)C Amb18016631 [1,1,0,0,0,0|1,0,1]=4 3114 B7R0.5 COC[C@H](N)C(C)C Amb32411970 [1,1,0,0,0,0|1,0,1]=4 3115 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|1,0,0]=3 3116 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,1,0,0,0,0|2,0,0]=4 3117 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [1,1,0,0,0,0|0,0,2]=4 3118 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|1,0,0]=3 3119 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [1,1,0,0,0,0|2,0,0]=4 3120 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|1,0,0]=3 3121 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|0,0,0]=2 3122 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|0,0,0]=2 3123 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|1,0,0]=3 3124 B7R0.5 CSCC(O)C(C)=O Amb25983211 [1,1,0,0,0,0|2,0,0]=4 3125 B7R0.5 CSCC(O)C(N)=O Amb27168145 [1,1,0,0,0,0|2,0,0]=4 3126 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|1,0,0]=3 3127 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|0,0,0]=2 3128 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|0,0,0]=2 3129 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [1,1,0,0,0,0|1,0,0]=3 3130 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,1,0,0,0,0|1,0,0]=3 3131 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,1,0,0,0,0|1,0,0]=3 3132 B7R0.5 C[C@@H](O)[C@@H](O)CC=O Amb27643485 [1,1,0,0,0,0|1,0,0]=3 3133 B7R0.5 C[C@@H](O)[C@H](O)CC=O Amb27798254 [1,1,0,0,0,0|1,0,0]=3 3134 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,1,0,0,0,0|1,0,0]=3 3135 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,1,0,0,0,0|1,0,0]=3 3136 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|0,0,0]=2 3137 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|0,0,0]=2 3138 B7R0.5 C\C(=C/CO)[C@@H](C)O Amb27255232 [1,1,0,0,0,0|1,0,1]=4 3139 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,1,0,0,0,0|1,0,1]=4 3140 B7R0.5 C\C=C\C(C)C(C)O Amb32944797 [1,1,0,0,0,0|2,0,0]=4 3141 B7R0.5 C\C=C\C(N)C(C)C Amb24473868 [1,1,0,0,0,0|2,0,0]=4 3142 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,1,0,0,0,0|1,0,1]=4 3143 B7R0.5 C\C=C\C(O)C(C)O Amb28429731 [1,1,0,0,0,0|2,0,0]=4 3144 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,1,0,0,0,0|0,0,1]=3 3145 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,1,0,0,0,0|1,0,1]=4 3146 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,1,0,0,0,0|1,0,1]=4 3147 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [1,1,0,0,0,0|0,0,1]=3 3148 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [1,1,0,0,0,0|1,0,1]=4 3149 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [1,1,0,0,0,0|0,0,1]=3 3150 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [1,1,0,0,0,0|0,0,1]=3 3151 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [1,1,0,0,0,0|2,0,0]=4 3152 B7R0.5 NC(=O)C(N)CCF Amb24391278 [1,1,0,0,0,0|1,0,0]=3 3153 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,1,0,0,0,0|1,0,0]=3 3154 B7R0.5 NC(=O)C(N)CNO Amb27396201 [1,1,0,0,0,0|1,0,0]=3 3155 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,1,0,0,0,0|0,0,0]=2 3156 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,1,0,0,0,0|0,0,0]=2 3157 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,1,0,0,0,0|0,0,0]=2 3158 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,1,0,0,0,0|0,0,0]=2 3159 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,1,0,0,0,0|0,0,0]=2 3160 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,1,0,0,0,0|0,0,0]=2 3161 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,1,0,0,0,0|0,0,0]=2 3162 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [1,1,0,0,0,0|1,0,0]=3 3163 B7R0.5 NC(CNO)C(=O)O Amb4092732 [1,1,0,0,0,0|0,0,0]=2 3164 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [1,1,0,0,0,0|0,0,0]=2 3165 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [1,1,0,0,0,0|0,0,2]=4 3166 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,1,0,0,0,0|1,0,0]=3 3167 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,1,0,0,0,0|1,0,0]=3 3168 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,1,0,0,0,0|1,0,0]=3 3169 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [1,1,0,0,0,0|2,0,0]=4 3170 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,1,0,0,0,0|0,0,0]=2 3171 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,1,0,0,0,0|0,0,0]=2 3172 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,1,0,0,0,0|1,0,0]=3 3173 B7R0.5 NCCC(O)C(N)=O Amb28121985 [1,1,0,0,0,0|2,0,0]=4 3174 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,1,0,0,0,0|1,0,0]=3 3175 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,1,0,0,0,0|0,0,0]=2 3176 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,1,0,0,0,0|0,0,0]=2 3177 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,1,0,0,0,0|0,0,0]=2 3178 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [1,1,0,0,0,0|1,0,0]=3 3179 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,1,0,0,0,0|1,0,0]=3 3180 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,1,0,0,0,0|1,0,0]=3 3181 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,1,0,0,0,0|0,0,0]=2 3182 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,1,0,0,0,0|0,0,0]=2 3183 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,1,0,0,0,0|0,0,0]=2 3184 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,1,0,0,0,0|0,0,0]=2 3185 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,1,0,0,0,0|1,0,0]=3 3186 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [1,1,0,0,0,0|2,0,0]=4 3187 B7R0.5 NOCC(N)C(=O)O Amb24184086 [1,1,0,0,0,0|0,0,0]=2 3188 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,1,0,0,0,0|0,0,0]=2 3189 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,1,0,0,0,0|0,0,0]=2 3190 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,1,0,0,0,0|0,0,0]=2 3191 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,1,0,0,0,0|0,0,0]=2 3192 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,1,0,0,0,0|0,0,0]=2 3193 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [1,1,0,0,0,0|0,1,0]=3 3194 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [1,1,0,0,0,0|0,0,2]=4 3195 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,1,0,0,0,0|0,0,1]=3 3196 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,1,0,0,0,0|0,0,0]=2 3197 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,1,0,0,0,0|0,0,0]=2 3198 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,1,0,0,0,0|0,0,0]=2 3199 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,1,0,0,0,0|0,0,1]=3 3200 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 3201 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [1,1,0,0,0,0|2,0,0]=4 3202 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [1,1,0,0,0,0|1,0,1]=4 3203 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|1,0,1]=4 3204 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|1,0,0]=3 3205 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,1,0,0,0,0|1,0,0]=3 3206 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|1,0,0]=3 3207 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,1,0,0,0,0|1,0,0]=3 3208 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,1,0,0,0,0|1,0,0]=3 3209 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,1,0,0,0,0|1,0,0]=3 3210 B7R0.5 O=C(O)C(O)CNO Amb27405525 [1,1,0,0,0,0|1,0,0]=3 3211 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,1,0,0,0,0|1,0,0]=3 3212 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,1,0,0,0,0|1,0,0]=3 3213 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [1,1,0,0,0,0|1,0,1]=4 3214 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [1,1,0,0,0,0|0,0,2]=4 3215 B7R0.10 C#CC(=O)C(N)CC Amb28422982 [1,1,0,0,0,0|1,0,0]=3 3216 B7R0.10 C#CC(=O)[C@@H](N)CC Amb35601233 [1,1,0,0,0,0|1,0,0]=3 3217 B7R0.10 C#CC(=O)[C@H](N)CC Amb35594876 [1,1,0,0,0,0|1,0,0]=3 3218 B7R0.10 C#CC(O)C(N)CC Amb35624529 [1,1,0,0,0,0|1,0,1]=4 3219 B7R0.10 C#CC(O)[C@@H](N)CC Amb35601345 [1,1,0,0,0,0|1,0,1]=4 3220 B7R0.10 C#CC(O)[C@H](N)CC Amb29849607 [1,1,0,0,0,0|1,0,1]=4 3221 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [1,1,0,0,0,0|2,0,0]=4 3222 B7R0.10 C=C(CC)C(=O)CO Amb27486129 [1,1,0,0,0,0|1,0,1]=4 3223 B7R0.10 C=C(CC)C(=O)OC Amb24469857 [1,1,0,0,0,0|1,0,1]=4 3224 B7R0.10 C=C(CO)C(=O)OC Amb17933844 [1,1,0,0,0,0|1,0,1]=4 3225 B7R0.10 C=C(CO)C(O)CO Amb28345461 [1,1,0,0,0,0|2,0,0]=4 3226 B7R0.10 C=CC(=O)C(C)CC Amb26350444 [1,1,0,0,0,0|2,0,0]=4 3227 B7R0.10 C=CC(=O)C(N)CC Amb27593564 [1,1,0,0,0,0|1,0,0]=3 3228 B7R0.10 C=CC(=O)[C@@H](N)CC Amb35601235 [1,1,0,0,0,0|1,0,0]=3 3229 B7R0.10 C=CC(=O)[C@H](N)CC Amb35594877 [1,1,0,0,0,0|1,0,0]=3 3230 B7R0.10 C=CC(Cl)C(O)CC Amb27482691 [1,1,0,0,0,0|2,0,0]=4 3231 B7R0.10 C=CC(F)C(O)CO Amb28185130 [1,1,0,0,0,0|2,0,0]=4 3232 B7R0.10 C=CC(N)C(C)CC Amb28132556 [1,1,0,0,0,0|2,0,0]=4 3233 B7R0.10 C=CC(O)C(O)CCl Amb27635214 [1,1,0,0,0,0|2,0,0]=4 3234 B7R0.10 C=CC(O)C(O)CN Amb18641921 [1,1,0,0,0,0|2,0,0]=4 3235 B7R0.10 C=CC(O)[C@@H](N)CC Amb35601262 [1,1,0,0,0,0|1,0,1]=4 3236 B7R0.10 C=CC(O)[C@@H](N)CO Amb27786767 [1,1,0,0,0,0|0,0,2]=4 3237 B7R0.10 C=CC(O)[C@H](N)CC Amb35659376 [1,1,0,0,0,0|1,0,1]=4 3238 B7R0.10 C=C[C@@H](C)[C@H](C)C=O Amb27947475 [1,1,0,0,0,0|2,0,0]=4 3239 B7R0.10 C=C[C@@H](C)[C@H](O)CC Amb28280923 [1,1,0,0,0,0|2,0,0]=4 3240 B7R0.10 C=C[C@@H](O)[C@@H](N)CO Amb24120616 [1,1,0,0,0,0|0,0,2]=4 3241 B7R0.10 C=C[C@@H](O)[C@@H](O)CO Amb26498961 [1,1,0,0,0,0|2,0,0]=4 3242 B7R0.10 C=C[C@@H](O)[C@H](N)CO Amb27188717 [1,1,0,0,0,0|0,0,2]=4 3243 B7R0.10 C=C[C@@H](O)[C@H](O)CC Amb28429693 [1,1,0,0,0,0|2,0,0]=4 3244 B7R0.10 C=C[C@H](C)[C@H](C)C=O Amb27631138 [1,1,0,0,0,0|2,0,0]=4 3245 B7R0.10 C=C[C@H](N)[C@H](C)CO Amb27881737 [1,1,0,0,0,0|1,0,0]=3 3246 B7R0.10 C=C[C@H](O)[C@@H](O)CN Amb27838832 [1,1,0,0,0,0|2,0,0]=4 3247 B7R0.10 C=C[C@H](O)[C@H](N)CC Amb27430452 [1,1,0,0,0,0|1,0,1]=4 3248 B7R0.10 C=C[C@H](O)[C@H](O)CO Amb27665226 [1,1,0,0,0,0|2,0,0]=4 3249 B7R0.10 CC(C#N)C(O)C=O Amb28239484 [1,1,0,0,0,0|2,0,0]=4 3250 B7R0.10 CC(C=O)C(C)CO Amb28048946 [1,1,0,0,0,0|1,0,0]=3 3251 B7R0.10 CC(C=O)C(O)CCl Amb27776790 [1,1,0,0,0,0|1,0,0]=3 3252 B7R0.10 CC(CN)C(=O)NO Amb27756001 [1,1,0,0,0,0|2,0,0]=4 3253 B7R0.10 CC(CN)C(O)C=O Amb26370126 [1,1,0,0,0,0|2,0,0]=4 3254 B7R0.10 CC(CO)C(=O)NN Amb28048504 [1,1,0,0,0,0|2,0,0]=4 3255 B7R0.10 CC(CO)[C@@H](N)CO Amb27627408 [1,1,0,0,0,0|0,0,1]=3 3256 B7R0.10 CC(CO)[C@H](O)CO Amb27207438 [1,1,0,0,0,0|1,0,1]=4 3257 B7R0.10 CCC(=O)C(=O)CO Amb28316184 [1,1,0,0,0,0|1,0,1]=4 3258 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [1,1,0,0,0,0|1,0,1]=4 3259 B7R0.10 CCC(=O)C(C)CC Amb22229845 [1,1,0,0,0,0|2,0,0]=4 3260 B7R0.10 CCC(=O)C(Cl)CC Amb17593422 [1,1,0,0,0,0|2,0,0]=4 3261 B7R0.10 CCC(=O)C(F)CC Amb28048919 [1,1,0,0,0,0|2,0,0]=4 3262 B7R0.10 CCC(=O)C(O)CC Amb2721046 [1,1,0,0,0,0|2,0,0]=4 3263 B7R0.10 CCC(=O)C(O)CO Amb28074689 [1,1,0,0,0,0|2,0,0]=4 3264 B7R0.10 CCC(=O)N(N)CC Amb33191316 [1,1,0,0,0,0|2,0,0]=4 3265 B7R0.10 CCC(=O)[C@@H](N)CC Amb35601236 [1,1,0,0,0,0|1,0,0]=3 3266 B7R0.10 CCC(=O)[C@H](C)CC Amb27835595 [1,1,0,0,0,0|2,0,0]=4 3267 B7R0.10 CCC(=O)[C@H](N)CC Amb35594878 [1,1,0,0,0,0|1,0,0]=3 3268 B7R0.10 CCC(Br)C(=O)NC Amb18181033 [1,1,0,0,0,0|2,0,0]=4 3269 B7R0.10 CCC(Br)C(=O)OC Amb1157544 [1,1,0,0,0,0|1,0,0]=3 3270 B7R0.10 CCC(C)C(=N)OC Amb20623203 [1,1,0,0,0,0|2,0,0]=4 3271 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [1,1,0,0,0,0|2,0,0]=4 3272 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [1,1,0,0,0,0|2,0,0]=4 3273 B7R0.10 CCC(C)C(=O)CN Amb26871505 [1,1,0,0,0,0|2,0,0]=4 3274 B7R0.10 CCC(C)C(=O)CO Amb24680373 [1,1,0,0,0,0|1,0,0]=3 3275 B7R0.10 CCC(C)C(=O)NN Amb9706124 [1,1,0,0,0,0|2,0,0]=4 3276 B7R0.10 CCC(C)C(=O)NO Amb6275767 [1,1,0,0,0,0|1,0,0]=3 3277 B7R0.10 CCC(C)C(C)C=O Amb18641810 [1,1,0,0,0,0|2,0,0]=4 3278 B7R0.10 CCC(C)C(N)C=O Amb27257596 [1,1,0,0,0,0|1,0,0]=3 3279 B7R0.10 CCC(C)C(N)CO Amb19267092 [1,1,0,0,0,0|1,0,1]=4 3280 B7R0.10 CCC(C)C(N)CO Amb8385507 [1,1,0,0,0,0|1,0,1]=4 3281 B7R0.10 CCC(C)C(O)C=O Amb28454245 [1,1,0,0,0,0|1,0,1]=4 3282 B7R0.10 CCC(C)[C@@H](N)CO Amb18015117 [1,1,0,0,0,0|1,0,1]=4 3283 B7R0.10 CCC(C)[C@H](N)CO Amb5785530 [1,1,0,0,0,0|1,0,1]=4 3284 B7R0.10 CCC(C)\C(C)=N\O Amb28124153 [1,1,0,0,0,0|2,0,0]=4 3285 B7R0.10 CCC(C)\C(Cl)=N\O Amb27654809 [1,1,0,0,0,0|2,0,0]=4 3286 B7R0.10 CCC(C)\C(N)=N\O Amb19516921 [1,1,0,0,0,0|2,0,0]=4 3287 B7R0.10 CCC(C)\C(N)=N\O Amb22586630 [1,1,0,0,0,0|2,0,0]=4 3288 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [1,1,0,0,0,0|1,0,0]=3 3289 B7R0.10 CCC(F)C(N)CO Amb28421837 [1,1,0,0,0,0|1,0,1]=4 3290 B7R0.10 CCC(N)C(=O)NC Amb33552054 [1,1,0,0,0,0|1,0,0]=3 3291 B7R0.10 CCC(N)C(=O)NC Amb9514096 [1,1,0,0,0,0|1,0,0]=3 3292 B7R0.10 CCC(N)C(=O)NN Amb18061942 [1,1,0,0,0,0|1,0,0]=3 3293 B7R0.10 CCC(N)C(=O)NO Amb21922881 [1,1,0,0,0,0|0,0,0]=2 3294 B7R0.10 CCC(N)C(=O)OC Amb17601372 [1,1,0,0,0,0|0,0,0]=2 3295 B7R0.10 CCC(N)C(=O)OC Amb9271765 [1,1,0,0,0,0|0,0,0]=2 3296 B7R0.10 CCC(N)C(O)CC Amb32663160 [1,1,0,0,0,0|1,0,1]=4 3297 B7R0.10 CCC(N)C(O)CC Amb33551344 [1,1,0,0,0,0|1,0,1]=4 3298 B7R0.10 CCC(N)\C(N)=N\O Amb26605280 [1,1,0,0,0,0|1,0,0]=3 3299 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [1,1,0,0,0,0|1,0,1]=4 3300 B7R0.10 CCC(O)C(=O)CO Amb28316154 [1,1,0,0,0,0|1,0,0]=3 3301 B7R0.10 CCC(O)C(=O)NC Amb27403520 [1,1,0,0,0,0|2,0,0]=4 3302 B7R0.10 CCC(O)C(=O)OC Amb4019849 [1,1,0,0,0,0|1,0,0]=3 3303 B7R0.10 CCC(O)C(C)C=O Amb17593201 [1,1,0,0,0,0|1,0,0]=3 3304 B7R0.10 CCC(O)C(C)CO Amb24461954 [1,1,0,0,0,0|1,0,1]=4 3305 B7R0.10 CCC(O)[C@H](N)CC Amb35602699 [1,1,0,0,0,0|1,0,1]=4 3306 B7R0.10 CCC(O)\C(C)=N\O Amb28140362 [1,1,0,0,0,0|2,0,0]=4 3307 B7R0.10 CCC(O)\C(N)=N\O Amb27165466 [1,1,0,0,0,0|1,0,1]=4 3308 B7R0.10 CCC(S)C(=O)OC Amb26860434 [1,1,0,0,0,0|1,0,0]=3 3309 B7R0.10 CCN(C)C(=O)CO Amb9421550 [1,1,0,0,0,0|2,0,0]=4 3310 B7R0.10 CCN(C)C(=O)NO Amb32657190 [1,1,0,0,0,0|2,0,0]=4 3311 B7R0.10 CCN(N)C(=O)OC Amb33191318 [1,1,0,0,0,0|1,0,0]=3 3312 B7R0.10 CC[C@@H](Br)C(=O)OC Amb27607617 [1,1,0,0,0,0|1,0,0]=3 3313 B7R0.10 CC[C@@H](C)[C@@H](C)C=O Amb28184530 [1,1,0,0,0,0|2,0,0]=4 3314 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb17678825 [1,1,0,0,0,0|1,0,1]=4 3315 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb33871568 [1,1,0,0,0,0|1,0,1]=4 3316 B7R0.10 CC[C@@H](C)[C@H](N)CO Amb25081749 [1,1,0,0,0,0|1,0,1]=4 3317 B7R0.10 CC[C@@H](N)C(=O)NC Amb27655585 [1,1,0,0,0,0|1,0,0]=3 3318 B7R0.10 CC[C@@H](N)C(=O)NO Amb27602079 [1,1,0,0,0,0|0,0,0]=2 3319 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [1,1,0,0,0,0|0,0,0]=2 3320 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [1,1,0,0,0,0|0,0,0]=2 3321 B7R0.10 CC[C@@H](N)C(C)OC Amb28141408 [1,1,0,0,0,0|1,0,1]=4 3322 B7R0.10 CC[C@@H](O)[C@@H](N)CO Amb25131931 [1,1,0,0,0,0|0,0,1]=3 3323 B7R0.10 CC[C@@H](O)[C@H](C)NO Amb28197538 [1,1,0,0,0,0|2,0,0]=4 3324 B7R0.10 CC[C@H](C)C(=O)NC Amb27403795 [1,1,0,0,0,0|2,0,0]=4 3325 B7R0.10 CC[C@H](C)C(=O)OC Amb28145887 [1,1,0,0,0,0|1,0,0]=3 3326 B7R0.10 CC[C@H](C)[C@@H](N)CO Amb27966960 [1,1,0,0,0,0|1,0,1]=4 3327 B7R0.10 CC[C@H](C)[C@H](N)C=O Amb28247667 [1,1,0,0,0,0|1,0,0]=3 3328 B7R0.10 CC[C@H](C)[C@H](N)CO Amb2785297 [1,1,0,0,0,0|1,0,1]=4 3329 B7R0.10 CC[C@H](C)[C@H](N)CO Amb30867664 [1,1,0,0,0,0|1,0,1]=4 3330 B7R0.10 CC[C@H](N)C(=O)NN Amb27186616 [1,1,0,0,0,0|1,0,0]=3 3331 B7R0.10 CC[C@H](N)C(=O)NO Amb27869261 [1,1,0,0,0,0|0,0,0]=2 3332 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [1,1,0,0,0,0|0,0,0]=2 3333 B7R0.10 CC[C@H](N)C(=O)OC Amb27391053 [1,1,0,0,0,0|0,0,0]=2 3334 B7R0.10 CC[C@H](O)C(=O)CO Amb27433137 [1,1,0,0,0,0|1,0,0]=3 3335 B7R0.10 CC[C@H](O)C(=O)OC Amb26318042 [1,1,0,0,0,0|1,0,0]=3 3336 B7R0.10 CNC(=O)C(N)CO Amb18641958 [1,1,0,0,0,0|1,0,0]=3 3337 B7R0.10 CNC(=O)C(O)CO Amb27838377 [1,1,0,0,0,0|2,0,0]=4 3338 B7R0.10 CNC(=O)[C@H](N)CO Amb28140756 [1,1,0,0,0,0|1,0,0]=3 3339 B7R0.10 CNC(C)C(=O)NO Amb27207236 [1,1,0,0,0,0|2,0,0]=4 3340 B7R0.10 CNC(C)C(=O)OC Amb18299580 [1,1,0,0,0,0|2,0,0]=4 3341 B7R0.10 CNC(C)C(=O)OC Amb21961535 [1,1,0,0,0,0|2,0,0]=4 3342 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [1,1,0,0,0,0|2,0,0]=4 3343 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [1,1,0,0,0,0|2,0,0]=4 3344 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [1,1,0,0,0,0|2,0,0]=4 3345 B7R0.10 CN[C@H](C)C(=O)OC Amb34153346 [1,1,0,0,0,0|2,0,0]=4 3346 B7R0.10 COC(=O)C(Br)CBr Amb6366470 [1,1,0,0,0,0|2,0,0]=4 3347 B7R0.10 COC(=O)C(Br)CF Amb10605572 [1,1,0,0,0,0|2,0,0]=4 3348 B7R0.10 COC(=O)C(Br)CN Amb27764797 [1,1,0,0,0,0|2,0,0]=4 3349 B7R0.10 COC(=O)C(Br)CO Amb22491520 [1,1,0,0,0,0|1,0,0]=3 3350 B7R0.10 COC(=O)C(Br)OC Amb21964964 [1,1,0,0,0,0|2,0,0]=4 3351 B7R0.10 COC(=O)C(Br)SC Amb27484075 [1,1,0,0,0,0|2,0,0]=4 3352 B7R0.10 COC(=O)C(C)CBr Amb23440928 [1,1,0,0,0,0|2,0,0]=4 3353 B7R0.10 COC(=O)C(C)CCl Amb25890022 [1,1,0,0,0,0|2,0,0]=4 3354 B7R0.10 COC(=O)C(C)CF Amb27205725 [1,1,0,0,0,0|2,0,0]=4 3355 B7R0.10 COC(=O)C(C)CN Amb13952562 [1,1,0,0,0,0|2,0,0]=4 3356 B7R0.10 COC(=O)C(C)CN Amb9400287 [1,1,0,0,0,0|2,0,0]=4 3357 B7R0.10 COC(=O)C(C)CO Amb9277786 [1,1,0,0,0,0|1,0,0]=3 3358 B7R0.10 COC(=O)C(C)CS Amb17673607 [1,1,0,0,0,0|1,1,0]=4 3359 B7R0.10 COC(=O)C(C)NO Amb28249757 [1,1,0,0,0,0|2,0,0]=4 3360 B7R0.10 COC(=O)C(C)SC Amb22043309 [1,1,0,0,0,0|2,0,0]=4 3361 B7R0.10 COC(=O)C(Cl)CBr Amb28285211 [1,1,0,0,0,0|2,0,0]=4 3362 B7R0.10 COC(=O)C(Cl)CCl Amb8513901 [1,1,0,0,0,0|2,0,0]=4 3363 B7R0.10 COC(=O)C(Cl)CN Amb27838384 [1,1,0,0,0,0|2,0,0]=4 3364 B7R0.10 COC(=O)C(Cl)CO Amb10605503 [1,1,0,0,0,0|1,0,0]=3 3365 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [1,1,0,0,0,0|2,0,0]=4 3366 B7R0.10 COC(=O)C(F)CCl Amb22735421 [1,1,0,0,0,0|2,0,0]=4 3367 B7R0.10 COC(=O)C(F)CN Amb25241379 [1,1,0,0,0,0|2,0,0]=4 3368 B7R0.10 COC(=O)C(F)CN Amb32661040 [1,1,0,0,0,0|2,0,0]=4 3369 B7R0.10 COC(=O)C(F)CO Amb22235114 [1,1,0,0,0,0|1,0,0]=3 3370 B7R0.10 COC(=O)C(N)C#N Amb23437075 [1,1,0,0,0,0|1,0,1]=4 3371 B7R0.10 COC(=O)C(N)CCl Amb1019565 [1,1,0,0,0,0|1,0,0]=3 3372 B7R0.10 COC(=O)C(N)CCl Amb10601654 [1,1,0,0,0,0|1,0,0]=3 3373 B7R0.10 COC(=O)C(N)CF Amb24482199 [1,1,0,0,0,0|1,0,0]=3 3374 B7R0.10 COC(=O)C(N)CF Amb28934912 [1,1,0,0,0,0|1,0,0]=3 3375 B7R0.10 COC(=O)C(N)CO Amb22489451 [1,1,0,0,0,0|0,0,0]=2 3376 B7R0.10 COC(=O)C(N)CO Amb2720272 [1,1,0,0,0,0|0,0,0]=2 3377 B7R0.10 COC(=O)C(N)CO Amb9785055 [1,1,0,0,0,0|0,0,0]=2 3378 B7R0.10 COC(=O)C(N)CS Amb2780965 [1,1,0,0,0,0|0,1,0]=3 3379 B7R0.10 COC(=O)C(N)CS Amb381226 [1,1,0,0,0,0|0,1,0]=3 3380 B7R0.10 COC(=O)C(O)CCl Amb22261563 [1,1,0,0,0,0|2,0,0]=4 3381 B7R0.10 COC(=O)C(O)CF Amb25734186 [1,1,0,0,0,0|2,0,0]=4 3382 B7R0.10 COC(=O)C(O)CN Amb22058759 [1,1,0,0,0,0|2,0,0]=4 3383 B7R0.10 COC(=O)C(O)CN Amb31194251 [1,1,0,0,0,0|2,0,0]=4 3384 B7R0.10 COC(=O)C(O)CO Amb28435920 [1,1,0,0,0,0|1,0,0]=3 3385 B7R0.10 COC(=O)C(O)CS Amb28138641 [1,1,0,0,0,0|1,1,0]=4 3386 B7R0.10 COC(=O)C(O)OC Amb17593224 [1,1,0,0,0,0|2,0,0]=4 3387 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [1,1,0,0,0,0|2,0,0]=4 3388 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [1,1,0,0,0,0|2,0,0]=4 3389 B7R0.10 COC(=O)[C@@H](C)CN Amb27391189 [1,1,0,0,0,0|2,0,0]=4 3390 B7R0.10 COC(=O)[C@@H](C)CN Amb35788514 [1,1,0,0,0,0|2,0,0]=4 3391 B7R0.10 COC(=O)[C@@H](C)CO Amb17615445 [1,1,0,0,0,0|1,0,0]=3 3392 B7R0.10 COC(=O)[C@@H](C)OC Amb27218042 [1,1,0,0,0,0|2,0,0]=4 3393 B7R0.10 COC(=O)[C@@H](F)CN Amb24505312 [1,1,0,0,0,0|2,0,0]=4 3394 B7R0.10 COC(=O)[C@@H](F)CN Amb30585108 [1,1,0,0,0,0|2,0,0]=4 3395 B7R0.10 COC(=O)[C@@H](N)CCl Amb10608842 [1,1,0,0,0,0|1,0,0]=3 3396 B7R0.10 COC(=O)[C@@H](N)CN Amb27412388 [1,1,0,0,0,0|1,0,0]=3 3397 B7R0.10 COC(=O)[C@@H](N)CN Amb9134529 [1,1,0,0,0,0|1,0,0]=3 3398 B7R0.10 COC(=O)[C@@H](N)CO Amb3941539 [1,1,0,0,0,0|0,0,0]=2 3399 B7R0.10 COC(=O)[C@@H](N)CO Amb8513312 [1,1,0,0,0,0|0,0,0]=2 3400 B7R0.10 COC(=O)[C@@H](N)CS Amb3940711 [1,1,0,0,0,0|0,1,0]=3 3401 B7R0.10 COC(=O)[C@@H](N)CS Amb6297280 [1,1,0,0,0,0|0,1,0]=3 3402 B7R0.10 COC(=O)[C@@H](O)CCl Amb27216387 [1,1,0,0,0,0|2,0,0]=4 3403 B7R0.10 COC(=O)[C@@H](O)CN Amb24670217 [1,1,0,0,0,0|2,0,0]=4 3404 B7R0.10 COC(=O)[C@@H](O)CN Amb28934854 [1,1,0,0,0,0|2,0,0]=4 3405 B7R0.10 COC(=O)[C@@H](O)CO Amb22226736 [1,1,0,0,0,0|1,0,0]=3 3406 B7R0.10 COC(=O)[C@H](C)CBr Amb10844721 [1,1,0,0,0,0|2,0,0]=4 3407 B7R0.10 COC(=O)[C@H](C)CO Amb17615446 [1,1,0,0,0,0|1,0,0]=3 3408 B7R0.10 COC(=O)[C@H](C)OC Amb28316057 [1,1,0,0,0,0|2,0,0]=4 3409 B7R0.10 COC(=O)[C@H](F)CN Amb28140777 [1,1,0,0,0,0|2,0,0]=4 3410 B7R0.10 COC(=O)[C@H](N)CCl Amb10601655 [1,1,0,0,0,0|1,0,0]=3 3411 B7R0.10 COC(=O)[C@H](N)CF Amb24351631 [1,1,0,0,0,0|1,0,0]=3 3412 B7R0.10 COC(=O)[C@H](N)CO Amb3939987 [1,1,0,0,0,0|0,0,0]=2 3413 B7R0.10 COC(=O)[C@H](N)CO Amb8390418 [1,1,0,0,0,0|0,0,0]=2 3414 B7R0.10 COC(=O)[C@H](N)CS Amb27630611 [1,1,0,0,0,0|0,1,0]=3 3415 B7R0.10 COC(=O)[C@H](N)CS Amb33763763 [1,1,0,0,0,0|0,1,0]=3 3416 B7R0.10 COC(=O)[C@H](O)CN Amb24073731 [1,1,0,0,0,0|2,0,0]=4 3417 B7R0.10 COC(=O)[C@H](O)CO Amb8471066 [1,1,0,0,0,0|1,0,0]=3 3418 B7R0.10 COC(=O)\C(N)=N\O Amb22741276 [1,1,0,0,0,0|1,0,1]=4 3419 B7R0.10 COC(C)C(=O)C=O Amb27622168 [1,1,0,0,0,0|1,0,1]=4 3420 B7R0.10 COC(C)C(Br)C=O Amb28119865 [1,1,0,0,0,0|1,0,0]=3 3421 B7R0.10 COC(C)C(C)CO Amb26508350 [1,1,0,0,0,0|1,0,1]=4 3422 B7R0.10 COC(C)C(C)NO Amb28288269 [1,1,0,0,0,0|2,0,0]=4 3423 B7R0.10 COC(C)C(N)CN Amb28141371 [1,1,0,0,0,0|1,0,1]=4 3424 B7R0.10 COC(C)[C@@H](C)CO Amb33746684 [1,1,0,0,0,0|1,0,1]=4 3425 B7R0.10 COC(C)[C@H](C)CO Amb33738170 [1,1,0,0,0,0|1,0,1]=4 3426 B7R0.10 COC(C)\C(N)=N\O Amb19650787 [1,1,0,0,0,0|1,0,1]=4 3427 B7R0.10 CO[C@H](C)[C@H](N)CBr Amb32723117 [1,1,0,0,0,0|1,0,1]=4 3428 B7R0.10 CO[C@H](C)[C@H](N)CCl Amb32723116 [1,1,0,0,0,0|1,0,1]=4 3429 B7R0.10 CO[C@H](C)[C@H](N)CN Amb32723114 [1,1,0,0,0,0|1,0,1]=4 3430 B7R0.10 CO[C@H](C)[C@H](N)CO Amb25221786 [1,1,0,0,0,0|0,0,1]=3 3431 B7R0.10 C[C@@H](CO)[C@@H](N)CO Amb27758321 [1,1,0,0,0,0|0,0,1]=3 3432 B7R0.10 C[C@@H](CO)[C@H](N)CO Amb27628042 [1,1,0,0,0,0|0,0,1]=3 3433 B7R0.10 C[C@@H](CO)[C@H](O)CO Amb28400332 [1,1,0,0,0,0|1,0,1]=4 3434 B7R0.10 C\C(=C/O)C(O)CO Amb27441465 [1,1,0,0,0,0|1,0,1]=4 3435 B7R0.10 C\C=C(/N)C(=O)OC Amb27438851 [1,1,0,0,0,0|0,0,2]=4 3436 B7R0.10 NC(CCl)C(=O)NO Amb6740291 [1,1,0,0,0,0|1,0,0]=3 3437 B7R0.10 NC(CO)C(=O)NO Amb22352399 [1,1,0,0,0,0|0,0,0]=2 3438 B7R0.10 NC(CO)C(O)CO Amb30884396 [1,1,0,0,0,0|0,0,1]=3 3439 B7R0.10 NCC(O)C(O)CO Amb25775606 [1,1,0,0,0,0|1,0,1]=4 3440 B7R0.10 NC[C@@H](O)[C@@H](O)CO Amb27956175 [1,1,0,0,0,0|1,0,1]=4 3441 B7R0.10 NC[C@@H](O)[C@H](N)CO Amb27167034 [1,1,0,0,0,0|0,0,1]=3 3442 B7R0.10 NC[C@H](O)[C@@H](O)CO Amb27473421 [1,1,0,0,0,0|1,0,1]=4 3443 B7R0.10 NC[C@H](O)[C@H](N)CO Amb27174481 [1,1,0,0,0,0|0,0,1]=3 3444 B7R0.10 NNC(=O)C(N)CO Amb26845977 [1,1,0,0,0,0|1,0,0]=3 3445 B7R0.10 NNC(=O)C(N)CO Amb8393226 [1,1,0,0,0,0|1,0,0]=3 3446 B7R0.10 NNC(=O)[C@@H](N)CO Amb26446598 [1,1,0,0,0,0|1,0,0]=3 3447 B7R0.10 NNC(=O)[C@@H](N)CS Amb16231457 [1,1,0,0,0,0|1,1,0]=4 3448 B7R0.10 NNC(=O)[C@H](N)CO Amb27849893 [1,1,0,0,0,0|1,0,0]=3 3449 B7R0.10 N[C@@H](CCl)C(=O)NO Amb22747830 [1,1,0,0,0,0|1,0,0]=3 3450 B7R0.10 N[C@@H](CCl)[C@H](O)CCl Amb27459767 [1,1,0,0,0,0|1,0,1]=4 3451 B7R0.10 N[C@@H](CO)C(=O)NO Amb28203960 [1,1,0,0,0,0|0,0,0]=2 3452 B7R0.10 N[C@@H](CO)C(=O)OCl Amb27838316 [1,1,0,0,0,0|0,0,0]=2 3453 B7R0.10 N[C@@H](CO)[C@@H](N)CO Amb28398616 [1,1,0,0,0,0|1,0,1]=4 3454 B7R0.10 N[C@@H](CO)[C@H](O)CO Amb27592540 [1,1,0,0,0,0|0,0,1]=3 3455 B7R0.10 N[C@H](CCl)C(=O)NO Amb28040834 [1,1,0,0,0,0|1,0,0]=3 3456 B7R0.10 N[C@H](CO)[C@@H](N)CO Amb27874012 [1,1,0,0,0,0|1,0,1]=4 3457 B7R0.10 N[C@H](CO)[C@@H](O)CO Amb28245425 [1,1,0,0,0,0|0,0,1]=3 3458 B7R0.10 N[C@H](CO)[C@H](N)CO Amb25976799 [1,1,0,0,0,0|1,0,1]=4 3459 B7R0.10 O=C(CO)C(=O)CO Amb28049023 [1,1,0,0,0,0|1,0,1]=4 3460 B7R0.10 O=C(CO)C(O)CO Amb27955920 [1,1,0,0,0,0|1,0,0]=3 3461 B7R0.10 O=C(CO)[C@H](O)CO Amb24628483 [1,1,0,0,0,0|1,0,0]=3 3462 B7R0.10 O=CC(=O)[C@@H](O)CO Amb28247115 [1,1,0,0,0,0|1,0,1]=4 3463 B7R0.10 O=CC(=O)[C@H](O)CO Amb27210862 [1,1,0,0,0,0|1,0,1]=4 3464 B7R0.10 O=CC(O)C(O)C=O Amb26319267 [1,1,0,0,0,0|1,0,1]=4 3465 B7R0.10 O=CC(O)C(O)CO Amb8513487 [1,1,0,0,0,0|1,0,0]=3 3466 B7R0.10 O=C[C@@H](O)[C@@H](O)CO Amb25839823 [1,1,0,0,0,0|1,0,0]=3 3467 B7R0.10 O=C[C@H](O)[C@@H](O)CO Amb24481533 [1,1,0,0,0,0|1,0,0]=3 3468 B7R0.10 O=C[C@H](O)[C@H](O)CO Amb9825398 [1,1,0,0,0,0|1,0,0]=3 3469 B7R0.10 OCC(F)C(O)CF Amb27594740 [1,1,0,0,0,0|1,0,1]=4 3470 B7R0.10 OCC(O)C(O)CO Amb2687705 [1,1,0,0,0,0|1,0,1]=4 3471 B7R0.10 OCC(O)C(O)CS Amb27857963 [1,1,0,0,0,0|1,0,1]=4 3472 B7R0.10 OCC(O)C(S)CO Amb28285221 [1,1,0,0,0,0|1,0,1]=4 3473 B7R0.10 OCC(O)[C@H](O)CO Amb27981952 [1,1,0,0,0,0|1,0,1]=4 3474 B7R0.10 OC[C@@H](O)[C@H](O)CO Amb20242423 [1,1,0,0,0,0|1,0,1]=4 3475 B7R0.10 OC[C@H](O)[C@H](F)CO Amb28207169 [1,1,0,0,0,0|1,0,1]=4 3476 B7R0.10 OC[C@H](O)[C@H](O)CO Amb33523573 [1,1,0,0,0,0|1,0,1]=4 3477 B7R0.13 C#CC(C)(N)C(=O)O Amb23504061 [1,1,0,0,0,0|0,0,2]=4 3478 B7R0.13 C#C[C@](C)(N)C(=O)O Amb24406693 [1,1,0,0,0,0|0,0,2]=4 3479 B7R0.13 C=C(C)C(C)(N)CO Amb33199514 [1,1,0,0,0,0|2,0,0]=4 3480 B7R0.13 C=CC(C)(N)C(=O)O Amb18641826 [1,1,0,0,0,0|0,0,2]=4 3481 B7R0.13 C=C[C@@](C)(N)C(=O)O Amb25970753 [1,1,0,0,0,0|0,0,2]=4 3482 B7R0.13 C=C[C@@](C)(O)[C@H](C)O Amb28065272 [1,1,0,0,0,0|2,0,0]=4 3483 B7R0.13 C=C[C@](C)(O)[C@H](C)O Amb27485874 [1,1,0,0,0,0|2,0,0]=4 3484 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [1,1,0,0,0,0|2,0,0]=4 3485 B7R0.13 CC(=O)C(C)(O)CO Amb27471773 [1,1,0,0,0,0|2,0,0]=4 3486 B7R0.13 CC(=O)C(Cl)(Cl)CO Amb24601361 [1,1,0,0,0,0|2,0,0]=4 3487 B7R0.13 CC(=O)C(F)(F)CO Amb25724409 [1,1,0,0,0,0|2,0,0]=4 3488 B7R0.13 CC(=O)[C@](C)(O)CO Amb28195327 [1,1,0,0,0,0|2,0,0]=4 3489 B7R0.13 CC(Br)(CBr)C(=O)O Amb9703187 [1,1,0,0,0,0|2,0,0]=4 3490 B7R0.13 CC(Br)(CCl)C(=O)O Amb28282621 [1,1,0,0,0,0|2,0,0]=4 3491 B7R0.13 CC(Br)(CO)C(N)=O Amb27657597 [1,1,0,0,0,0|2,0,0]=4 3492 B7R0.13 CC(C)(CBr)C(=O)O Amb2613668 [1,1,0,0,0,0|2,0,0]=4 3493 B7R0.13 CC(C)(CCl)C(=O)O Amb3940361 [1,1,0,0,0,0|2,0,0]=4 3494 B7R0.13 CC(C)(CF)C(=O)O Amb22000679 [1,1,0,0,0,0|2,0,0]=4 3495 B7R0.13 CC(C)(CN)C(=O)O Amb22371031 [1,1,0,0,0,0|2,0,0]=4 3496 B7R0.13 CC(C)(CN)C(=O)O Amb8396020 [1,1,0,0,0,0|2,0,0]=4 3497 B7R0.13 CC(C)(CO)C(=O)O Amb2613656 [1,1,0,0,0,0|1,0,0]=3 3498 B7R0.13 CC(C)C(C)(C)C=O Amb18641812 [1,1,0,0,0,0|2,0,0]=4 3499 B7R0.13 CC(C)C(C)(N)CO Amb18286211 [1,1,0,0,0,0|1,0,1]=4 3500 B7R0.13 CC(C)C(C)(N)CO Amb33552488 [1,1,0,0,0,0|1,0,1]=4 3501 B7R0.13 CC(C)[C@@](C)(N)CO Amb22503794 [1,1,0,0,0,0|1,0,1]=4 3502 B7R0.13 CC(C)[C@](C)(N)CO Amb22503795 [1,1,0,0,0,0|1,0,1]=4 3503 B7R0.13 CC(Cl)C(C)(Cl)C=O Amb27482498 [1,1,0,0,0,0|2,0,0]=4 3504 B7R0.13 CC(F)(CBr)C(=O)O Amb28121309 [1,1,0,0,0,0|2,0,0]=4 3505 B7R0.13 CC(F)(CN)C(=O)O Amb27794896 [1,1,0,0,0,0|2,0,0]=4 3506 B7R0.13 CC(N)(CF)C(=O)O Amb27435532 [1,1,0,0,0,0|1,0,0]=3 3507 B7R0.13 CC(N)(CN)C(=O)O Amb25310586 [1,1,0,0,0,0|1,0,0]=3 3508 B7R0.13 CC(N)(CN)C(=O)O Amb33550422 [1,1,0,0,0,0|1,0,0]=3 3509 B7R0.13 CC(N)(CO)C(=O)O Amb2780027 [1,1,0,0,0,0|0,0,0]=2 3510 B7R0.13 CC(N)(CO)C(=O)O Amb28934875 [1,1,0,0,0,0|0,0,0]=2 3511 B7R0.13 CC(N)(CO)C(N)=O Amb28381837 [1,1,0,0,0,0|1,0,0]=3 3512 B7R0.13 CC(N)(CS)C(=O)O Amb18124446 [1,1,0,0,0,0|0,1,0]=3 3513 B7R0.13 CC(N)(CS)C(=O)O Amb24480151 [1,1,0,0,0,0|0,1,0]=3 3514 B7R0.13 CC(O)(CBr)C(=O)O Amb18522184 [1,1,0,0,0,0|2,0,0]=4 3515 B7R0.13 CC(O)(CCl)C(=O)O Amb26497884 [1,1,0,0,0,0|2,0,0]=4 3516 B7R0.13 CC(O)(CO)C(=O)O Amb33544570 [1,1,0,0,0,0|1,0,0]=3 3517 B7R0.13 CC(O)C(C)(C)CO Amb4016409 [1,1,0,0,0,0|1,0,1]=4 3518 B7R0.13 CC(O)C(C)(O)CO Amb24642681 [1,1,0,0,0,0|1,0,1]=4 3519 B7R0.13 CCC(C)(Br)C(=O)O Amb22228657 [1,1,0,0,0,0|1,0,0]=3 3520 B7R0.13 CCC(C)(C)C(=O)Cl Amb8394880 [1,1,0,0,0,0|2,0,0]=4 3521 B7R0.13 CCC(C)(C)C(=O)O Amb4605833 [1,1,0,0,0,0|1,0,0]=3 3522 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [1,1,0,0,0,0|1,1,0]=4 3523 B7R0.13 CCC(C)(C)C(C)=O Amb2687561 [1,1,0,0,0,0|2,0,0]=4 3524 B7R0.13 CCC(C)(C)C(N)=O Amb3886539 [1,1,0,0,0,0|2,0,0]=4 3525 B7R0.13 CCC(C)(Cl)C(=O)O Amb25730682 [1,1,0,0,0,0|1,0,0]=3 3526 B7R0.13 CCC(C)(Cl)C(N)=O Amb28075797 [1,1,0,0,0,0|2,0,0]=4 3527 B7R0.13 CCC(C)(N)C(=O)O Amb28934789 [1,1,0,0,0,0|0,0,0]=2 3528 B7R0.13 CCC(C)(N)C(=O)O Amb9728371 [1,1,0,0,0,0|0,0,0]=2 3529 B7R0.13 CCC(C)(N)C(N)=O Amb13952193 [1,1,0,0,0,0|1,0,0]=3 3530 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [1,1,0,0,0,0|1,0,0]=3 3531 B7R0.13 CCC(C)(O)C(=O)Cl Amb28042052 [1,1,0,0,0,0|2,0,0]=4 3532 B7R0.13 CCC(C)(O)C(=O)O Amb2609046 [1,1,0,0,0,0|1,0,0]=3 3533 B7R0.13 CCC(C)(O)C(C)=O Amb17593200 [1,1,0,0,0,0|2,0,0]=4 3534 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [1,1,0,0,0,0|2,0,0]=4 3535 B7R0.13 CCC(Cl)(Cl)C(=O)O Amb25274946 [1,1,0,0,0,0|1,0,0]=3 3536 B7R0.13 CCC(F)(F)C(=O)O Amb10982488 [1,1,0,0,0,0|1,0,0]=3 3537 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [1,1,0,0,0,0|2,0,0]=4 3538 B7R0.13 CCC(N)(S)C(=O)O Amb27229859 [1,1,0,0,0,0|0,0,0]=2 3539 B7R0.13 CCC(O)(O)C(=O)O Amb28428544 [1,1,0,0,0,0|1,0,0]=3 3540 B7R0.13 CC[C@@](C)(Cl)C(=O)O Amb27391076 [1,1,0,0,0,0|1,0,0]=3 3541 B7R0.13 CC[C@@](C)(N)C(=O)O Amb8515205 [1,1,0,0,0,0|0,0,0]=2 3542 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [1,1,0,0,0,0|2,0,0]=4 3543 B7R0.13 CC[C@](C)(N)C(=O)O Amb16183896 [1,1,0,0,0,0|0,0,0]=2 3544 B7R0.13 CC[C@](C)(N)C(=O)O Amb33871585 [1,1,0,0,0,0|0,0,0]=2 3545 B7R0.13 CC[C@](C)(N)C(N)=O Amb27838327 [1,1,0,0,0,0|1,0,0]=3 3546 B7R0.13 CC[C@](C)(O)C(C)=O Amb27860292 [1,1,0,0,0,0|2,0,0]=4 3547 B7R0.13 CC[C@](C)(O)C(N)=O Amb27258058 [1,1,0,0,0,0|2,0,0]=4 3548 B7R0.13 CC[C@](N)(O)C(=O)O Amb28398612 [1,1,0,0,0,0|0,0,0]=2 3549 B7R0.13 CNC(C)(C)C(=O)O Amb30625191 [1,1,0,0,0,0|2,0,0]=4 3550 B7R0.13 CNC(C)(C)C(=O)O Amb4037017 [1,1,0,0,0,0|2,0,0]=4 3551 B7R0.13 COC(C)(C)C(=O)O Amb7089070 [1,1,0,0,0,0|2,0,0]=4 3552 B7R0.13 CSC(C)(C)C(=O)O Amb17501488 [1,1,0,0,0,0|2,0,0]=4 3553 B7R0.13 CSC(Cl)(Cl)C(=O)O Amb27835442 [1,1,0,0,0,0|2,0,0]=4 3554 B7R0.13 CSC(F)(F)C(=O)O Amb23586472 [1,1,0,0,0,0|2,0,0]=4 3555 B7R0.13 C[C@@H](O)C(C)(C)CO Amb27981959 [1,1,0,0,0,0|1,0,1]=4 3556 B7R0.13 C[C@@H](O)[C@](C)(O)CO Amb27211282 [1,1,0,0,0,0|1,0,1]=4 3557 B7R0.13 C[C@@](F)(CN)C(=O)O Amb27880722 [1,1,0,0,0,0|2,0,0]=4 3558 B7R0.13 C[C@@](N)(CO)C(=O)O Amb8515082 [1,1,0,0,0,0|0,0,0]=2 3559 B7R0.13 C[C@@](N)(CS)C(=O)O Amb16183893 [1,1,0,0,0,0|0,1,0]=3 3560 B7R0.13 C[C@@](N)(CS)C(=O)O Amb22757501 [1,1,0,0,0,0|0,1,0]=3 3561 B7R0.13 C[C@@](N)(CS)C(N)=O Amb27843429 [1,1,0,0,0,0|1,1,0]=4 3562 B7R0.13 C[C@@](O)(CBr)C(=O)O Amb17610012 [1,1,0,0,0,0|2,0,0]=4 3563 B7R0.13 C[C@H](O)C(C)(C)CO Amb28065990 [1,1,0,0,0,0|1,0,1]=4 3564 B7R0.13 C[C@H](O)[C@](C)(N)CO Amb27595667 [1,1,0,0,0,0|0,0,1]=3 3565 B7R0.13 C[C@](N)(CN)C(=O)O Amb25690446 [1,1,0,0,0,0|1,0,0]=3 3566 B7R0.13 C[C@](N)(CO)C(=O)O Amb8515081 [1,1,0,0,0,0|0,0,0]=2 3567 B7R0.13 C[C@](O)(CBr)C(=O)O Amb22224875 [1,1,0,0,0,0|2,0,0]=4 3568 B7R0.13 C[C@](O)(CN)C(=O)O Amb27440648 [1,1,0,0,0,0|2,0,0]=4 3569 B7R0.13 C[C@](S)(CN)C(=O)O Amb27489167 [1,1,0,0,0,0|2,0,0]=4 3570 B7R0.13 NC(N)(CS)C(=O)O Amb24746383 [1,1,0,0,0,0|0,1,0]=3 3571 B7R0.13 NCC(F)(F)C(=O)O Amb19888004 [1,1,0,0,0,0|2,0,0]=4 3572 B7R0.13 NCC(F)(F)C(=O)O Amb2697603 [1,1,0,0,0,0|2,0,0]=4 3573 B7R0.13 O=C(O)C(Cl)(Cl)CCl Amb22731239 [1,1,0,0,0,0|2,0,0]=4 3574 B7R0.13 O=C(O)C(Cl)(Cl)CO Amb27409099 [1,1,0,0,0,0|1,0,0]=3 3575 B7R0.13 O=C(O)C(F)(Cl)CBr Amb27830396 [1,1,0,0,0,0|2,0,0]=4 3576 B7R0.13 O=C(O)C(F)(F)CBr Amb27455617 [1,1,0,0,0,0|2,0,0]=4 3577 B7R0.13 O=C(O)C(F)(F)CF Amb25711017 [1,1,0,0,0,0|2,0,0]=4 3578 B7R0.13 O=C(O)C(F)(F)CO Amb17593305 [1,1,0,0,0,0|1,0,0]=3 3579 B7R0.13 O=C(O)C(F)(F)CS Amb33171136 [1,1,0,0,0,0|1,1,0]=4 3580 B7R0.14 C=CC(C)C(C)(C)O Amb4035893 [1,1,0,0,0,0|2,0,0]=4 3581 B7R0.14 C=CC(N)C(C)(C)C Amb27185754 [1,1,0,0,0,0|2,0,0]=4 3582 B7R0.14 C=CC(N)P(C)(=O)O Amb27430241 [1,1,0,0,0,0|2,0,0]=4 3583 B7R0.14 C=C[C@H](N)C(C)(C)C Amb27233974 [1,1,0,0,0,0|2,0,0]=4 3584 B7R0.14 CC(C)(C)C(Br)C=O Amb18127551 [1,1,0,0,0,0|2,0,0]=4 3585 B7R0.14 CC(C)(C)C(Cl)C=O Amb17593424 [1,1,0,0,0,0|2,0,0]=4 3586 B7R0.14 CC(C)(C)C(N)CO Amb19338133 [1,1,0,0,0,0|1,0,1]=4 3587 B7R0.14 CC(C)(C)C(N)CO Amb8993281 [1,1,0,0,0,0|1,0,1]=4 3588 B7R0.14 CC(C)(C)[C@@H](Cl)C=O Amb27398016 [1,1,0,0,0,0|2,0,0]=4 3589 B7R0.14 CC(C)(C)[C@@H](F)C=O Amb28054345 [1,1,0,0,0,0|2,0,0]=4 3590 B7R0.14 CC(C)(C)[C@@H](N)CO Amb3429352 [1,1,0,0,0,0|1,0,1]=4 3591 B7R0.14 CC(C)(C)[C@@H](O)C=O Amb28351621 [1,1,0,0,0,0|2,0,0]=4 3592 B7R0.14 CC(C)(C)[C@H](Cl)C=O Amb28046166 [1,1,0,0,0,0|2,0,0]=4 3593 B7R0.14 CC(C)(C)[C@H](N)CO Amb3939824 [1,1,0,0,0,0|1,0,1]=4 3594 B7R0.14 CC(C)(F)C(N)CO Amb25075200 [1,1,0,0,0,0|1,0,1]=4 3595 B7R0.14 CC(C)(F)[C@@H](N)CO Amb27235628 [1,1,0,0,0,0|1,0,1]=4 3596 B7R0.14 CC(C)(F)[C@H](N)CO Amb26481190 [1,1,0,0,0,0|1,0,1]=4 3597 B7R0.14 CC(C)(O)C(Cl)CO Amb20620744 [1,1,0,0,0,0|1,0,1]=4 3598 B7R0.14 CC(C)(O)C(N)C#N Amb27856015 [1,1,0,0,0,0|1,0,1]=4 3599 B7R0.14 CC(C)(O)[C@@H](N)CO Amb28187036 [1,1,0,0,0,0|0,0,1]=3 3600 B7R0.14 CC(C)(O)[C@H](O)CO Amb28280907 [1,1,0,0,0,0|1,0,1]=4 3601 B7R0.14 CC(C)(S)C(N)CO Amb28422064 [1,1,0,0,0,0|0,1,1]=4 3602 B7R0.14 CC(C=O)C(C)(C)C Amb10558535 [1,1,0,0,0,0|2,0,0]=4 3603 B7R0.14 CC(C=O)C(C)(C)F Amb24694360 [1,1,0,0,0,0|2,0,0]=4 3604 B7R0.14 CC(C=O)C(C)(C)O Amb28255749 [1,1,0,0,0,0|1,0,0]=3 3605 B7R0.14 CC(C=O)C(C)(F)F Amb25026843 [1,1,0,0,0,0|2,0,0]=4 3606 B7R0.14 CC(CO)C(C)(C)O Amb28343216 [1,1,0,0,0,0|1,0,1]=4 3607 B7R0.14 CC(F)(F)C(N)CO Amb25207871 [1,1,0,0,0,0|1,0,1]=4 3608 B7R0.14 CC(F)(F)[C@@H](N)CO Amb32809824 [1,1,0,0,0,0|1,0,1]=4 3609 B7R0.14 CC(F)(F)[C@H](N)CO Amb32810145 [1,1,0,0,0,0|1,0,1]=4 3610 B7R0.14 CCC(C)S(=O)(=O)O Amb22372234 [1,1,0,0,0,0|2,0,0]=4 3611 B7R0.14 CCC(Cl)P(=O)(O)O Amb27657245 [1,1,0,0,0,0|2,0,0]=4 3612 B7R0.14 CCC(N)C(C)(C)O Amb18198391 [1,1,0,0,0,0|1,0,1]=4 3613 B7R0.14 CCC(N)C(C)(C)O Amb28934865 [1,1,0,0,0,0|1,0,1]=4 3614 B7R0.14 CCC(N)P(C)(=O)O Amb27390481 [1,1,0,0,0,0|1,0,0]=3 3615 B7R0.14 CCC(O)P(=O)(O)O Amb24354457 [1,1,0,0,0,0|2,0,0]=4 3616 B7R0.14 CCC(O)S(=O)(=O)O Amb35753165 [1,1,0,0,0,0|2,0,0]=4 3617 B7R0.14 CC[C@@H](N)P(=O)(O)O Amb8516010 [1,1,0,0,0,0|1,0,0]=3 3618 B7R0.14 CC[C@H](N)P(=O)(O)O Amb8517200 [1,1,0,0,0,0|1,0,0]=3 3619 B7R0.14 CP(=O)(O)C(N)CO Amb25809584 [1,1,0,0,0,0|1,0,0]=3 3620 B7R0.14 C[C@@H](CO)C(C)(C)O Amb22737257 [1,1,0,0,0,0|1,0,1]=4 3621 B7R0.14 C[C@H](CO)C(C)(C)O Amb27480759 [1,1,0,0,0,0|1,0,1]=4 3622 B7R0.14 NC(CCl)P(=O)(O)O Amb27410198 [1,1,0,0,0,0|2,0,0]=4 3623 B7R0.14 NC(CO)P(O)(O)=S Amb27967305 [1,1,0,0,0,0|1,0,1]=4 3624 B7R0.14 NCC(N)P(=O)(O)O Amb27839530 [1,1,0,0,0,0|2,0,0]=4 3625 B7R0.14 N[C@H](CCl)P(=O)(O)O Amb27590220 [1,1,0,0,0,0|2,0,0]=4 3626 B7R0.15 C=C(C)C(CC)NC Amb27400414 [1,1,0,0,0,0|2,0,0]=4 3627 B7R0.15 C=C(C)C(CC)NN Amb28316204 [1,1,0,0,0,0|2,0,0]=4 3628 B7R0.15 C=C(C)C(CN)CO Amb33199604 [1,1,0,0,0,0|2,0,0]=4 3629 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [1,1,0,0,0,0|1,0,0]=3 3630 B7R0.15 C=CC(CC)C(C)=O Amb28315864 [1,1,0,0,0,0|2,0,0]=4 3631 B7R0.15 C=CC(CN)C(C)C Amb28315826 [1,1,0,0,0,0|2,0,0]=4 3632 B7R0.15 C=CC(NC)C(C)C Amb27873670 [1,1,0,0,0,0|2,0,0]=4 3633 B7R0.15 C=CC(NN)C(C)C Amb27656552 [1,1,0,0,0,0|2,0,0]=4 3634 B7R0.15 C=C[C@H](OC)[C@H](C)O Amb27198025 [1,1,0,0,0,0|2,0,0]=4 3635 B7R0.15 CC(=O)C(CN)CN Amb28206451 [1,1,0,0,0,0|2,0,0]=4 3636 B7R0.15 CC(=O)C(CO)CO Amb22904340 [1,1,0,0,0,0|2,0,0]=4 3637 B7R0.15 CC(C)C(C#N)C=O Amb26316466 [1,1,0,0,0,0|1,0,1]=4 3638 B7R0.15 CC(C)C(CN)CO Amb22304811 [1,1,0,0,0,0|1,0,1]=4 3639 B7R0.15 CC(C)C(CO)ON Amb25175780 [1,1,0,0,0,0|1,0,1]=4 3640 B7R0.15 CC(C)C(CO)ON Amb32662750 [1,1,0,0,0,0|1,0,1]=4 3641 B7R0.15 CC(C)\C(C=O)=C\N Amb25338102 [1,1,0,0,0,0|1,0,1]=4 3642 B7R0.15 CC(O)C(CO)CO Amb34916641 [1,1,0,0,0,0|1,0,1]=4 3643 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [1,1,0,0,0,0|0,0,1]=3 3644 B7R0.15 CCC(C#N)C(C)=O Amb9535904 [1,1,0,0,0,0|1,0,1]=4 3645 B7R0.15 CCC(C#N)C(N)=O Amb27797961 [1,1,0,0,0,0|1,0,1]=4 3646 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [1,1,0,0,0,0|1,0,0]=3 3647 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [1,1,0,0,0,0|2,0,0]=4 3648 B7R0.15 CCC(CC)C(=O)O Amb4605826 [1,1,0,0,0,0|1,0,0]=3 3649 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [1,1,0,0,0,0|1,0,1]=4 3650 B7R0.15 CCC(CC)C(C)=O Amb33536259 [1,1,0,0,0,0|2,0,0]=4 3651 B7R0.15 CCC(CC)C(N)=O Amb33550498 [1,1,0,0,0,0|2,0,0]=4 3652 B7R0.15 CCC(CCl)C(=O)Cl Amb28421936 [1,1,0,0,0,0|2,0,0]=4 3653 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [1,1,0,0,0,0|1,0,0]=3 3654 B7R0.15 CCC(CF)C(=O)O Amb27625346 [1,1,0,0,0,0|1,0,0]=3 3655 B7R0.15 CCC(CN)C(=O)O Amb18987934 [1,1,0,0,0,0|0,0,0]=2 3656 B7R0.15 CCC(CN)C(=O)O Amb19514932 [1,1,0,0,0,0|0,0,0]=2 3657 B7R0.15 CCC(CN)C(C)O Amb27985476 [1,1,0,0,0,0|1,0,1]=4 3658 B7R0.15 CCC(CN)C(N)=O Amb18294192 [1,1,0,0,0,0|1,0,0]=3 3659 B7R0.15 CCC(CO)C(=O)O Amb18641947 [1,1,0,0,0,0|1,0,0]=3 3660 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [1,1,0,0,0,0|1,0,1]=4 3661 B7R0.15 CCC(CO)C(C)O Amb28048986 [1,1,0,0,0,0|1,0,1]=4 3662 B7R0.15 CCC(CO)C(N)=O Amb28314312 [1,1,0,0,0,0|2,0,0]=4 3663 B7R0.15 CCC(NC)C(=O)O Amb10610245 [1,1,0,0,0,0|0,0,0]=2 3664 B7R0.15 CCC(NC)C(=O)O Amb9619833 [1,1,0,0,0,0|0,0,0]=2 3665 B7R0.15 CCC(NC)C(C)=O Amb28049011 [1,1,0,0,0,0|1,0,0]=3 3666 B7R0.15 CCC(NC)C(C)O Amb27253936 [1,1,0,0,0,0|1,0,1]=4 3667 B7R0.15 CCC(NC)C(N)=O Amb15701261 [1,1,0,0,0,0|1,0,0]=3 3668 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [1,1,0,0,0,0|0,0,0]=2 3669 B7R0.15 CCC(NN)C(=O)O Amb18641955 [1,1,0,0,0,0|0,0,0]=2 3670 B7R0.15 CCC(NO)C(=O)O Amb4019788 [1,1,0,0,0,0|0,0,0]=2 3671 B7R0.15 CCC(OC)C(=O)O Amb8472685 [1,1,0,0,0,0|1,0,0]=3 3672 B7R0.15 CCC(OC)C(C)=O Amb26004835 [1,1,0,0,0,0|2,0,0]=4 3673 B7R0.15 CCC(OC)C(N)=O Amb2027289 [1,1,0,0,0,0|2,0,0]=4 3674 B7R0.15 CCC(SC)C(=O)O Amb17501348 [1,1,0,0,0,0|1,0,0]=3 3675 B7R0.15 CCC(SC)C(C)=O Amb28460748 [1,1,0,0,0,0|2,0,0]=4 3676 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [1,1,0,0,0,0|0,0,0]=2 3677 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [1,1,0,0,0,0|1,0,0]=3 3678 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [1,1,0,0,0,0|0,0,0]=2 3679 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [1,1,0,0,0,0|0,0,0]=2 3680 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [1,1,0,0,0,0|1,0,0]=3 3681 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [1,1,0,0,0,0|0,0,0]=2 3682 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [1,1,0,0,0,0|0,0,0]=2 3683 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [1,1,0,0,0,0|0,0,0]=2 3684 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [1,1,0,0,0,0|2,0,0]=4 3685 B7R0.15 CNC(C#N)C(C)O Amb35647154 [1,1,0,0,0,0|1,0,1]=4 3686 B7R0.15 CNC(C=O)C(C)C Amb18641852 [1,1,0,0,0,0|1,0,0]=3 3687 B7R0.15 CNC(CN)C(=O)O Amb23515020 [1,1,0,0,0,0|1,0,0]=3 3688 B7R0.15 CNC(CN)C(=O)O Amb28934876 [1,1,0,0,0,0|1,0,0]=3 3689 B7R0.15 CNC(CO)C(=O)O Amb26068513 [1,1,0,0,0,0|0,0,0]=2 3690 B7R0.15 CNC(CO)C(C)C Amb18291223 [1,1,0,0,0,0|1,0,1]=4 3691 B7R0.15 CNC(CO)C(C)O Amb27794828 [1,1,0,0,0,0|0,0,1]=3 3692 B7R0.15 CNC(CO)C(N)=O Amb18641957 [1,1,0,0,0,0|1,0,0]=3 3693 B7R0.15 CNC(CS)C(=O)O Amb2781760 [1,1,0,0,0,0|0,1,0]=3 3694 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [1,1,0,0,0,0|0,0,0]=2 3695 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [1,1,0,0,0,0|1,0,0]=3 3696 B7R0.15 CN[C@@H](CO)C(C)C Amb28286878 [1,1,0,0,0,0|1,0,1]=4 3697 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [1,1,0,0,0,0|0,1,0]=3 3698 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [1,1,0,0,0,0|0,1,0]=3 3699 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [1,1,0,0,0,0|0,0,0]=2 3700 B7R0.15 CN[C@H](CO)[C@@H](C)O Amb27239292 [1,1,0,0,0,0|0,0,1]=3 3701 B7R0.15 CN\C(CO)=C(\C)O Amb25210013 [1,1,0,0,0,0|1,0,1]=4 3702 B7R0.15 COC(C=O)C(C)C Amb18641891 [1,1,0,0,0,0|2,0,0]=4 3703 B7R0.15 COC(CN)C(=O)O Amb22059584 [1,1,0,0,0,0|1,0,0]=3 3704 B7R0.15 COC(CN)C(=O)O Amb24271092 [1,1,0,0,0,0|1,0,0]=3 3705 B7R0.15 COC(OC)C(=O)O Amb26446254 [1,1,0,0,0,0|2,0,0]=4 3706 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [1,1,0,0,0,0|1,0,0]=3 3707 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [1,1,0,0,0,0|1,0,0]=3 3708 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [1,1,0,0,0,0|1,0,0]=3 3709 B7R0.15 CSC(C=O)C(=O)O Amb27399075 [1,1,0,0,0,0|2,0,0]=4 3710 B7R0.15 CSC(C=O)C(C)C Amb18641605 [1,1,0,0,0,0|2,0,0]=4 3711 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [1,1,0,0,0,0|2,0,0]=4 3712 B7R0.15 CSC(CN)C(=O)O Amb28346880 [1,1,0,0,0,0|1,0,0]=3 3713 B7R0.15 CSC(SC)C(=O)O Amb28245282 [1,1,0,0,0,0|2,0,0]=4 3714 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [1,1,0,0,0,0|1,0,1]=4 3715 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [1,1,0,0,0,0|1,0,1]=4 3716 B7R0.15 C\N=C(/NC)C(=O)O Amb28349086 [1,1,0,0,0,0|1,0,1]=4 3717 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [1,1,0,0,0,0|0,0,1]=3 3718 B7R0.15 NCC(CF)C(=O)O Amb26995116 [1,1,0,0,0,0|1,0,0]=3 3719 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [1,1,0,0,0,0|0,0,0]=2 3720 B7R0.15 NNC(CO)C(=O)O Amb27595622 [1,1,0,0,0,0|0,0,0]=2 3721 B7R0.15 NNC(CS)C(=O)O Amb24117863 [1,1,0,0,0,0|0,1,0]=3 3722 B7R0.15 NNC(CS)C(=O)O Amb27834344 [1,1,0,0,0,0|0,1,0]=3 3723 B7R0.15 NOC(CO)C(=O)O Amb27173883 [1,1,0,0,0,0|0,0,0]=2 3724 B7R0.15 O=C(O)C(CBr)CBr Amb2778682 [1,1,0,0,0,0|2,0,0]=4 3725 B7R0.15 O=C(O)C(CI)CI Amb17779784 [1,1,0,0,0,0|2,0,0]=4 3726 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [1,1,0,0,0,0|0,0,0]=2 3727 B7R0.15 O=C(O)C(CS)CS Amb26600542 [1,1,0,0,0,0|1,1,0]=4 3728 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [1,1,0,0,0,0|0,1,0]=3 3729 B9R0.10 CC(=O)\C=C(\N)C(C)(C)O Amb27788212 [0,1,0,0,0,1|1,0,1]=4 3730 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,1,0,0,0,1|1,0,0]=3 3731 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,1,0,0,0,1|1,0,0]=3 3732 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,1,0,0,0,1|2,0,0]=4 3733 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,1,0,0,0,1|2,0,0]=4 3734 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,1,0,0,0,1|1,0,0]=3 3735 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,1,0,0,0,1|1,0,0]=3 3736 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,1,0,0,0,1|2,0,0]=4 3737 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,1,0,0,0,1|1,0,0]=3 3738 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,1,0,0,0,1|2,0,0]=4 3739 B9R0.10 CC(C)(C)\C(N)=C\C(=O)O Amb28313951 [0,1,0,0,0,1|1,0,1]=4 3740 B9R0.10 CC(C)(F)C(N)CC(=O)O Amb33273018 [0,1,0,0,0,1|1,0,0]=3 3741 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,1,0,0,0,1|2,0,0]=4 3742 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,1,0,0,0,1|2,0,0]=4 3743 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,1,0,0,0,1|2,0,0]=4 3744 B9R0.10 CC(C)(S)C(N)CC(=O)O Amb28182470 [0,1,0,0,0,1|0,1,0]=3 3745 B9R0.10 CC(C)(S)C(N)C[PH](=O)O Amb27792834 [0,1,0,0,0,1|1,1,0]=4 3746 B9R0.10 CC(C)CC(N)P(=O)(O)O Amb564159 [0,1,0,0,0,1|2,0,0]=4 3747 B9R0.10 CC(C)CC(N)S(=O)(=O)O Amb24390196 [0,1,0,0,0,1|2,0,0]=4 3748 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O Amb25992755 [0,1,0,0,0,1|2,0,0]=4 3749 B9R0.10 CC(C)C[C@H](N)P(=O)(O)O Amb25889931 [0,1,0,0,0,1|2,0,0]=4 3750 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,1,0,0,0,1|2,0,0]=4 3751 B9R0.10 CC(CC(=O)O)C(C)(C)F Amb27633286 [0,1,0,0,0,1|2,0,0]=4 3752 B9R0.10 CC(CC(=O)O)C(C)(C)N Amb19651352 [0,1,0,0,0,1|2,0,0]=4 3753 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,1,0,0,0,1|1,0,0]=3 3754 B9R0.10 CC(F)(F)C(N)CC(=O)O Amb32810091 [0,1,0,0,0,1|1,0,0]=3 3755 B9R0.10 CC(F)(F)C(O)CC(=O)O Amb32809827 [0,1,0,0,0,1|2,0,0]=4 3756 B9R0.10 CC(F)(F)[C@@H](O)CC(=O)O Amb33482321 [0,1,0,0,0,1|2,0,0]=4 3757 B9R0.10 CC(F)(F)[C@H](O)CC(=O)O Amb32809834 [0,1,0,0,0,1|2,0,0]=4 3758 B9R0.10 CP(=O)(O)C(N)CC(=O)O Amb27831332 [0,1,0,0,0,1|1,0,0]=3 3759 B9R0.10 CP(=O)(O)C(N)CC(N)=O Amb27615069 [0,1,0,0,0,1|2,0,0]=4 3760 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,1,0,0,0,1|2,0,0]=4 3761 B9R0.10 NC(CC(=O)O)C(F)(F)Cl Amb27483984 [0,1,0,0,0,1|2,0,0]=4 3762 B9R0.10 NC(CC(=O)O)C(F)(F)F Amb1091770 [0,1,0,0,0,1|2,0,0]=4 3763 B9R0.10 N[C@@H](CC(=O)O)C(F)(F)F Amb22388421 [0,1,0,0,0,1|2,0,0]=4 3764 B9R0.10 N[C@H](CC(=O)O)C(F)(F)F Amb20670844 [0,1,0,0,0,1|2,0,0]=4 3765 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb22641962 [0,1,0,0,0,1|1,0,1]=4 3766 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb31307620 [0,1,0,0,0,1|1,0,1]=4 3767 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,1,0,0,0,1|1,0,1]=4 3768 B9R0.11 CC(=O)NC(C)(N)C(=O)O Amb27881127 [0,1,0,0,0,1|0,0,2]=4 3769 B9R0.11 CC(C)C(C)(C)CC(=O)O Amb18124695 [0,1,0,0,0,1|2,0,0]=4 3770 B9R0.11 CC(C)C(C)(N)CC(=O)O Amb25934755 [0,1,0,0,0,1|1,0,0]=3 3771 B9R0.11 CC(C)C(C)(N)CC(N)=O Amb32787537 [0,1,0,0,0,1|2,0,0]=4 3772 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,1,0,0,0,1|2,0,0]=4 3773 B9R0.11 CC(C)C(F)(F)CC(=O)O Amb26991653 [0,1,0,0,0,1|2,0,0]=4 3774 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,1,0,0,0,1|2,0,0]=4 3775 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,1,0,0,0,1|2,0,0]=4 3776 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,1,0,0,0,1|1,0,0]=3 3777 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,1,0,0,0,1|2,0,0]=4 3778 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,1,0,0,0,1|2,0,0]=4 3779 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,1,0,0,0,1|2,0,0]=4 3780 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,1,0,0,0,1|1,0,0]=3 3781 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,1,0,0,0,1|1,0,0]=3 3782 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,1,0,0,0,1|2,0,0]=4 3783 B9R0.11 CC(C)OC(C)(C)C(=O)O Amb18976739 [0,1,0,0,0,1|2,0,0]=4 3784 B9R0.11 CC(C)SC(C)(C)C(=O)O Amb17501486 [0,1,0,0,0,1|2,0,0]=4 3785 B9R0.11 CC(C)[C@@](C)(N)CC(=O)O Amb27185746 [0,1,0,0,0,1|1,0,0]=3 3786 B9R0.11 CC(C)[C@](C)(N)CC(=O)O Amb28346262 [0,1,0,0,0,1|1,0,0]=3 3787 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,1,0,0,0,1|2,0,0]=4 3788 B9R0.11 CC(N)(CC(=O)O)C(=O)O Amb10807406 [0,1,0,0,0,1|1,0,1]=4 3789 B9R0.11 CC(N)(CC(=O)O)C(F)F Amb32787868 [0,1,0,0,0,1|2,0,0]=4 3790 B9R0.11 CC(N)(CC(=O)O)C(F)F Amb35788392 [0,1,0,0,0,1|2,0,0]=4 3791 B9R0.11 CC(N)(CC(=O)O)[PH](=O)O Amb25701546 [0,1,0,0,0,1|2,0,0]=4 3792 B9R0.11 CC(N)C(C)(C)CC(=O)O Amb26440704 [0,1,0,0,0,1|2,0,0]=4 3793 B9R0.11 CC(N)C(C)(N)CC(=O)O Amb33255266 [0,1,0,0,0,1|1,0,0]=3 3794 B9R0.11 CC(N)C(C)(N)CC(N)=O Amb33254064 [0,1,0,0,0,1|2,0,0]=4 3795 B9R0.11 CC(N)CC(C)(C)C(=O)O Amb27881524 [0,1,0,0,0,1|2,0,0]=4 3796 B9R0.11 CC(O)CC(C)(N)C(=O)O Amb28289237 [0,1,0,0,0,1|0,0,0]=2 3797 B9R0.11 CC(O)CC(C)(N)C(N)=O Amb35725166 [0,1,0,0,0,1|1,0,0]=3 3798 B9R0.11 CC(S)CC(C)(C)C(=O)O Amb35675430 [0,1,0,0,0,1|1,1,0]=4 3799 B9R0.11 CN(C)CC(C)(N)C(=O)O Amb18294465 [0,1,0,0,0,1|2,0,0]=4 3800 B9R0.11 CN(O)C(C)(C)CC(=O)O Amb30025601 [0,1,0,0,0,1|2,0,0]=4 3801 B9R0.11 CN(O)CC(C)(O)C(=O)O Amb28349124 [0,1,0,0,0,1|2,0,0]=4 3802 B9R0.11 CN(O)CC(F)(F)C(=O)O Amb33169729 [0,1,0,0,0,1|2,0,0]=4 3803 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O Amb10601663 [0,1,0,0,0,1|1,0,1]=4 3804 B9R0.23 C#CC(=O)[C@@H](N)CC(C)C Amb35617479 [0,1,0,0,0,1|2,0,0]=4 3805 B9R0.23 C#CC(=O)[C@H](N)CC(C)C Amb35737491 [0,1,0,0,0,1|2,0,0]=4 3806 B9R0.23 C=C(C)CC(N)C(=O)OC Amb26654974 [0,1,0,0,0,1|1,0,1]=4 3807 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,1,0,0,0,1|1,0,1]=4 3808 B9R0.23 C=CC(=O)C(N)CC(C)C Amb28348598 [0,1,0,0,0,1|2,0,0]=4 3809 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,1,0,0,0,1|2,0,0]=4 3810 B9R0.23 CC(=O)NC(C)C(O)CO Amb35660314 [0,1,0,0,0,1|2,0,0]=4 3811 B9R0.23 CC(C)CC(N)C(=O)NN Amb18559331 [0,1,0,0,0,1|2,0,0]=4 3812 B9R0.23 CC(C)CC(N)C(=O)NO Amb27264492 [0,1,0,0,0,1|1,0,0]=3 3813 B9R0.23 CC(C)C[C@@H](N)C(=O)NN Amb27768739 [0,1,0,0,0,1|2,0,0]=4 3814 B9R0.23 CC(C)C[C@H](N)C(=O)CCl Amb27646024 [0,1,0,0,0,1|2,0,0]=4 3815 B9R0.23 CC(C)C[C@H](N)C(=O)CCl Amb33788832 [0,1,0,0,0,1|2,0,0]=4 3816 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,1,0,0,0,1|1,0,0]=3 3817 B9R0.23 CC(C=O)C(C)CC(=O)O Amb27838156 [0,1,0,0,0,1|1,0,1]=4 3818 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,1,0,0,0,1|2,0,0]=4 3819 B9R0.23 CC(CO)C(C)NC(N)=O Amb28351735 [0,1,0,0,0,1|2,0,0]=4 3820 B9R0.23 CC(NC(N)=O)C(O)CO Amb35660192 [0,1,0,0,0,1|2,0,0]=4 3821 B9R0.23 CC(O)CC(C)C(=O)NN Amb27666364 [0,1,0,0,0,1|2,0,0]=4 3822 B9R0.23 CC(O)CC(O)C(O)C=O Amb25713186 [0,1,0,0,0,1|1,0,1]=4 3823 B9R0.23 CCC(=O)C(N)CC(C)C Amb18202462 [0,1,0,0,0,1|2,0,0]=4 3824 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,1,0,0,0,1|2,0,0]=4 3825 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,1,0,0,0,1|1,0,0]=3 3826 B9R0.23 CCC(C)C(N)CC(N)=O Amb25312995 [0,1,0,0,0,1|2,0,0]=4 3827 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,1,0,0,0,1|2,0,0]=4 3828 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,1,0,0,0,1|1,0,0]=3 3829 B9R0.23 CCC(C)[C@@H](N)CC(N)=O Amb25823252 [0,1,0,0,0,1|2,0,0]=4 3830 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,1,0,0,0,1|2,0,0]=4 3831 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,1,0,0,0,1|1,0,0]=3 3832 B9R0.23 CCC(C)[C@H](N)CC(N)=O Amb28050389 [0,1,0,0,0,1|2,0,0]=4 3833 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,1,0,0,0,1|2,0,0]=4 3834 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,1,0,0,0,1|1,0,0]=3 3835 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,1,0,0,0,1|1,0,0]=3 3836 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,1,0,0,0,1|1,0,0]=3 3837 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,1,0,0,0,1|1,0,0]=3 3838 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,1,0,0,0,1|1,0,0]=3 3839 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,1,0,0,0,1|1,0,0]=3 3840 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,1,0,0,0,1|0,0,0]=2 3841 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,1,0,0,0,1|0,0,2]=4 3842 B9R0.23 CNC(=O)C(N)CC(C)C Amb7969680 [0,1,0,0,0,1|2,0,0]=4 3843 B9R0.23 CNC(=O)C(N)CC(C)C Amb9724493 [0,1,0,0,0,1|2,0,0]=4 3844 B9R0.23 CNC(=O)[C@@H](N)CC(C)C Amb17231992 [0,1,0,0,0,1|2,0,0]=4 3845 B9R0.23 CNC(=O)[C@H](N)CC(C)C Amb18035928 [0,1,0,0,0,1|2,0,0]=4 3846 B9R0.23 COC(=O)C(Br)CC(C)C Amb22490955 [0,1,0,0,0,1|2,0,0]=4 3847 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,1,0,0,0,1|2,0,0]=4 3848 B9R0.23 COC(=O)C(Cl)CC(C)C Amb18800856 [0,1,0,0,0,1|2,0,0]=4 3849 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,1,0,0,0,1|0,0,2]=4 3850 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,1,0,0,0,1|0,0,2]=4 3851 B9R0.23 COC(=O)C(N)CC(C)C Amb1152419 [0,1,0,0,0,1|1,0,0]=3 3852 B9R0.23 COC(=O)C(N)CC(C)C Amb22489476 [0,1,0,0,0,1|1,0,0]=3 3853 B9R0.23 COC(=O)C(N)CC(C)C Amb932819 [0,1,0,0,0,1|1,0,0]=3 3854 B9R0.23 COC(=O)C(N)CC(C)O Amb33065512 [0,1,0,0,0,1|0,0,0]=2 3855 B9R0.23 COC(=O)C(N)CC(Cl)Cl Amb28121067 [0,1,0,0,0,1|2,0,0]=4 3856 B9R0.23 COC(=O)C(N)CC(F)F Amb22059458 [0,1,0,0,0,1|2,0,0]=4 3857 B9R0.23 COC(=O)C(N)CC(F)F Amb32693476 [0,1,0,0,0,1|2,0,0]=4 3858 B9R0.23 COC(=O)C(N)CN(C)C Amb24715537 [0,1,0,0,0,1|2,0,0]=4 3859 B9R0.23 COC(=O)C(N)CN(C)C Amb28555446 [0,1,0,0,0,1|2,0,0]=4 3860 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,1,0,0,0,1|2,0,0]=4 3861 B9R0.23 COC(=O)N(C)C[C@@H](C)O Amb28456472 [0,1,0,0,0,1|2,0,0]=4 3862 B9R0.23 COC(=O)N(C)C[C@H](C)O Amb27873990 [0,1,0,0,0,1|2,0,0]=4 3863 B9R0.23 COC(=O)[C@@H](Br)CC(C)C Amb27400688 [0,1,0,0,0,1|2,0,0]=4 3864 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,1,0,0,0,1|0,0,2]=4 3865 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,1,0,0,0,1|0,0,2]=4 3866 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb533935 [0,1,0,0,0,1|1,0,0]=3 3867 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb8513236 [0,1,0,0,0,1|1,0,0]=3 3868 B9R0.23 COC(=O)[C@@H](N)CC(Cl)Cl Amb27444622 [0,1,0,0,0,1|2,0,0]=4 3869 B9R0.23 COC(=O)[C@@H](N)CC(F)F Amb28187129 [0,1,0,0,0,1|2,0,0]=4 3870 B9R0.23 COC(=O)[C@@H](N)CN(C)C Amb31295179 [0,1,0,0,0,1|2,0,0]=4 3871 B9R0.23 COC(=O)[C@H](Br)CC(C)C Amb27796257 [0,1,0,0,0,1|2,0,0]=4 3872 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,1,0,0,0,1|2,0,0]=4 3873 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,1,0,0,0,1|0,0,2]=4 3874 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb2719741 [0,1,0,0,0,1|1,0,0]=3 3875 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb3941143 [0,1,0,0,0,1|1,0,0]=3 3876 B9R0.23 COC(=O)[C@H](N)CC(F)F Amb33482999 [0,1,0,0,0,1|2,0,0]=4 3877 B9R0.23 COC(=O)[C@H](N)CC(F)F Amb33483000 [0,1,0,0,0,1|2,0,0]=4 3878 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,1,0,0,0,1|2,0,0]=4 3879 B9R0.23 COC(=O)\C(N)=C\C(C)C Amb28050074 [0,1,0,0,0,1|1,0,1]=4 3880 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,1,0,0,0,1|1,0,0]=3 3881 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,1,0,0,0,1|0,0,0]=2 3882 B9R0.23 COC(C)C(N)CC(N)=O Amb26580109 [0,1,0,0,0,1|1,0,0]=3 3883 B9R0.23 COC(C)[C@@H](C)NC(C)=O Amb27197797 [0,1,0,0,0,1|2,0,0]=4 3884 B9R0.23 COC(C)[C@H](C)NC(C)=O Amb28063340 [0,1,0,0,0,1|2,0,0]=4 3885 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,1,0,0,0,1|0,0,0]=2 3886 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,1,0,0,0,1|0,0,0]=2 3887 B9R0.23 C[C@@H](N)C[C@@H](O)C(=O)NO Amb27620269 [0,1,0,0,0,1|2,0,0]=4 3888 B9R0.23 C[C@@H](O)CN(C)C(=O)CO Amb28456435 [0,1,0,0,0,1|2,0,0]=4 3889 B9R0.23 C[C@H](C=O)[C@@H](C)CC(=O)O Amb27874077 [0,1,0,0,0,1|1,0,1]=4 3890 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,1,0,0,0,1|2,0,0]=4 3891 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,1,0,0,0,1|1,0,1]=4 3892 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,1,0,0,0,1|1,0,1]=4 3893 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,1,0,0,0,1|1,0,1]=4 3894 B9R0.23 NC(=O)CC(N)[C@H](O)CO Amb28050874 [0,1,0,0,0,1|1,0,0]=3 3895 B9R0.23 NC(=O)C[C@@H](O)[C@H](O)CO Amb27788545 [0,1,0,0,0,1|2,0,0]=4 3896 B9R0.23 NC(=O)C[C@H](O)[C@H](O)CO Amb27759937 [0,1,0,0,0,1|2,0,0]=4 3897 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,1,0,0,0,1|0,0,0]=2 3898 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,1,0,0,0,1|1,0,0]=3 3899 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,1,0,0,0,1|1,0,0]=3 3900 B9R0.23 N[C@H](CC(=O)O)C(=O)NO Amb27413035 [0,1,0,0,0,1|1,0,1]=4 3901 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,1,0,0,0,1|1,0,0]=3 3902 B9R0.39 C#CC(CC(=O)O)C(C)C Amb27408324 [0,1,0,0,0,1|2,0,0]=4 3903 B9R0.39 C#C[C@@H](CC(=O)O)C(C)C Amb27977044 [0,1,0,0,0,1|2,0,0]=4 3904 B9R0.39 C#C[C@H](CC(=O)O)C(C)C Amb27253902 [0,1,0,0,0,1|2,0,0]=4 3905 B9R0.39 C=C(C)C(CN)CC(=O)O Amb33199956 [0,1,0,0,0,1|1,0,1]=4 3906 B9R0.39 C=CC(CC(=O)O)C(C)C Amb18643903 [0,1,0,0,0,1|2,0,0]=4 3907 B9R0.39 C=CC(SC(C)C)C(=O)O Amb28123807 [0,1,0,0,0,1|2,0,0]=4 3908 B9R0.39 C=C[C@@H](CC(=O)O)C(C)C Amb27881786 [0,1,0,0,0,1|2,0,0]=4 3909 B9R0.39 C=C[C@H](CC(=O)O)C(C)C Amb27962891 [0,1,0,0,0,1|2,0,0]=4 3910 B9R0.39 CC(=O)NC(CN)C(=O)O Amb28128874 [0,1,0,0,0,1|0,0,2]=4 3911 B9R0.39 CC(=O)OC(CCl)C(C)O Amb27815074 [0,1,0,0,0,1|2,0,0]=4 3912 B9R0.39 CC(=O)O[C@@H](CN)C(=O)O Amb27874054 [0,1,0,0,0,1|0,0,2]=4 3913 B9R0.39 CC(C)C(C#N)CC(=O)O Amb25818234 [0,1,0,0,0,1|1,0,1]=4 3914 B9R0.39 CC(C)C(CN)CC(=O)O Amb26910759 [0,1,0,0,0,1|1,0,0]=3 3915 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [0,1,0,0,0,1|1,0,1]=4 3916 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,1,0,0,0,1|1,0,0]=3 3917 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,1,0,0,0,1|1,0,0]=3 3918 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,1,0,0,0,1|2,0,0]=4 3919 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [0,1,0,0,0,1|1,0,1]=4 3920 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,1,0,0,0,1|1,0,0]=3 3921 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,1,0,0,0,1|1,0,0]=3 3922 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,1,0,0,0,1|1,0,0]=3 3923 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,1,0,0,0,1|1,0,0]=3 3924 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,1,0,0,0,1|1,0,0]=3 3925 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,1,0,0,0,1|1,0,0]=3 3926 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,1,0,0,0,1|1,0,0]=3 3927 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,1,0,0,0,1|1,0,0]=3 3928 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,1,0,0,0,1|1,0,0]=3 3929 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,1,0,0,0,1|1,0,0]=3 3930 B9R0.39 CC(C)C[C@H](NN)C(N)=O Amb27604368 [0,1,0,0,0,1|2,0,0]=4 3931 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,1,0,0,0,1|1,0,0]=3 3932 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,1,0,0,0,1|2,0,0]=4 3933 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,1,0,0,0,1|2,0,0]=4 3934 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,1,0,0,0,1|2,0,0]=4 3935 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,1,0,0,0,1|1,0,0]=3 3936 B9R0.39 CC(C)[C@@H](C#N)CC(=O)O Amb27473398 [0,1,0,0,0,1|1,0,1]=4 3937 B9R0.39 CC(C)[C@H](C#N)CC(=O)O Amb28184580 [0,1,0,0,0,1|1,0,1]=4 3938 B9R0.39 CC(Cl)CC(CN)C(=O)O Amb28396430 [0,1,0,0,0,1|1,0,0]=3 3939 B9R0.39 CC(N)NC(CS)C(=O)O Amb27792112 [0,1,0,0,0,1|2,0,0]=4 3940 B9R0.39 CC(O)CC(C#N)C(=O)O Amb35741473 [0,1,0,0,0,1|0,0,1]=3 3941 B9R0.39 CCC(CC(=O)O)C(C)C Amb33534084 [0,1,0,0,0,1|2,0,0]=4 3942 B9R0.39 CCC(CC(=O)O)C(C)O Amb18831453 [0,1,0,0,0,1|1,0,0]=3 3943 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,1,0,0,0,1|2,0,0]=4 3944 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [0,1,0,0,0,1|1,0,0]=3 3945 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,1,0,0,0,1|2,0,0]=4 3946 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,1,0,0,0,1|2,0,0]=4 3947 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,1,0,0,0,1|2,0,0]=4 3948 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,1,0,0,0,1|2,0,0]=4 3949 B9R0.39 CC[C@H](CC(=O)O)C(C)C Amb25989910 [0,1,0,0,0,1|2,0,0]=4 3950 B9R0.39 CNC(CC(=O)O)C(=O)O Amb1905634 [0,1,0,0,0,1|1,0,1]=4 3951 B9R0.39 CNC(CC(=O)O)C(=O)O Amb30867747 [0,1,0,0,0,1|1,0,1]=4 3952 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,1,0,0,0,1|0,0,2]=4 3953 B9R0.39 CNC(CC(=O)O)C(C)C Amb27209417 [0,1,0,0,0,1|1,0,0]=3 3954 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,1,0,0,0,1|1,0,0]=3 3955 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,1,0,0,0,1|1,0,0]=3 3956 B9R0.39 CNC(CC(C)C)C(N)=O Amb19006600 [0,1,0,0,0,1|2,0,0]=4 3957 B9R0.39 CNC(CC(C)C)C(N)=O Amb32753443 [0,1,0,0,0,1|2,0,0]=4 3958 B9R0.39 CNC(CN(C)C)C(=O)O Amb28388875 [0,1,0,0,0,1|2,0,0]=4 3959 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O Amb3499450 [0,1,0,0,0,1|1,0,1]=4 3960 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,1,0,0,0,1|1,0,0]=3 3961 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,1,0,0,0,1|1,0,0]=3 3962 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb24550819 [0,1,0,0,0,1|2,0,0]=4 3963 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb32679561 [0,1,0,0,0,1|2,0,0]=4 3964 B9R0.39 CN[C@H](CC(=O)O)C(=O)O Amb8515692 [0,1,0,0,0,1|1,0,1]=4 3965 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,1,0,0,0,1|1,0,0]=3 3966 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,1,0,0,0,1|1,0,0]=3 3967 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,1,0,0,0,1|2,0,0]=4 3968 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,1,0,0,0,1|2,0,0]=4 3969 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,1,0,0,0,1|2,0,0]=4 3970 B9R0.39 C\C(Cl)=C/C(ON)C(=O)O Amb27252200 [0,1,0,0,0,1|1,0,1]=4 3971 B9R0.39 NCC(CC(=O)O)C(=O)O Amb22546423 [0,1,0,0,0,1|1,0,1]=4 3972 B9R0.39 NCC(CC(=O)O)C(=O)O Amb24538047 [0,1,0,0,0,1|1,0,1]=4 3973 B9R0.39 NCC(CC(=O)O)C(F)F Amb27192581 [0,1,0,0,0,1|2,0,0]=4 3974 B9R0.39 NCC(CC(=O)O)C(F)F Amb28555657 [0,1,0,0,0,1|2,0,0]=4 3975 B9R0.39 NNC(CC(=O)O)C(=O)O Amb28070991 [0,1,0,0,0,1|1,0,1]=4 3976 B9R0.39 NN[C@@H](CC(=O)O)C(=O)O Amb24117193 [0,1,0,0,0,1|1,0,1]=4 3977 B9R0.39 O=C(O)CC(NCl)C(=O)O Amb27953217 [0,1,0,0,0,1|1,0,1]=4 3978 B9R0.39 O=C(O)CC(NO)C(=O)O Amb24685872 [0,1,0,0,0,1|1,0,1]=4 3979 B9R0.39 O=C(O)CC(NS)C(=O)O Amb25808901 [0,1,0,0,0,1|1,0,1]=4 3980 B9R0.39 O=C(O)C[C@H](NCl)C(=O)O Amb27401859 [0,1,0,0,0,1|1,0,1]=4 3981 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24117497 [0,1,0,0,0,1|1,0,1]=4 3982 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24630025 [0,1,0,0,0,1|1,0,1]=4 3983 B9R0.42 C#CC(=O)NC(C)C(C)O Amb28064873 [0,1,0,0,0,1|2,0,0]=4 3984 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O Amb28321822 [0,1,0,0,0,1|0,0,1]=3 3985 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,1,0,0,0,1|1,0,1]=4 3986 B9R0.42 C=C(CC(O)CO)C(=O)O Amb28050042 [0,1,0,0,0,1|1,0,1]=4 3987 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,1,0,0,0,1|1,0,1]=4 3988 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,1,0,0,0,1|1,0,1]=4 3989 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,1,0,0,0,1|1,0,1]=4 3990 B9R0.42 C=CC(=O)O[C@@H](C)[C@H](C)O Amb28064101 [0,1,0,0,0,1|2,0,0]=4 3991 B9R0.42 C=CC(=O)O[C@H](C)[C@@H](C)O Amb27839286 [0,1,0,0,0,1|2,0,0]=4 3992 B9R0.42 C=CC(C)C[C@H](C)C(=O)O Amb27788729 [0,1,0,0,0,1|2,0,0]=4 3993 B9R0.42 C=CC(C)O[C@H](C)C(=O)O Amb27863058 [0,1,0,0,0,1|2,0,0]=4 3994 B9R0.42 C=CC(C)SC(C)C(=O)O Amb18310581 [0,1,0,0,0,1|2,0,0]=4 3995 B9R0.42 CC(=O)C(C)CC(O)CO Amb27616537 [0,1,0,0,0,1|2,0,0]=4 3996 B9R0.42 CC(=O)C(O)CC(O)CO Amb28049878 [0,1,0,0,0,1|2,0,0]=4 3997 B9R0.42 CC(C#N)CC(N)C(=O)O Amb25262927 [0,1,0,0,0,1|1,0,0]=3 3998 B9R0.42 CC(C#N)CC(N)C(N)=O Amb33035593 [0,1,0,0,0,1|2,0,0]=4 3999 B9R0.42 CC(C#N)C[C@@H](N)C(=O)O Amb33127539 [0,1,0,0,0,1|1,0,0]=3 4000 B9R0.42 CC(C#N)C[C@H](N)C(=O)O Amb33036873 [0,1,0,0,0,1|1,0,0]=3 4001 B9R0.42 CC(C#N)O[C@H](C)C(=O)O Amb27847636 [0,1,0,0,0,1|2,0,0]=4 4002 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,1,0,0,0,1|1,0,0]=3 4003 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,0,0,0,1|1,0,0]=3 4004 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,0,0,0,1|0,0,0]=2 4005 B9R0.42 CC(CO)CC(N)C(N)=O Amb32787927 [0,1,0,0,0,1|1,0,0]=3 4006 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,0,0,0,1|0,0,0]=2 4007 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,0,0,0,1|0,0,0]=2 4008 B9R0.42 CC(CO)NC(C)C(N)=O Amb9360038 [0,1,0,0,0,1|2,0,0]=4 4009 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,1,0,0,0,1|1,0,0]=3 4010 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,1,0,0,0,1|1,0,0]=3 4011 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,1,0,0,0,1|1,0,0]=3 4012 B9R0.42 CC(CO)SC(C)C(N)=O Amb27664026 [0,1,0,0,0,1|2,0,0]=4 4013 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,1,0,0,0,1|1,0,0]=3 4014 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,1,0,0,0,1|2,0,0]=4 4015 B9R0.42 CC(O)C(=O)OC(=O)CO Amb27197247 [0,1,0,0,0,1|1,0,1]=4 4016 B9R0.42 CC(O)C(C)NC(=O)CN Amb27424140 [0,1,0,0,0,1|2,0,0]=4 4017 B9R0.42 CC(O)C(O)CC(=O)C=O Amb28201309 [0,1,0,0,0,1|1,0,1]=4 4018 B9R0.42 CC(O)C(O)CC(=O)CO Amb27615146 [0,1,0,0,0,1|1,0,0]=3 4019 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,1,0,0,0,1|0,0,2]=4 4020 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,1,0,0,0,1|0,0,2]=4 4021 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,1,0,0,0,1|0,0,2]=4 4022 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,1,0,0,0,1|0,0,2]=4 4023 B9R0.42 CCC(=O)OC(N)C(C)C Amb28240454 [0,1,0,0,0,1|2,0,0]=4 4024 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,1,0,0,0,1|2,0,0]=4 4025 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,1,0,0,0,1|2,0,0]=4 4026 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,1,0,0,0,1|1,0,0]=3 4027 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,1,0,0,0,1|1,0,0]=3 4028 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [0,1,0,0,0,1|2,0,0]=4 4029 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,1,0,0,0,1|2,0,0]=4 4030 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,1,0,0,0,1|2,0,0]=4 4031 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,1,0,0,0,1|2,0,0]=4 4032 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,1,0,0,0,1|1,0,0]=3 4033 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,1,0,0,0,1|2,0,0]=4 4034 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,1,0,0,0,1|1,0,0]=3 4035 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [0,1,0,0,0,1|2,0,0]=4 4036 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,1,0,0,0,1|2,0,0]=4 4037 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,1,0,0,0,1|2,0,0]=4 4038 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,1,0,0,0,1|2,0,0]=4 4039 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,1,0,0,0,1|2,0,0]=4 4040 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [0,1,0,0,0,1|1,0,0]=3 4041 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,1,0,0,0,1|1,0,0]=3 4042 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,1,0,0,0,1|1,0,0]=3 4043 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,1,0,0,0,1|0,0,0]=2 4044 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [0,1,0,0,0,1|1,0,0]=3 4045 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,1,0,0,0,1|1,0,0]=3 4046 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,1,0,0,0,1|0,0,0]=2 4047 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,1,0,0,0,1|0,0,0]=2 4048 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,1,0,0,0,1|2,0,0]=4 4049 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,1,0,0,0,1|1,0,1]=4 4050 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,1,0,0,0,1|2,0,0]=4 4051 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,1,0,0,0,1|2,0,0]=4 4052 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,1,0,0,0,1|2,0,0]=4 4053 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,1,0,0,0,1|1,0,0]=3 4054 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,1,0,0,0,1|2,0,0]=4 4055 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,1,0,0,0,1|1,0,0]=3 4056 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,1,0,0,0,1|1,0,0]=3 4057 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,1,0,0,0,1|0,0,2]=4 4058 B9R0.42 CNC(=O)CC(N)C(C)C Amb28325378 [0,1,0,0,0,1|2,0,0]=4 4059 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,1,0,0,0,1|0,0,2]=4 4060 B9R0.42 CNC(=O)OC(C)C(C)O Amb27971496 [0,1,0,0,0,1|2,0,0]=4 4061 B9R0.42 COC(=O)CC(=O)C(C)O Amb27827292 [0,1,0,0,0,1|1,0,1]=4 4062 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,1,0,0,0,1|0,0,2]=4 4063 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,1,0,0,0,1|0,0,2]=4 4064 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,1,0,0,0,1|0,0,2]=4 4065 B9R0.42 COC(=O)CC(N)C(C)C Amb22168224 [0,1,0,0,0,1|1,0,0]=3 4066 B9R0.42 COC(=O)CC(N)C(C)C Amb26870018 [0,1,0,0,0,1|1,0,0]=3 4067 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,1,0,0,0,1|2,0,0]=4 4068 B9R0.42 COC(=O)CC(O)C(C)N Amb27429441 [0,1,0,0,0,1|2,0,0]=4 4069 B9R0.42 COC(=O)CC(O)C(C)O Amb27969056 [0,1,0,0,0,1|1,0,0]=3 4070 B9R0.42 COC(=O)CC(O)[C@H](C)O Amb27455910 [0,1,0,0,0,1|1,0,0]=3 4071 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,1,0,0,0,1|0,0,2]=4 4072 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,1,0,0,0,1|0,0,2]=4 4073 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb26391960 [0,1,0,0,0,1|1,0,0]=3 4074 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb30640927 [0,1,0,0,0,1|1,0,0]=3 4075 B9R0.42 COC(=O)C[C@@H](N)[C@@H](C)O Amb28340873 [0,1,0,0,0,1|0,0,0]=2 4076 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,1,0,0,0,1|2,0,0]=4 4077 B9R0.42 COC(=O)C[C@@H](O)[C@H](C)N Amb27429613 [0,1,0,0,0,1|2,0,0]=4 4078 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,1,0,0,0,1|0,0,2]=4 4079 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb23401522 [0,1,0,0,0,1|1,0,0]=3 4080 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb25865860 [0,1,0,0,0,1|1,0,0]=3 4081 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,1,0,0,0,1|2,0,0]=4 4082 B9R0.42 COC(=O)C[C@H](O)[C@H](C)O Amb28069717 [0,1,0,0,0,1|1,0,0]=3 4083 B9R0.42 COC(=O)NC(C)C(C)S Amb28040967 [0,1,0,0,0,1|1,1,0]=4 4084 B9R0.42 COC(=O)\C=C(/N)C(C)C Amb32701567 [0,1,0,0,0,1|1,0,1]=4 4085 B9R0.42 COC(=O)\N=C(/N)C(C)C Amb25147336 [0,1,0,0,0,1|1,0,1]=4 4086 B9R0.42 COC(C)CC(=O)C(=O)O Amb27614317 [0,1,0,0,0,1|1,0,1]=4 4087 B9R0.42 COC(C)CC(C)C(C)=O Amb27841945 [0,1,0,0,0,1|2,0,0]=4 4088 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,1,0,0,0,1|0,0,0]=2 4089 B9R0.42 COC(C)CC(N)C(N)=O Amb25349298 [0,1,0,0,0,1|1,0,0]=3 4090 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,1,0,0,0,1|1,0,0]=3 4091 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,1,0,0,0,1|0,0,0]=2 4092 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,1,0,0,0,1|0,0,0]=2 4093 B9R0.42 COC(C)\C=C(\C)C(=O)O Amb27432877 [0,1,0,0,0,1|1,0,1]=4 4094 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,1,0,0,0,1|0,1,0]=3 4095 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,1,0,0,0,1|0,1,0]=3 4096 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,0,0,0,1|0,0,0]=2 4097 B9R0.42 C[C@@H](CO)NC(=O)C(=O)O Amb28049727 [0,1,0,0,0,1|1,0,1]=4 4098 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,1,0,0,0,1|1,0,0]=3 4099 B9R0.42 C[C@@H](O)[C@@H](O)C[C@H](O)C=O Amb27617150 [0,1,0,0,0,1|1,0,1]=4 4100 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,0,0,0,1|0,0,0]=2 4101 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,1,0,0,0,1|1,0,0]=3 4102 B9R0.42 C[C@H](O)[C@H](O)C[C@@H](O)C=O Amb27169403 [0,1,0,0,0,1|1,0,1]=4 4103 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,1,0,0,0,1|1,0,1]=4 4104 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,1,0,0,0,1|1,0,1]=4 4105 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,1,0,0,0,1|1,0,1]=4 4106 B9R0.42 C\C(=C\C(N)C(C)C)CO Amb28118444 [0,1,0,0,0,1|2,0,0]=4 4107 B9R0.42 C\C(C=O)=C/C(C)C(C)O Amb28252434 [0,1,0,0,0,1|2,0,0]=4 4108 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,1,0,0,0,1|1,0,1]=4 4109 B9R0.42 NC(=O)C(N)CC(O)CF Amb33308795 [0,1,0,0,0,1|1,0,0]=3 4110 B9R0.42 NC(=O)C(N)CC(O)CO Amb33066193 [0,1,0,0,0,1|1,0,0]=3 4111 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,1,0,0,0,1|0,0,2]=4 4112 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,1,0,0,0,1|0,0,2]=4 4113 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [0,1,0,0,0,1|1,0,1]=4 4114 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,1,0,0,0,1|1,0,0]=3 4115 B9R0.42 NC(CC(O)C=O)C(=O)O Amb28126784 [0,1,0,0,0,1|0,0,1]=3 4116 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,1,0,0,0,1|0,0,0]=2 4117 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,1,0,0,0,1|0,0,0]=2 4118 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,1,0,0,0,1|0,0,0]=2 4119 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [0,1,0,0,0,1|1,0,0]=3 4120 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,1,0,0,0,1|0,0,0]=2 4121 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,1,0,0,0,1|1,0,0]=3 4122 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,1,0,0,0,1|1,0,0]=3 4123 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,1,0,0,0,1|0,0,2]=4 4124 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,1,0,0,0,1|0,0,2]=4 4125 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,1,0,0,0,1|0,0,2]=4 4126 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [0,1,0,0,0,1|1,0,1]=4 4127 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,1,0,0,0,1|0,0,0]=2 4128 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,1,0,0,0,1|0,0,0]=2 4129 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,1,0,0,0,1|0,0,0]=2 4130 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O Amb17607759 [0,1,0,0,0,1|2,0,0]=4 4131 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,1,0,0,0,1|0,0,0]=2 4132 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,1,0,0,0,1|0,0,0]=2 4133 B9R0.42 N[C@H](CN(O)N=O)C(=O)O Amb27976802 [0,1,0,0,0,1|2,0,0]=4 4134 B9R0.42 O=C(O)C(=O)C[C@H](O)CO Amb26605764 [0,1,0,0,0,1|1,0,1]=4 4135 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [0,1,0,0,0,1|2,0,0]=4 4136 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,1,0,0,0,1|1,0,0]=3 4137 B9R0.57 CC(=O)C(N)CC(C)(C)C Amb27959417 [0,1,0,0,0,1|2,0,0]=4 4138 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,1,0,0,0,1|1,0,0]=3 4139 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,1,0,0,0,1|1,0,0]=3 4140 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,1,0,0,0,1|2,0,0]=4 4141 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,1,0,0,0,1|2,0,0]=4 4142 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,1,0,0,0,1|2,0,0]=4 4143 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,1,0,0,0,1|1,0,0]=3 4144 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,1,0,0,0,1|1,0,0]=3 4145 B9R0.57 CC(C)(C)OC(F)C(=O)O Amb27399823 [0,1,0,0,0,1|2,0,0]=4 4146 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,1,0,0,0,1|1,0,0]=3 4147 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,1,0,0,0,1|1,0,0]=3 4148 B9R0.57 CC(C)(F)CC(N)C(N)=O Amb33036949 [0,1,0,0,0,1|2,0,0]=4 4149 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,1,0,0,0,1|2,0,0]=4 4150 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,1,0,0,0,1|1,0,0]=3 4151 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,1,0,0,0,1|1,0,0]=3 4152 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,1,0,0,0,1|0,0,0]=2 4153 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] Amb33109899 [0,1,0,0,0,1|0,0,1]=3 4154 B9R0.57 CC(C)(O)CC(N)C(N)=O Amb33065412 [0,1,0,0,0,1|1,0,0]=3 4155 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,1,0,0,0,1|1,0,0]=3 4156 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,1,0,0,0,1|0,0,0]=2 4157 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,1,0,0,0,1|1,0,0]=3 4158 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,1,0,0,0,1|0,0,0]=2 4159 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,1,0,0,0,1|0,1,0]=3 4160 B9R0.57 CC(C)[C@@H](N)CP(C)(=O)O Amb27476831 [0,1,0,0,0,1|2,0,0]=4 4161 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,1,0,0,0,1|2,0,0]=4 4162 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,1,0,0,0,1|2,0,0]=4 4163 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,1,0,0,0,1|2,0,0]=4 4164 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,1,0,0,0,1|2,0,0]=4 4165 B9R0.57 CC(CC(C)(F)F)C(=O)O Amb33482229 [0,1,0,0,0,1|2,0,0]=4 4166 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb26866987 [0,1,0,0,0,1|1,0,0]=3 4167 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb33483896 [0,1,0,0,0,1|1,0,0]=3 4168 B9R0.57 CC(F)(F)CC(N)C(N)=O Amb33036598 [0,1,0,0,0,1|2,0,0]=4 4169 B9R0.57 CC(F)(F)CC(O)C(=O)O Amb26361859 [0,1,0,0,0,1|2,0,0]=4 4170 B9R0.57 CC(F)(F)C[C@@H](N)C(=O)O Amb33309023 [0,1,0,0,0,1|1,0,0]=3 4171 B9R0.57 CC(F)(F)C[C@H](N)C(=O)O Amb26573683 [0,1,0,0,0,1|1,0,0]=3 4172 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,1,0,0,0,1|2,0,0]=4 4173 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,1,0,0,0,1|2,0,0]=4 4174 B9R0.57 CC(OC(C)(C)C)C(=O)O Amb9208483 [0,1,0,0,0,1|2,0,0]=4 4175 B9R0.57 CP(=O)(O)CC(N)C(=O)O Amb27770381 [0,1,0,0,0,1|1,0,0]=3 4176 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb27983621 [0,1,0,0,0,1|1,0,1]=4 4177 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb32753509 [0,1,0,0,0,1|1,0,1]=4 4178 B9R0.57 CS(=O)(=O)C[C@@H](N)C(=O)O Amb27831327 [0,1,0,0,0,1|1,0,1]=4 4179 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb27231797 [0,1,0,0,0,1|1,0,1]=4 4180 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb32683294 [0,1,0,0,0,1|1,0,1]=4 4181 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,1,0,0,0,1|2,0,0]=4 4182 B9R0.57 C[C@@H](CC(C)(F)F)C(=O)O Amb33744369 [0,1,0,0,0,1|2,0,0]=4 4183 B9R0.57 C[C@@H](O)[C@H](N)CS(=O)(=O)O Amb27483111 [0,1,0,0,0,1|1,0,0]=3 4184 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,1,0,0,0,1|2,0,0]=4 4185 B9R0.57 C[C@H](CC(C)(F)F)C(=O)O Amb33743241 [0,1,0,0,0,1|2,0,0]=4 4186 B9R0.57 C[C@H](O)[C@@H](O)CP(=O)(O)O Amb28079090 [0,1,0,0,0,1|2,0,0]=4 4187 B9R0.57 C[Si](C)(C)CC(N)C(=O)O Amb26361043 [0,1,0,0,0,1|1,1,0]=4 4188 B9R0.57 C[Si](C)(C)C[C@@H](N)C(=O)O Amb27658975 [0,1,0,0,0,1|1,1,0]=4 4189 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O Amb24482244 [0,1,0,0,0,1|1,1,0]=4 4190 B9R0.57 C[Si](C)(O)C[C@H](N)C(=O)O Amb27408998 [0,1,0,0,0,1|0,1,0]=3 4191 B9R0.57 NC(CC(F)(F)Cl)C(=O)O Amb27477823 [0,1,0,0,0,1|2,0,0]=4 4192 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb10603542 [0,1,0,0,0,1|2,0,0]=4 4193 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb2684546 [0,1,0,0,0,1|2,0,0]=4 4194 B9R0.57 NC(CP(=O)(O)O)C(=O)O Amb542762 [0,1,0,0,0,1|2,0,0]=4 4195 B9R0.57 NC(CP(O)(O)=S)C(=O)O Amb27232821 [0,1,0,0,0,1|2,0,0]=4 4196 B9R0.57 NC(CS(=O)(=O)O)C(=O)O Amb2698240 [0,1,0,0,0,1|2,0,0]=4 4197 B9R0.57 N[C@@H](CC(Cl)(Cl)Cl)C(=O)O Amb25967143 [0,1,0,0,0,1|2,0,0]=4 4198 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O Amb19889287 [0,1,0,0,0,1|2,0,0]=4 4199 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O Amb2719731 [0,1,0,0,0,1|2,0,0]=4 4200 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb17942867 [0,1,0,0,0,1|2,0,0]=4 4201 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb3940873 [0,1,0,0,0,1|2,0,0]=4 4202 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O Amb19889286 [0,1,0,0,0,1|2,0,0]=4 4203 B9R0.57 N[C@H](CP(=O)(O)O)C(=O)O Amb8515685 [0,1,0,0,0,1|2,0,0]=4 4204 B9R0.79 C=C(C(=O)O)C(O)C(C)C Amb27468733 [0,1,0,0,0,1|2,0,0]=4 4205 B9R0.79 C=C(C(C)=O)[C@H](O)[C@H](C)O Amb28253921 [0,1,0,0,0,1|2,0,0]=4 4206 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [0,1,0,0,0,1|1,0,1]=4 4207 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,1,0,0,0,1|1,0,1]=4 4208 B9R0.79 CC(=O)C(=O)C(O)C(C)O Amb28202342 [0,1,0,0,0,1|2,0,0]=4 4209 B9R0.79 CC(=O)C(=O)[C@@H](O)[C@H](C)O Amb27594785 [0,1,0,0,0,1|2,0,0]=4 4210 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,1,0,0,0,1|0,0,2]=4 4211 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,1,0,0,0,1|0,0,2]=4 4212 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,1,0,0,0,1|0,1,1]=4 4213 B9R0.79 CC(C(=O)O)C(N)C(=O)O Amb2099482 [0,1,0,0,0,1|1,0,1]=4 4214 B9R0.79 CC(C(F)F)C(N)C(=O)O Amb4442353 [0,1,0,0,0,1|2,0,0]=4 4215 B9R0.79 CC(C(F)F)[C@H](N)C(=O)O Amb27424746 [0,1,0,0,0,1|2,0,0]=4 4216 B9R0.79 CC(C(N)C(=O)O)N(C)C Amb30020664 [0,1,0,0,0,1|2,0,0]=4 4217 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,1,0,0,0,1|1,0,1]=4 4218 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,1,0,0,0,1|1,0,1]=4 4219 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,1,0,0,0,1|1,0,0]=3 4220 B9R0.79 CC(C)C(C)C(=O)C(=O)O Amb27473341 [0,1,0,0,0,1|2,0,0]=4 4221 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,1,0,0,0,1|1,0,0]=3 4222 B9R0.79 CC(C)C(C)C(N)C(N)=O Amb28315989 [0,1,0,0,0,1|2,0,0]=4 4223 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,1,0,0,0,1|1,0,0]=3 4224 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,1,0,0,0,1|1,0,0]=3 4225 B9R0.79 CC(C)C(Cl)C(=O)C(=O)O Amb18646182 [0,1,0,0,0,1|2,0,0]=4 4226 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,1,0,0,0,1|1,0,0]=3 4227 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,1,0,0,0,1|1,0,0]=3 4228 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,1,0,0,0,1|1,0,0]=3 4229 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,1,0,0,0,1|1,0,0]=3 4230 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,1,0,0,0,1|1,0,0]=3 4231 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,1,0,0,0,1|1,0,0]=3 4232 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,1,0,0,0,1|1,0,0]=3 4233 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,1,0,0,0,1|2,0,0]=4 4234 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,1,0,0,0,1|2,0,0]=4 4235 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,1,0,0,0,1|1,0,0]=3 4236 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,1,0,0,0,1|2,0,0]=4 4237 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,1,0,0,0,1|2,0,0]=4 4238 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,1,0,0,0,1|1,0,0]=3 4239 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,1,0,0,0,1|1,0,0]=3 4240 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,1,0,0,0,1|2,0,0]=4 4241 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,1,0,0,0,1|1,0,0]=3 4242 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,1,0,0,0,1|2,0,0]=4 4243 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,1,0,0,0,1|2,0,0]=4 4244 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,1,0,0,0,1|2,0,0]=4 4245 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,1,0,0,0,1|1,0,0]=3 4246 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,1,0,0,0,1|1,0,0]=3 4247 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,1,0,0,0,1|1,0,0]=3 4248 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,1,0,0,0,1|2,0,0]=4 4249 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,1,0,0,0,1|1,0,0]=3 4250 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,1,0,0,0,1|2,0,0]=4 4251 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,1,0,0,0,1|1,0,0]=3 4252 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,1,0,0,0,1|2,0,0]=4 4253 B9R0.79 CC(Cl)C(C)C(N)C(=O)O Amb27838066 [0,1,0,0,0,1|1,0,0]=3 4254 B9R0.79 CC(F)C(C)C(Br)C(=O)O Amb28050032 [0,1,0,0,0,1|2,0,0]=4 4255 B9R0.79 CC(F)C(C)C(N)C(=O)O Amb28041913 [0,1,0,0,0,1|1,0,0]=3 4256 B9R0.79 CC(N)C(O)C(C)C(=O)O Amb25870814 [0,1,0,0,0,1|2,0,0]=4 4257 B9R0.79 CC(O)C(C)C(C)C(=O)O Amb28059349 [0,1,0,0,0,1|1,0,0]=3 4258 B9R0.79 CC(O)C(C)C(N)C(=O)O Amb21953714 [0,1,0,0,0,1|0,0,0]=2 4259 B9R0.79 CC(O)C(C)C(N)C(N)=O Amb33036679 [0,1,0,0,0,1|1,0,0]=3 4260 B9R0.79 CC(O)C(C)[C@@H](N)C(=O)O Amb22800202 [0,1,0,0,0,1|0,0,0]=2 4261 B9R0.79 CC(O)C(C)[C@H](N)C(=O)O Amb27390194 [0,1,0,0,0,1|0,0,0]=2 4262 B9R0.79 CC(O)C(O)C(N)C(=O)O Amb27210841 [0,1,0,0,0,1|0,0,0]=2 4263 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(=O)O Amb33524291 [0,1,0,0,0,1|0,0,0]=2 4264 B9R0.79 CC(S)C(C)C(N)C(=O)O Amb27241739 [0,1,0,0,0,1|0,1,0]=3 4265 B9R0.79 C[C@@H](C(=O)O)C(N)C(=O)O Amb27877897 [0,1,0,0,0,1|1,0,1]=4 4266 B9R0.79 C[C@@H](C(=O)O)[C@@H](N)C(=O)O Amb27170727 [0,1,0,0,0,1|1,0,1]=4 4267 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O Amb25324829 [0,1,0,0,0,1|1,0,1]=4 4268 B9R0.79 C[C@@H](O)[C@@H](O)[C@H](O)C(N)=O Amb27760015 [0,1,0,0,0,1|2,0,0]=4 4269 B9R0.79 C[C@@H](O)[C@H](C)[C@@H](N)C(=O)O Amb27252085 [0,1,0,0,0,1|0,0,0]=2 4270 B9R0.79 C[C@@H](O)[C@H](C)[C@H](N)C(=O)O Amb17615448 [0,1,0,0,0,1|0,0,0]=2 4271 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb27783086 [0,1,0,0,0,1|1,0,1]=4 4272 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb31031234 [0,1,0,0,0,1|1,0,1]=4 4273 B9R0.79 C[C@H](N)[C@@H](O)[C@@H](C)C(=O)O Amb27845316 [0,1,0,0,0,1|2,0,0]=4 4274 B9R0.79 C[C@H](O)[C@@H](C)[C@@H](N)C(=O)O Amb27655509 [0,1,0,0,0,1|0,0,0]=2 4275 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O Amb27595659 [0,1,0,0,0,1|0,0,0]=2 4276 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(=O)O Amb27592166 [0,1,0,0,0,1|1,0,0]=3 4277 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(N)=O Amb27424984 [0,1,0,0,0,1|2,0,0]=4 4278 B9R0.79 C[C@H]([C@@H](C)O)[C@@H](N)C(=O)O Amb25693814 [0,1,0,0,0,1|0,0,0]=2 4279 B9R0.79 NC(C(=O)O)C(F)C(=O)O Amb24061061 [0,1,0,0,0,1|1,0,1]=4 4280 B9R0.79 NC(C(=O)O)C(N)C(=O)O Amb24117894 [0,1,0,0,0,1|1,0,1]=4 4281 B9R0.79 NC(C(=O)O)C(O)C(=O)O Amb9871461 [0,1,0,0,0,1|1,0,1]=4 4282 B9R0.79 NC(C(=O)O)C(O)C(Cl)Cl Amb27837948 [0,1,0,0,0,1|2,0,0]=4 4283 B9R0.79 NC(C(=O)O)C(O)C(F)F Amb19148422 [0,1,0,0,0,1|2,0,0]=4 4284 B9R0.79 N[C@@H](C(=O)O)C(F)C(=O)O Amb27494927 [0,1,0,0,0,1|1,0,1]=4 4285 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb17942870 [0,1,0,0,0,1|1,0,1]=4 4286 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(Cl)Cl Amb27792191 [0,1,0,0,0,1|2,0,0]=4 4287 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27470435 [0,1,0,0,0,1|1,0,1]=4 4288 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(F)F Amb25940794 [0,1,0,0,0,1|2,0,0]=4 4289 B9R0.79 N[C@H](C(=O)O)C(F)C(=O)O Amb27796116 [0,1,0,0,0,1|1,0,1]=4 4290 B9R0.79 N[C@H](C(=O)O)[C@@H](F)C(=O)O Amb27865514 [0,1,0,0,0,1|1,0,1]=4 4291 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O Amb10072362 [0,1,0,0,0,1|1,0,1]=4 4292 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24087715 [0,1,0,0,0,1|1,0,1]=4 4293 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24117974 [0,1,0,0,0,1|1,0,1]=4 4294 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(F)F Amb26336091 [0,1,0,0,0,1|2,0,0]=4 4295 B9R0.79 N[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27796563 [0,1,0,0,0,1|1,0,1]=4 4296 B9R0.79 N[C@H](C(=O)O)[C@H](F)C(=O)O Amb26945975 [0,1,0,0,0,1|1,0,1]=4 4297 B9R0.79 N[C@H](C(=O)O)[C@H](N)C(=O)O Amb27173533 [0,1,0,0,0,1|1,0,1]=4 4298 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb17615140 [0,1,0,0,0,1|1,0,1]=4 4299 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb33714683 [0,1,0,0,0,1|1,0,1]=4 4300 B9R0.6 C#CCC(=O)[C@@H](N)C(C)C Amb35617528 [0,2,0,0,0,0|2,0,0]=4 4301 B9R0.6 C#CCC(=O)[C@H](N)C(C)C Amb35617738 [0,2,0,0,0,0|2,0,0]=4 4302 B9R0.6 C#CCC(C)C(C)C(=O)O Amb28049486 [0,2,0,0,0,0|2,0,0]=4 4303 B9R0.6 C=C(C(=O)O)C(C)OCC Amb33425050 [0,2,0,0,0,0|1,0,1]=4 4304 B9R0.6 C=C(C(=O)OCC)C(C)O Amb28138407 [0,2,0,0,0,0|1,0,1]=4 4305 B9R0.6 C=C(C(=O)OCC)[C@@H](C)O Amb27823217 [0,2,0,0,0,0|1,0,1]=4 4306 B9R0.6 C=C(C)C(N)C(=O)OCC Amb27788978 [0,2,0,0,0,0|1,0,1]=4 4307 B9R0.6 C=C(C)C(N)C(C)OCC Amb27799925 [0,2,0,0,0,0|2,0,0]=4 4308 B9R0.6 C=C(CCC)[C@H](N)C(=O)O Amb27404609 [0,2,0,0,0,0|1,0,1]=4 4309 B9R0.6 C=C(COC)C(C)C(C)O Amb32944992 [0,2,0,0,0,0|2,0,0]=4 4310 B9R0.6 C=CCC(C)C(C)C(=O)O Amb18643938 [0,2,0,0,0,0|2,0,0]=4 4311 B9R0.6 C=CCC(C)C(N)C(=O)O Amb26381874 [0,2,0,0,0,0|1,0,0]=3 4312 B9R0.6 C=CCC(C)C(N)C(N)=O Amb33066012 [0,2,0,0,0,0|2,0,0]=4 4313 B9R0.6 C=CCC(C)[C@@H](N)C(=O)O Amb33037030 [0,2,0,0,0,0|1,0,0]=3 4314 B9R0.6 C=CCC(C)[C@H](N)C(=O)O Amb32865926 [0,2,0,0,0,0|1,0,0]=3 4315 B9R0.6 C=CCC(O)C(N)C(C)O Amb27872196 [0,2,0,0,0,0|1,0,1]=4 4316 B9R0.6 CC(=O)C(O)C(O)CC=O Amb28050017 [0,2,0,0,0,0|2,0,0]=4 4317 B9R0.6 CC(C(=O)O)N(C)CCO Amb5767856 [0,2,0,0,0,0|2,0,0]=4 4318 B9R0.6 CC(C)C(N)C(=O)NC#N Amb28313164 [0,2,0,0,0,0|2,0,0]=4 4319 B9R0.6 CC(C)C(N)C(=O)OCCl Amb27601971 [0,2,0,0,0,0|1,0,0]=3 4320 B9R0.6 CC(C)[C@@H](N)C(=O)OCCl Amb27221960 [0,2,0,0,0,0|1,0,0]=3 4321 B9R0.6 CC(CC#N)C(C)C(=O)O Amb35719228 [0,2,0,0,0,0|2,0,0]=4 4322 B9R0.6 CC(CC#N)C(N)C(=O)O Amb33066130 [0,2,0,0,0,0|1,0,0]=3 4323 B9R0.6 CC(CC#N)C(N)C(N)=O Amb33036532 [0,2,0,0,0,0|2,0,0]=4 4324 B9R0.6 CC(CC#N)[C@@H](N)C(=O)O Amb33308829 [0,2,0,0,0,0|1,0,0]=3 4325 B9R0.6 CC(CC#N)[C@H](N)C(=O)O Amb32865927 [0,2,0,0,0,0|1,0,0]=3 4326 B9R0.6 CC(CC=O)C(C)C(=O)O Amb18644133 [0,2,0,0,0,0|1,0,1]=4 4327 B9R0.6 CC(N=[N+]=[N-])C(C)C(=O)O Amb27772454 [0,2,0,0,0,0|2,0,0]=4 4328 B9R0.6 CC(N=[N+]=[N-])C(O)C(=O)O Amb27827365 [0,2,0,0,0,0|2,0,0]=4 4329 B9R0.6 CC(NC#N)C(C)C(=O)O Amb30030671 [0,2,0,0,0,0|2,0,0]=4 4330 B9R0.6 CC(O)C(O)C(=O)\C=N\O Amb28253802 [0,2,0,0,0,0|1,0,0]=3 4331 B9R0.6 CC(O)C(O)C(O)CC=O Amb4035622 [0,2,0,0,0,0|1,0,1]=4 4332 B9R0.6 CC(OC=O)C(N)C(=O)O Amb27456598 [0,2,0,0,0,0|0,0,0]=2 4333 B9R0.6 CCCC(=O)C(N)C(C)C Amb27467995 [0,2,0,0,0,0|2,0,0]=4 4334 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [0,2,0,0,0,0|2,0,0]=4 4335 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [0,2,0,0,0,0|1,0,0]=3 4336 B9R0.6 CCCC(C)C(N)C(N)=O Amb27809015 [0,2,0,0,0,0|2,0,0]=4 4337 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [0,2,0,0,0,0|2,0,0]=4 4338 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [0,2,0,0,0,0|2,0,0]=4 4339 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [0,2,0,0,0,0|1,0,0]=3 4340 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [0,2,0,0,0,0|2,0,0]=4 4341 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [0,2,0,0,0,0|1,0,0]=3 4342 B9R0.6 CCCC(F)C(Br)C(=O)O Amb27623862 [0,2,0,0,0,0|2,0,0]=4 4343 B9R0.6 CCCC(F)C(N)C(=O)O Amb10839857 [0,2,0,0,0,0|1,0,0]=3 4344 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [0,2,0,0,0,0|2,0,0]=4 4345 B9R0.6 CCCC(N)C(F)C(=O)O Amb33036385 [0,2,0,0,0,0|2,0,0]=4 4346 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [0,2,0,0,0,0|1,0,0]=3 4347 B9R0.6 CCCC(O)C(C)C(N)=O Amb27816041 [0,2,0,0,0,0|2,0,0]=4 4348 B9R0.6 CCCC(O)C(Cl)C(=O)O Amb28120934 [0,2,0,0,0,0|1,0,0]=3 4349 B9R0.6 CCCC(O)C(Cl)C(C)=O Amb26066170 [0,2,0,0,0,0|2,0,0]=4 4350 B9R0.6 CCCC(O)C(F)C(=O)O Amb33036248 [0,2,0,0,0,0|1,0,0]=3 4351 B9R0.6 CCCC(O)C(N)C(=O)O Amb18124815 [0,2,0,0,0,0|0,0,0]=2 4352 B9R0.6 CCCC(O)C(O)C(=O)O Amb27772742 [0,2,0,0,0,0|1,0,0]=3 4353 B9R0.6 CCCC(O)C(O)C(C)=O Amb28122464 [0,2,0,0,0,0|2,0,0]=4 4354 B9R0.6 CCCC(O)[C@@H](O)C(=O)O Amb27256644 [0,2,0,0,0,0|1,0,0]=3 4355 B9R0.6 CCCC(O)[C@H](N)C(=O)O Amb26635079 [0,2,0,0,0,0|0,0,0]=2 4356 B9R0.6 CCCC(S)C(N)C(=O)O Amb27860699 [0,2,0,0,0,0|0,1,0]=3 4357 B9R0.6 CCCC(S)[C@@H](N)C(=O)O Amb27759942 [0,2,0,0,0,0|0,1,0]=3 4358 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [0,2,0,0,0,0|2,0,0]=4 4359 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [0,2,0,0,0,0|2,0,0]=4 4360 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O Amb22747816 [0,2,0,0,0,0|2,0,0]=4 4361 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O Amb22747809 [0,2,0,0,0,0|2,0,0]=4 4362 B9R0.6 CCC[C@@H](O)[C@@H](N)C(=O)O Amb25367288 [0,2,0,0,0,0|0,0,0]=2 4363 B9R0.6 CCC[C@@H](O)[C@H](N)C(=O)O Amb24715802 [0,2,0,0,0,0|0,0,0]=2 4364 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [0,2,0,0,0,0|1,0,0]=3 4365 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [0,2,0,0,0,0|2,0,0]=4 4366 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [0,2,0,0,0,0|1,0,0]=3 4367 B9R0.6 CCC[C@H](N)C(O)C(=O)O Amb27229636 [0,2,0,0,0,0|2,0,0]=4 4368 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [0,2,0,0,0,0|2,0,0]=4 4369 B9R0.6 CCC[C@H](N)[C@@H](O)C(=O)O Amb26344900 [0,2,0,0,0,0|2,0,0]=4 4370 B9R0.6 CCC[C@H](N)[C@H](O)C(=O)O Amb25084552 [0,2,0,0,0,0|2,0,0]=4 4371 B9R0.6 CCC[C@H](O)[C@@H](N)C(=O)O Amb26415873 [0,2,0,0,0,0|0,0,0]=2 4372 B9R0.6 CCC[C@H](O)[C@H](N)C(=O)O Amb25113866 [0,2,0,0,0,0|0,0,0]=2 4373 B9R0.6 CCNC(=O)C(N)C(C)C Amb21956643 [0,2,0,0,0,0|2,0,0]=4 4374 B9R0.6 CCNC(=O)C(N)C(C)C Amb6280842 [0,2,0,0,0,0|2,0,0]=4 4375 B9R0.6 CCNC(=O)C(N)C(C)O Amb27759304 [0,2,0,0,0,0|1,0,0]=3 4376 B9R0.6 CCNC(=O)[C@@H](N)C(C)C Amb17231989 [0,2,0,0,0,0|2,0,0]=4 4377 B9R0.6 CCNC(=O)[C@H](N)C(C)C Amb18538480 [0,2,0,0,0,0|2,0,0]=4 4378 B9R0.6 CCOC(=O)C(=O)C(C)O Amb25146496 [0,2,0,0,0,0|1,0,1]=4 4379 B9R0.6 CCOC(=O)C(Br)C(C)Br Amb2687822 [0,2,0,0,0,0|2,0,0]=4 4380 B9R0.6 CCOC(=O)C(Br)C(C)C Amb2720442 [0,2,0,0,0,0|2,0,0]=4 4381 B9R0.6 CCOC(=O)C(Br)C(C)F Amb27614917 [0,2,0,0,0,0|2,0,0]=4 4382 B9R0.6 CCOC(=O)C(Br)C(C)O Amb28287328 [0,2,0,0,0,0|1,0,0]=3 4383 B9R0.6 CCOC(=O)C(C)C(C)C Amb2780711 [0,2,0,0,0,0|2,0,0]=4 4384 B9R0.6 CCOC(=O)C(C)C(C)N Amb25759658 [0,2,0,0,0,0|2,0,0]=4 4385 B9R0.6 CCOC(=O)C(C)C(C)O Amb17615516 [0,2,0,0,0,0|1,0,0]=3 4386 B9R0.6 CCOC(=O)C(Cl)C(C)C Amb18800861 [0,2,0,0,0,0|2,0,0]=4 4387 B9R0.6 CCOC(=O)C(Cl)[C@H](C)O Amb27409078 [0,2,0,0,0,0|1,0,0]=3 4388 B9R0.6 CCOC(=O)C(F)C(C)C Amb24554825 [0,2,0,0,0,0|2,0,0]=4 4389 B9R0.6 CCOC(=O)C(F)C(C)O Amb26396062 [0,2,0,0,0,0|1,0,0]=3 4390 B9R0.6 CCOC(=O)C(N)C(C)=O Amb18124722 [0,2,0,0,0,0|0,0,2]=4 4391 B9R0.6 CCOC(=O)C(N)C(C)=O Amb6893882 [0,2,0,0,0,0|0,0,2]=4 4392 B9R0.6 CCOC(=O)C(N)C(C)C Amb17621190 [0,2,0,0,0,0|1,0,0]=3 4393 B9R0.6 CCOC(=O)C(N)C(C)C Amb9204488 [0,2,0,0,0,0|1,0,0]=3 4394 B9R0.6 CCOC(=O)C(N)C(C)N Amb27789388 [0,2,0,0,0,0|1,0,0]=3 4395 B9R0.6 CCOC(=O)C(N)C(C)O Amb9206209 [0,2,0,0,0,0|0,0,0]=2 4396 B9R0.6 CCOC(=O)C(O)C(C)C Amb25787483 [0,2,0,0,0,0|2,0,0]=4 4397 B9R0.6 CCOC(=O)C(O)C(C)N Amb33329398 [0,2,0,0,0,0|2,0,0]=4 4398 B9R0.6 CCOC(=O)C(O)C(C)O Amb17593683 [0,2,0,0,0,0|1,0,0]=3 4399 B9R0.6 CCOC(=O)C(S)C(C)C Amb27977759 [0,2,0,0,0,0|2,0,0]=4 4400 B9R0.6 CCOC(=O)C(S)C(C)O Amb28281846 [0,2,0,0,0,0|1,0,0]=3 4401 B9R0.6 CCOC(=O)[C@@H](Br)C(C)C Amb27401118 [0,2,0,0,0,0|2,0,0]=4 4402 B9R0.6 CCOC(=O)[C@@H](C)[C@@H](C)O Amb27394728 [0,2,0,0,0,0|1,0,0]=3 4403 B9R0.6 CCOC(=O)[C@@H](C)[C@H](C)O Amb27812304 [0,2,0,0,0,0|1,0,0]=3 4404 B9R0.6 CCOC(=O)[C@@H](N)C(C)C Amb2725108 [0,2,0,0,0,0|1,0,0]=3 4405 B9R0.6 CCOC(=O)[C@@H](N)C(C)C Amb3941376 [0,2,0,0,0,0|1,0,0]=3 4406 B9R0.6 CCOC(=O)[C@@H](N)C(C)F Amb28123369 [0,2,0,0,0,0|1,0,0]=3 4407 B9R0.6 CCOC(=O)[C@@H](N)C(C)O Amb28350590 [0,2,0,0,0,0|0,0,0]=2 4408 B9R0.6 CCOC(=O)[C@@H](N)C(F)F Amb24117985 [0,2,0,0,0,0|2,0,0]=4 4409 B9R0.6 CCOC(=O)[C@@H](N)[C@@H](C)O Amb22745461 [0,2,0,0,0,0|0,0,0]=2 4410 B9R0.6 CCOC(=O)[C@@H](N)[C@@H](C)O Amb27214639 [0,2,0,0,0,0|0,0,0]=2 4411 B9R0.6 CCOC(=O)[C@@H](N)[C@H](C)O Amb26858170 [0,2,0,0,0,0|0,0,0]=2 4412 B9R0.6 CCOC(=O)[C@@H](O)C(C)C Amb25079854 [0,2,0,0,0,0|2,0,0]=4 4413 B9R0.6 CCOC(=O)[C@@H](O)[C@@H](C)O Amb17666646 [0,2,0,0,0,0|1,0,0]=3 4414 B9R0.6 CCOC(=O)[C@H](Br)C(C)C Amb28130440 [0,2,0,0,0,0|2,0,0]=4 4415 B9R0.6 CCOC(=O)[C@H](Br)[C@@H](C)O Amb28240821 [0,2,0,0,0,0|1,0,0]=3 4416 B9R0.6 CCOC(=O)[C@H](C)[C@@H](C)O Amb27466574 [0,2,0,0,0,0|1,0,0]=3 4417 B9R0.6 CCOC(=O)[C@H](F)[C@H](C)O Amb27486621 [0,2,0,0,0,0|1,0,0]=3 4418 B9R0.6 CCOC(=O)[C@H](N)C(C)C Amb10069732 [0,2,0,0,0,0|1,0,0]=3 4419 B9R0.6 CCOC(=O)[C@H](N)C(C)C Amb22801934 [0,2,0,0,0,0|1,0,0]=3 4420 B9R0.6 CCOC(=O)[C@H](N)C(F)F Amb27860305 [0,2,0,0,0,0|2,0,0]=4 4421 B9R0.6 CCOC(=O)[C@H](N)[C@@H](C)F Amb25727320 [0,2,0,0,0,0|1,0,0]=3 4422 B9R0.6 CCOC(=O)[C@H](N)[C@@H](C)O Amb25882725 [0,2,0,0,0,0|0,0,0]=2 4423 B9R0.6 CCOC(=O)[C@H](N)[C@@H](C)O Amb33877385 [0,2,0,0,0,0|0,0,0]=2 4424 B9R0.6 CCOC(=O)[C@H](N)[C@H](C)O Amb24587729 [0,2,0,0,0,0|0,0,0]=2 4425 B9R0.6 CCOC(=O)[C@H](O)[C@@H](C)O Amb28370069 [0,2,0,0,0,0|1,0,0]=3 4426 B9R0.6 CCOC(C)C(=O)C(=O)O Amb33425710 [0,2,0,0,0,0|1,0,1]=4 4427 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [0,2,0,0,0,0|1,0,0]=3 4428 B9R0.6 CCOC(C)C(N)C(=O)O Amb25887694 [0,2,0,0,0,0|0,0,0]=2 4429 B9R0.6 CCOC(C)C(N)C(N)=O Amb33037044 [0,2,0,0,0,0|1,0,0]=3 4430 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [0,2,0,0,0,0|1,0,0]=3 4431 B9R0.6 CCOC(C)C(O)C(C)=O Amb27226954 [0,2,0,0,0,0|2,0,0]=4 4432 B9R0.6 CCOC(C)[C@@H](N)C(=O)O Amb33065865 [0,2,0,0,0,0|0,0,0]=2 4433 B9R0.6 CCOC(C)[C@H](N)C(=O)O Amb33065957 [0,2,0,0,0,0|0,0,0]=2 4434 B9R0.6 CCO[C@H](C)[C@@H](N)C(=O)O Amb22747686 [0,2,0,0,0,0|0,0,0]=2 4435 B9R0.6 CCSC(=O)C(N)C(C)C Amb27650546 [0,2,0,0,0,0|1,1,0]=4 4436 B9R0.6 CCSC(=O)[C@@H](C)[C@@H](C)O Amb28455305 [0,2,0,0,0,0|1,1,0]=4 4437 B9R0.6 CCSC(=O)[C@H](C)[C@H](C)O Amb27761567 [0,2,0,0,0,0|1,1,0]=4 4438 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [0,2,0,0,0,0|1,1,0]=4 4439 B9R0.6 CCSC(C)C(N)C(=O)O Amb26359481 [0,2,0,0,0,0|0,1,0]=3 4440 B9R0.6 COCC(=O)C(N)C(C)C Amb27656120 [0,2,0,0,0,0|1,0,0]=3 4441 B9R0.6 COCC(=O)N(N)C(C)C Amb33191480 [0,2,0,0,0,0|2,0,0]=4 4442 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [0,2,0,0,0,0|1,0,0]=3 4443 B9R0.6 COCC(C)C(Cl)C(N)=O Amb27614969 [0,2,0,0,0,0|2,0,0]=4 4444 B9R0.6 COCC(C)C(N)C(=O)O Amb24116980 [0,2,0,0,0,0|0,0,0]=2 4445 B9R0.6 COCC(C)C(N)C(N)=O Amb24468545 [0,2,0,0,0,0|1,0,0]=3 4446 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [0,2,0,0,0,0|1,0,0]=3 4447 B9R0.6 COCC(C)[C@@H](N)C(=O)O Amb26467489 [0,2,0,0,0,0|0,0,0]=2 4448 B9R0.6 COCC(C)[C@H](N)C(=O)O Amb25729786 [0,2,0,0,0,0|0,0,0]=2 4449 B9R0.6 COCC(O)C(N)C(=O)O Amb25147551 [0,2,0,0,0,0|0,0,0]=2 4450 B9R0.6 COC\C(O)=C(/N)C(=O)O Amb27786739 [0,2,0,0,0,0|0,0,2]=4 4451 B9R0.6 CONC(=O)C(Br)C(C)C Amb28239997 [0,2,0,0,0,0|2,0,0]=4 4452 B9R0.6 CONC(=O)C(C)C(C)N Amb28044644 [0,2,0,0,0,0|2,0,0]=4 4453 B9R0.6 CONC(=O)C(N)C(C)C Amb28245106 [0,2,0,0,0,0|1,0,0]=3 4454 B9R0.6 CONC(=O)[C@H](O)C(C)C Amb27833456 [0,2,0,0,0,0|2,0,0]=4 4455 B9R0.6 CO\N=C(/C)C(C)C(=O)O Amb27618373 [0,2,0,0,0,0|1,0,1]=4 4456 B9R0.6 CSCC(C)C(N)C(=O)O Amb27161222 [0,2,0,0,0,0|0,1,0]=3 4457 B9R0.6 CSCC(C)[C@H](N)C(=O)O Amb28137881 [0,2,0,0,0,0|0,1,0]=3 4458 B9R0.6 CSCC(O)C(N)C(=O)O Amb18646340 [0,2,0,0,0,0|0,0,0]=2 4459 B9R0.6 CSC[C@@H](C)C(N)C(=O)O Amb27629392 [0,2,0,0,0,0|0,1,0]=3 4460 B9R0.6 CSC[C@H](O)[C@@H](N)C(=O)O Amb28320767 [0,2,0,0,0,0|0,0,0]=2 4461 B9R0.6 C[C@@H](CCCl)[C@H](N)C(=O)O Amb28203940 [0,2,0,0,0,0|1,0,0]=3 4462 B9R0.6 C[C@@H](O)[C@@H](O)[C@@H](O)CC=O Amb27873208 [0,2,0,0,0,0|1,0,1]=4 4463 B9R0.6 C[C@@H](OC=O)[C@H](N)C(=O)O Amb27972267 [0,2,0,0,0,0|0,0,0]=2 4464 B9R0.6 C[C@H](C(=O)O)[C@@H](C)OC=O Amb27391147 [0,2,0,0,0,0|1,0,0]=3 4465 B9R0.6 C[C@H](N=[N+]=[N-])[C@H](O)C(=O)O Amb27238502 [0,2,0,0,0,0|2,0,0]=4 4466 B9R0.6 C[C@H](O)[C@@H](O)[C@@H](O)CC=O Amb25679039 [0,2,0,0,0,0|1,0,1]=4 4467 B9R0.6 C[C@H](O)[C@@H](O)[C@H](O)CC=O Amb27431946 [0,2,0,0,0,0|1,0,1]=4 4468 B9R0.6 C[C@H](OC=O)[C@H](C)C(=O)O Amb27620887 [0,2,0,0,0,0|1,0,0]=3 4469 B9R0.6 C\C=C\C(C)C(C)C(=O)O Amb28346501 [0,2,0,0,0,0|2,0,0]=4 4470 B9R0.6 C\C=C\[C@@H](C)[C@H](Br)C(=O)O Amb27849000 [0,2,0,0,0,0|2,0,0]=4 4471 B9R0.6 C\C=C\[C@H](C)[C@H](C)C(=O)O Amb27630536 [0,2,0,0,0,0|2,0,0]=4 4472 B9R0.6 NC(C(=O)O)C(O)CCF Amb33196437 [0,2,0,0,0,0|0,0,0]=2 4473 B9R0.6 NCCC(F)C(N)C(=O)O Amb28204060 [0,2,0,0,0,0|1,0,0]=3 4474 B9R0.6 NCCC(N)C(N)C(=O)O Amb27759858 [0,2,0,0,0,0|1,0,0]=3 4475 B9R0.6 NCC[C@@H](F)[C@H](N)C(=O)O Amb27818085 [0,2,0,0,0,0|1,0,0]=3 4476 B9R0.6 NCC[C@@H](O)[C@H](N)C(=O)O Amb27800764 [0,2,0,0,0,0|0,0,0]=2 4477 B9R0.6 NCC[C@H](O)[C@H](N)C(=O)O Amb27263062 [0,2,0,0,0,0|0,0,0]=2 4478 B9R0.25 C#CC(=O)[C@@H](N)C(C)(C)C Amb35623685 [0,2,0,0,0,0|2,0,0]=4 4479 B9R0.25 C#CC(=O)[C@H](N)C(C)(C)C Amb35617508 [0,2,0,0,0,0|2,0,0]=4 4480 B9R0.25 C=CC(=O)C(N)C(C)(C)C Amb28145096 [0,2,0,0,0,0|2,0,0]=4 4481 B9R0.25 C=CC(=O)[C@@H](N)C(C)(C)C Amb35623686 [0,2,0,0,0,0|2,0,0]=4 4482 B9R0.25 C=CC(=O)[C@H](N)C(C)(C)C Amb35617509 [0,2,0,0,0,0|2,0,0]=4 4483 B9R0.25 CC(C(=O)NO)C(C)(C)C Amb27753555 [0,2,0,0,0,0|2,0,0]=4 4484 B9R0.25 CC(C)(C)C(N)C(=O)NO Amb24760873 [0,2,0,0,0,0|1,0,0]=3 4485 B9R0.25 CCC(=O)C(N)C(C)(C)C Amb28050323 [0,2,0,0,0,0|2,0,0]=4 4486 B9R0.25 CCC(=O)[C@@H](N)C(C)(C)C Amb35623687 [0,2,0,0,0,0|2,0,0]=4 4487 B9R0.25 CCC(=O)[C@H](N)C(C)(C)C Amb35617510 [0,2,0,0,0,0|2,0,0]=4 4488 B9R0.25 CCC(C)C(N)P(=O)(O)O Amb8516014 [0,2,0,0,0,0|2,0,0]=4 4489 B9R0.25 CCC(O)C(S)P(=O)(O)O Amb28050574 [0,2,0,0,0,0|2,0,0]=4 4490 B9R0.25 CCC(O)C(S)S(=O)(=O)O Amb27771486 [0,2,0,0,0,0|2,0,0]=4 4491 B9R0.25 CC[C@H](C)[C@@H](N)P(=O)(O)O Amb27615025 [0,2,0,0,0,0|2,0,0]=4 4492 B9R0.25 CNC(=O)C(N)C(C)(C)C Amb18523738 [0,2,0,0,0,0|2,0,0]=4 4493 B9R0.25 CNC(=O)C(N)C(C)(C)S Amb27475994 [0,2,0,0,0,0|1,1,0]=4 4494 B9R0.25 CNC(=O)[C@@H](N)C(C)(C)C Amb22801719 [0,2,0,0,0,0|2,0,0]=4 4495 B9R0.25 CNC(=O)[C@@H](N)C(C)(C)C Amb32412135 [0,2,0,0,0,0|2,0,0]=4 4496 B9R0.25 CNC(=O)[C@@H](N)C(C)(C)O Amb27236691 [0,2,0,0,0,0|1,0,0]=3 4497 B9R0.25 COC(=O)C(Br)C(C)(C)C Amb26856421 [0,2,0,0,0,0|2,0,0]=4 4498 B9R0.25 COC(=O)C(C)C(C)(C)C Amb10558498 [0,2,0,0,0,0|2,0,0]=4 4499 B9R0.25 COC(=O)C(N)C(C)(C)C Amb2425516 [0,2,0,0,0,0|1,0,0]=3 4500 B9R0.25 COC(=O)C(N)C(C)(C)C Amb33473692 [0,2,0,0,0,0|1,0,0]=3 4501 B9R0.25 COC(=O)C(N)C(C)(C)F Amb25662650 [0,2,0,0,0,0|1,0,0]=3 4502 B9R0.25 COC(=O)C(N)C(C)(C)O Amb23399555 [0,2,0,0,0,0|0,0,0]=2 4503 B9R0.25 COC(=O)C(N)C(C)(F)F Amb28322787 [0,2,0,0,0,0|1,0,0]=3 4504 B9R0.25 COC(=O)C(N)C(C)(F)F Amb35753107 [0,2,0,0,0,0|1,0,0]=3 4505 B9R0.25 COC(=O)C(N)C(F)(F)F Amb10840309 [0,2,0,0,0,0|2,0,0]=4 4506 B9R0.25 COC(=O)C(N)C(F)(F)F Amb2694681 [0,2,0,0,0,0|2,0,0]=4 4507 B9R0.25 COC(=O)C(O)C(C)(C)C Amb27784083 [0,2,0,0,0,0|2,0,0]=4 4508 B9R0.25 COC(=O)C(O)C(C)(C)F Amb28280903 [0,2,0,0,0,0|2,0,0]=4 4509 B9R0.25 COC(=O)C(O)C(C)(C)N Amb25683764 [0,2,0,0,0,0|2,0,0]=4 4510 B9R0.25 COC(=O)C(O)C(C)(C)N Amb28555594 [0,2,0,0,0,0|2,0,0]=4 4511 B9R0.25 COC(=O)C(O)C(C)(C)S Amb28207123 [0,2,0,0,0,0|1,1,0]=4 4512 B9R0.25 COC(=O)C(O)C(C)(F)F Amb33009657 [0,2,0,0,0,0|2,0,0]=4 4513 B9R0.25 COC(=O)N(N)C(C)(C)C Amb33191366 [0,2,0,0,0,0|2,0,0]=4 4514 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C Amb19374784 [0,2,0,0,0,0|1,0,0]=3 4515 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C Amb9824752 [0,2,0,0,0,0|1,0,0]=3 4516 B9R0.25 COC(=O)[C@@H](N)C(C)(C)F Amb28364468 [0,2,0,0,0,0|1,0,0]=3 4517 B9R0.25 COC(=O)[C@@H](N)C(C)(C)O Amb28132587 [0,2,0,0,0,0|0,0,0]=2 4518 B9R0.25 COC(=O)[C@@H](N)C(C)(C)S Amb24482143 [0,2,0,0,0,0|0,1,0]=3 4519 B9R0.25 COC(=O)[C@@H](N)C(F)(F)F Amb27413025 [0,2,0,0,0,0|2,0,0]=4 4520 B9R0.25 COC(=O)[C@H](N)C(C)(C)C Amb26612833 [0,2,0,0,0,0|1,0,0]=3 4521 B9R0.25 COC(=O)[C@H](N)C(C)(C)C Amb33801635 [0,2,0,0,0,0|1,0,0]=3 4522 B9R0.25 COC(=O)[C@H](N)C(C)(C)S Amb28076574 [0,2,0,0,0,0|0,1,0]=3 4523 B9R0.27 C#CC(=O)[C@@H](N)C(C)CC Amb35617475 [0,2,0,0,0,0|2,0,0]=4 4524 B9R0.27 C#CC(=O)[C@@H](N)[C@@H](C)CC Amb35617476 [0,2,0,0,0,0|2,0,0]=4 4525 B9R0.27 C#CC(C)C(O)C(=O)OC Amb27839201 [0,2,0,0,0,0|2,0,0]=4 4526 B9R0.27 C#C[C@H](C)[C@@H](O)C(=O)OC Amb27980516 [0,2,0,0,0,0|2,0,0]=4 4527 B9R0.27 C=C(C(=O)OC)C(C)CO Amb25335437 [0,2,0,0,0,0|1,0,1]=4 4528 B9R0.27 C=C(C(=O)OC)C(O)CC Amb27755500 [0,2,0,0,0,0|1,0,1]=4 4529 B9R0.27 C=C(C(=O)OC)C(O)CO Amb27853545 [0,2,0,0,0,0|1,0,1]=4 4530 B9R0.27 C=C(C(=O)OC)[C@H](O)CO Amb27451995 [0,2,0,0,0,0|1,0,1]=4 4531 B9R0.27 C=C(CC)[C@@H](N)C(=O)OC Amb27855580 [0,2,0,0,0,0|1,0,1]=4 4532 B9R0.27 C=C(OC)C(N)C(=O)OC Amb28422733 [0,2,0,0,0,0|0,0,2]=4 4533 B9R0.27 C=CC(=O)C(N)C(C)CC Amb28050472 [0,2,0,0,0,0|2,0,0]=4 4534 B9R0.27 C=CC(C)C(C)C(=O)NO Amb27589393 [0,2,0,0,0,0|2,0,0]=4 4535 B9R0.27 C=CC(C)C(N)C(=O)OC Amb18644005 [0,2,0,0,0,0|1,0,0]=3 4536 B9R0.27 C=CC(C)C(N)C(=O)OC Amb24271135 [0,2,0,0,0,0|1,0,0]=3 4537 B9R0.27 C=CC(O)C(C)C(=O)OC Amb26398909 [0,2,0,0,0,0|1,0,1]=4 4538 B9R0.27 C=CC(O)C(O)C(=O)OC Amb28139301 [0,2,0,0,0,0|1,0,1]=4 4539 B9R0.27 C=C[C@@H](C)[C@H](N)C(=O)OC Amb27815032 [0,2,0,0,0,0|1,0,0]=3 4540 B9R0.27 C=C[C@@H](C)[C@H](O)C(=O)OC Amb27839535 [0,2,0,0,0,0|2,0,0]=4 4541 B9R0.27 C=C[C@H](O)[C@H](C)C(=O)OC Amb28207288 [0,2,0,0,0,0|1,0,1]=4 4542 B9R0.27 C=C[C@H](O)[C@H](O)C(=O)OC Amb27839364 [0,2,0,0,0,0|1,0,1]=4 4543 B9R0.27 CC(CO)C(O)C(O)C=O Amb28430799 [0,2,0,0,0,0|1,0,1]=4 4544 B9R0.27 CCC(=O)C(C)C(C)CO Amb28079323 [0,2,0,0,0,0|2,0,0]=4 4545 B9R0.27 CCC(=O)C(N)C(C)CC Amb27838050 [0,2,0,0,0,0|2,0,0]=4 4546 B9R0.27 CCC(=O)C(O)C(O)CO Amb27434229 [0,2,0,0,0,0|2,0,0]=4 4547 B9R0.27 CCC(=O)[C@@H](O)[C@H](O)CC Amb28049857 [0,2,0,0,0,0|2,0,0]=4 4548 B9R0.27 CCC(=O)[C@H](N)[C@@H](C)CC Amb27461445 [0,2,0,0,0,0|2,0,0]=4 4549 B9R0.27 CCC(=O)[C@H](O)[C@H](O)CO Amb24647600 [0,2,0,0,0,0|2,0,0]=4 4550 B9R0.27 CCC(C)C(Br)C(=O)OC Amb27797258 [0,2,0,0,0,0|2,0,0]=4 4551 B9R0.27 CCC(C)C(C)C(=O)OC Amb27605074 [0,2,0,0,0,0|2,0,0]=4 4552 B9R0.27 CCC(C)C(Cl)C(=O)OC Amb18800857 [0,2,0,0,0,0|2,0,0]=4 4553 B9R0.27 CCC(C)C(N)C(=O)NC Amb32666144 [0,2,0,0,0,0|2,0,0]=4 4554 B9R0.27 CCC(C)C(N)C(=O)NC Amb6262886 [0,2,0,0,0,0|2,0,0]=4 4555 B9R0.27 CCC(C)C(N)C(=O)OC Amb1154182 [0,2,0,0,0,0|1,0,0]=3 4556 B9R0.27 CCC(C)C(N)C(=O)OC Amb9703020 [0,2,0,0,0,0|1,0,0]=3 4557 B9R0.27 CCC(C)C(O)C(=O)OC Amb23596600 [0,2,0,0,0,0|2,0,0]=4 4558 B9R0.27 CCC(C)[C@H](N)C(=O)NC Amb17231991 [0,2,0,0,0,0|2,0,0]=4 4559 B9R0.27 CCC(N)C(O)C(=O)OC Amb28555515 [0,2,0,0,0,0|2,0,0]=4 4560 B9R0.27 CCC(O)C(C)C(=O)NC Amb27200580 [0,2,0,0,0,0|2,0,0]=4 4561 B9R0.27 CCC(O)C(C)C(=O)OC Amb24731247 [0,2,0,0,0,0|1,0,0]=3 4562 B9R0.27 CCC(O)C(N)C(=O)OC Amb18644322 [0,2,0,0,0,0|0,0,0]=2 4563 B9R0.27 CCC(O)[C@@H](N)C(=O)OC Amb28132679 [0,2,0,0,0,0|0,0,0]=2 4564 B9R0.27 CCN(O)C(C)C(=O)OC Amb27216870 [0,2,0,0,0,0|2,0,0]=4 4565 B9R0.27 CC[C@@H](C)[C@@H](N)C(=O)OC Amb28341323 [0,2,0,0,0,0|1,0,0]=3 4566 B9R0.27 CC[C@@H](C)[C@@H](O)C(=O)OC Amb28138586 [0,2,0,0,0,0|2,0,0]=4 4567 B9R0.27 CC[C@@H](C)[C@H](O)C(=O)OC Amb27484517 [0,2,0,0,0,0|2,0,0]=4 4568 B9R0.27 CC[C@@H](O)[C@@H](O)[C@@H](O)C=O Amb28345011 [0,2,0,0,0,0|1,0,1]=4 4569 B9R0.27 CC[C@@H](O)[C@H](O)C(=O)OC Amb28065109 [0,2,0,0,0,0|1,0,0]=3 4570 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC Amb22747221 [0,2,0,0,0,0|1,0,0]=3 4571 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC Amb28350478 [0,2,0,0,0,0|1,0,0]=3 4572 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl Amb30633186 [0,2,0,0,0,0|2,0,0]=4 4573 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC Amb24478007 [0,2,0,0,0,0|2,0,0]=4 4574 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC Amb33446989 [0,2,0,0,0,0|2,0,0]=4 4575 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NO Amb25146430 [0,2,0,0,0,0|1,0,0]=3 4576 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC Amb533936 [0,2,0,0,0,0|1,0,0]=3 4577 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC Amb8390409 [0,2,0,0,0,0|1,0,0]=3 4578 B9R0.27 CC[C@H](N)C(O)C(=O)OC Amb27759874 [0,2,0,0,0,0|2,0,0]=4 4579 B9R0.27 CC[C@H](N)[C@@H](N)C(=O)OC Amb27985351 [0,2,0,0,0,0|1,0,0]=3 4580 B9R0.27 CC[C@H](N)[C@@H](O)C(=O)OC Amb27768624 [0,2,0,0,0,0|2,0,0]=4 4581 B9R0.27 CC[C@H](O)[C@@H](N)[C@H](O)CC Amb27408746 [0,2,0,0,0,0|1,0,1]=4 4582 B9R0.27 CC[C@H](O)[C@@H](O)C(=O)OC Amb27839536 [0,2,0,0,0,0|1,0,0]=3 4583 B9R0.27 CC[C@H](O)[C@H](C)C(=O)NC Amb27620232 [0,2,0,0,0,0|2,0,0]=4 4584 B9R0.27 CC[C@H](O)[C@H](N)C(=O)OC Amb28120015 [0,2,0,0,0,0|0,0,0]=2 4585 B9R0.27 CNC(=O)C(O)C(C)OC Amb28315930 [0,2,0,0,0,0|2,0,0]=4 4586 B9R0.27 CNC(=O)[C@@H](N)[C@@H](C)OC Amb32723111 [0,2,0,0,0,0|1,0,0]=3 4587 B9R0.27 COC(=O)C(=O)C(C)OC Amb28381261 [0,2,0,0,0,0|1,0,1]=4 4588 B9R0.27 COC(=O)C(Br)C(Br)CBr Amb20241612 [0,2,0,0,0,0|2,0,0]=4 4589 B9R0.27 COC(=O)C(C)C(C)CO Amb27945381 [0,2,0,0,0,0|1,0,0]=3 4590 B9R0.27 COC(=O)C(C)C(Cl)OC Amb27878631 [0,2,0,0,0,0|2,0,0]=4 4591 B9R0.27 COC(=O)C(C)C(O)CO Amb27763921 [0,2,0,0,0,0|1,0,0]=3 4592 B9R0.27 COC(=O)C(Cl)C(C)OC Amb24373136 [0,2,0,0,0,0|1,0,0]=3 4593 B9R0.27 COC(=O)C(Cl)C(C)SC Amb27185586 [0,2,0,0,0,0|1,1,0]=4 4594 B9R0.27 COC(=O)C(Cl)C(Cl)CCl Amb27791996 [0,2,0,0,0,0|2,0,0]=4 4595 B9R0.27 COC(=O)C(Cl)C(Cl)OC Amb27650703 [0,2,0,0,0,0|2,0,0]=4 4596 B9R0.27 COC(=O)C(N)C(=O)OC Amb2778854 [0,2,0,0,0,0|0,0,2]=4 4597 B9R0.27 COC(=O)C(N)C(=O)OC Amb8517111 [0,2,0,0,0,0|0,0,2]=4 4598 B9R0.27 COC(=O)C(N)C(C)C#N Amb33066140 [0,2,0,0,0,0|1,0,0]=3 4599 B9R0.27 COC(=O)C(N)C(C)CO Amb33066102 [0,2,0,0,0,0|0,0,0]=2 4600 B9R0.27 COC(=O)C(N)C(C)OC Amb25111509 [0,2,0,0,0,0|0,0,0]=2 4601 B9R0.27 COC(=O)C(N)C(O)CCl Amb27436705 [0,2,0,0,0,0|0,0,0]=2 4602 B9R0.27 COC(=O)C(O)C(C)C#N Amb27162771 [0,2,0,0,0,0|2,0,0]=4 4603 B9R0.27 COC(=O)C(O)C(C)C=O Amb28126610 [0,2,0,0,0,0|1,0,1]=4 4604 B9R0.27 COC(=O)C(O)C(C)CN Amb27465415 [0,2,0,0,0,0|2,0,0]=4 4605 B9R0.27 COC(=O)C(O)C(O)CCl Amb28121926 [0,2,0,0,0,0|1,0,0]=3 4606 B9R0.27 COC(=O)[C@@H](C)[C@@H](O)CO Amb27805350 [0,2,0,0,0,0|1,0,0]=3 4607 B9R0.27 COC(=O)[C@@H](Cl)[C@@H](C)OC Amb27233550 [0,2,0,0,0,0|1,0,0]=3 4608 B9R0.27 COC(=O)[C@@H](N)C(C)OC Amb27879002 [0,2,0,0,0,0|0,0,0]=2 4609 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)OC Amb27817562 [0,2,0,0,0,0|0,0,0]=2 4610 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)OC Amb33483415 [0,2,0,0,0,0|0,0,0]=2 4611 B9R0.27 COC(=O)[C@@H](N)[C@H](C)OC Amb28251917 [0,2,0,0,0,0|0,0,0]=2 4612 B9R0.27 COC(=O)[C@@H](O)[C@@H](C)OC Amb27456964 [0,2,0,0,0,0|1,0,0]=3 4613 B9R0.27 COC(=O)[C@@H](O)[C@H](O)CCl Amb28126702 [0,2,0,0,0,0|1,0,0]=3 4614 B9R0.27 COC(=O)[C@H](Br)[C@@H](C)OC Amb28323609 [0,2,0,0,0,0|1,0,0]=3 4615 B9R0.27 COC(=O)[C@H](Cl)[C@@H](C)OC Amb27798305 [0,2,0,0,0,0|1,0,0]=3 4616 B9R0.27 COC(=O)[C@H](N)[C@@H](C)OC Amb27453476 [0,2,0,0,0,0|0,0,0]=2 4617 B9R0.27 COC(=O)[C@H](O)[C@@H](O)CO Amb27839500 [0,2,0,0,0,0|1,0,0]=3 4618 B9R0.27 COC(=O)[C@H](O)[C@H](C)OC Amb27752349 [0,2,0,0,0,0|1,0,0]=3 4619 B9R0.27 C[C@H](CO)[C@@H](O)[C@H](O)C=O Amb27207777 [0,2,0,0,0,0|1,0,1]=4 4620 B9R0.27 NC(C(O)C=O)C(O)CO Amb27837971 [0,2,0,0,0,0|0,0,1]=3 4621 B9R0.27 N[C@@H]([C@H](O)CO)[C@@H](O)C=O Amb28251001 [0,2,0,0,0,0|0,0,1]=3 4622 B9R0.27 N[C@H]([C@H](O)CO)[C@@H](O)C=O Amb28041824 [0,2,0,0,0,0|0,0,1]=3 4623 B9R0.27 O=C(CO)C(=O)C(O)CO Amb27458696 [0,2,0,0,0,0|1,0,1]=4 4624 B9R0.27 O=C(CO)C(=O)[C@H](O)CO Amb28126619 [0,2,0,0,0,0|1,0,1]=4 4625 B9R0.27 O=C(CO)C(O)C(O)CBr Amb28325803 [0,2,0,0,0,0|1,0,0]=3 4626 B9R0.27 O=C(CO)C(O)C(O)CCl Amb27596631 [0,2,0,0,0,0|1,0,0]=3 4627 B9R0.27 O=C(CO)C(O)C(O)CO Amb25099014 [0,2,0,0,0,0|1,0,0]=3 4628 B9R0.27 O=C(CO)C(O)C(O)CS Amb27861266 [0,2,0,0,0,0|1,0,0]=3 4629 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CBr Amb27180827 [0,2,0,0,0,0|1,0,0]=3 4630 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CCl Amb27961447 [0,2,0,0,0,0|1,0,0]=3 4631 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO Amb6599969 [0,2,0,0,0,0|1,0,0]=3 4632 B9R0.27 O=C(CO)[C@H](O)[C@H](O)CF Amb28074784 [0,2,0,0,0,0|1,0,0]=3 4633 B9R0.27 O=C(NO)[C@@H](O)[C@@H](O)CO Amb27652927 [0,2,0,0,0,0|1,0,0]=3 4634 B9R0.27 O=C(NO)[C@H](O)[C@@H](O)CO Amb28189337 [0,2,0,0,0,0|1,0,0]=3 4635 B9R0.27 O=C(NO)[C@H](O)[C@H](O)CO Amb27946842 [0,2,0,0,0,0|1,0,0]=3 4636 B9R0.27 O=C(O[K])[C@H](O)[C@H](O)CO Amb8384042 [0,2,0,0,0,0|1,0,0]=3 4637 B9R0.27 O=CC(=O)[C@@H](O)[C@@H](O)CO Amb27455044 [0,2,0,0,0,0|1,0,1]=4 4638 B9R0.27 O=CC(=O)[C@@H](O)[C@H](O)CO Amb27635237 [0,2,0,0,0,0|1,0,1]=4 4639 B9R0.27 O=CC(=O)[C@H](O)[C@H](O)CO Amb28077016 [0,2,0,0,0,0|1,0,1]=4 4640 B9R0.27 O=CC(O)C(F)C(O)CO Amb28253834 [0,2,0,0,0,0|1,0,1]=4 4641 B9R0.27 O=CC(O)C(O)C(O)CO Amb9786761 [0,2,0,0,0,0|1,0,1]=4 4642 B9R0.27 O=CC(O)C(O)C(O)CS Amb28365122 [0,2,0,0,0,0|1,0,1]=4 4643 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@@H](O)CO Amb8628489 [0,2,0,0,0,0|1,0,1]=4 4644 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO Amb10807416 [0,2,0,0,0,0|1,0,1]=4 4645 B9R0.27 O=C[C@@H](O)[C@H](O)[C@@H](O)CO Amb3940879 [0,2,0,0,0,0|1,0,1]=4 4646 B9R0.27 O=C[C@@H](O)[C@H](O)[C@H](O)CO Amb8628829 [0,2,0,0,0,0|1,0,1]=4 4647 B9R0.27 O=C[C@H](O)C(O)C(O)CO Amb27759377 [0,2,0,0,0,0|1,0,1]=4 4648 B9R0.27 O=C[C@H](O)[C@@H](O)[C@@H](O)CO Amb3940859 [0,2,0,0,0,0|1,0,1]=4 4649 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CO Amb10843531 [0,2,0,0,0,0|1,0,1]=4 4650 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CS Amb27838040 [0,2,0,0,0,0|1,0,1]=4 4651 B9R0.27 O=C[C@H](O)[C@H](O)C(=O)CO Amb27837984 [0,2,0,0,0,0|1,0,1]=4 4652 B9R0.27 O=C[C@H](O)[C@H](O)[C@@H](O)CO Amb25146279 [0,2,0,0,0,0|1,0,1]=4 4653 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO Amb3940856 [0,2,0,0,0,0|1,0,1]=4 4654 B9R0.28 C#CC(C)C(C)(N)C(=O)O Amb25061187 [0,2,0,0,0,0|1,0,0]=3 4655 B9R0.28 C#CC(C)C(C)(O)C(=O)O Amb28208473 [0,2,0,0,0,0|2,0,0]=4 4656 B9R0.28 C=CC(C)C(Cl)(Cl)C(=O)O Amb27478232 [0,2,0,0,0,0|2,0,0]=4 4657 B9R0.28 C=CC(O)C(C)(C)C(=O)O Amb24568657 [0,2,0,0,0,0|1,0,1]=4 4658 B9R0.28 C=C[C@@H](C)[C@@](C)(O)C(=O)O Amb27874076 [0,2,0,0,0,0|2,0,0]=4 4659 B9R0.28 CC(C#N)C(C)(C)C(=O)O Amb27626028 [0,2,0,0,0,0|2,0,0]=4 4660 B9R0.28 CC(C)(C(=O)O)C(N)CO Amb27808913 [0,2,0,0,0,0|2,0,0]=4 4661 B9R0.28 CC(C)(C(=O)O)[C@@H](N)CO Amb27602524 [0,2,0,0,0,0|2,0,0]=4 4662 B9R0.28 CC(C)C(C)(N)C(=O)CBr Amb28126791 [0,2,0,0,0,0|2,0,0]=4 4663 B9R0.28 CC(CO)C(C)(C)C(=O)O Amb27857073 [0,2,0,0,0,0|1,0,0]=3 4664 B9R0.28 CC(N)(C(=O)O)C(O)CO Amb27393917 [0,2,0,0,0,0|0,0,0]=2 4665 B9R0.28 CC(O)(C(=O)O)C(O)CN Amb27237582 [0,2,0,0,0,0|1,0,0]=3 4666 B9R0.28 CCC(C)C(C)(C)C(=O)O Amb26861529 [0,2,0,0,0,0|2,0,0]=4 4667 B9R0.28 CCC(C)C(C)(N)C(=O)O Amb28428774 [0,2,0,0,0,0|1,0,0]=3 4668 B9R0.28 CCC(C)C(C)(N)C(=O)O Amb33733696 [0,2,0,0,0,0|1,0,0]=3 4669 B9R0.28 CCC(C)C(F)(F)C(=O)O Amb32811211 [0,2,0,0,0,0|2,0,0]=4 4670 B9R0.28 CCC(C)C(N)(N)C(=O)O Amb27759305 [0,2,0,0,0,0|1,0,0]=3 4671 B9R0.28 CCC(C)C(O)(O)C(=O)O Amb28314146 [0,2,0,0,0,0|2,0,0]=4 4672 B9R0.28 CCC(F)C(F)(F)C(=O)O Amb32946937 [0,2,0,0,0,0|2,0,0]=4 4673 B9R0.28 CCC(N)C(C)(C)C(=O)O Amb27633803 [0,2,0,0,0,0|2,0,0]=4 4674 B9R0.28 CCC(N)C(F)(F)C(=O)O Amb27389566 [0,2,0,0,0,0|2,0,0]=4 4675 B9R0.28 CCC(O)C(C)(C)C(=O)O Amb18989578 [0,2,0,0,0,0|1,0,0]=3 4676 B9R0.28 CCC(O)C(C)(O)C(C)=O Amb28199985 [0,2,0,0,0,0|2,0,0]=4 4677 B9R0.28 CCC(O)C(Cl)(Cl)C(C)=O Amb27839335 [0,2,0,0,0,0|2,0,0]=4 4678 B9R0.28 CCC(O)C(F)(F)C(=O)O Amb18796752 [0,2,0,0,0,0|1,0,0]=3 4679 B9R0.28 CC[C@@H](C)[C@](C)(N)C(=O)O Amb25946335 [0,2,0,0,0,0|1,0,0]=3 4680 B9R0.28 CC[C@H](C)[C@@](C)(N)C(=O)O Amb27153391 [0,2,0,0,0,0|1,0,0]=3 4681 B9R0.28 CC[C@H](C)[C@](C)(N)C(=O)O Amb24538030 [0,2,0,0,0,0|1,0,0]=3 4682 B9R0.28 CC[C@H](O)[C@@](C)(O)C(=O)O Amb27221818 [0,2,0,0,0,0|1,0,0]=3 4683 B9R0.28 CNC(=O)C(C)(N)C(C)C Amb27831478 [0,2,0,0,0,0|2,0,0]=4 4684 B9R0.28 CNC(=O)[C@@](C)(N)[C@H](C)O Amb27841874 [0,2,0,0,0,0|1,0,0]=3 4685 B9R0.28 COC(=O)C(C)(Br)C(C)C Amb27810643 [0,2,0,0,0,0|2,0,0]=4 4686 B9R0.28 COC(=O)C(C)(C)C(C)C Amb23589746 [0,2,0,0,0,0|2,0,0]=4 4687 B9R0.28 COC(=O)C(C)(C)C(C)N Amb18124747 [0,2,0,0,0,0|2,0,0]=4 4688 B9R0.28 COC(=O)C(C)(C)C(C)O Amb27424899 [0,2,0,0,0,0|1,0,0]=3 4689 B9R0.28 COC(=O)C(C)(Cl)C(C)Cl Amb27591593 [0,2,0,0,0,0|2,0,0]=4 4690 B9R0.28 COC(=O)C(C)(N)C(C)C Amb18989923 [0,2,0,0,0,0|1,0,0]=3 4691 B9R0.28 COC(=O)C(C)(N)C(C)O Amb18644324 [0,2,0,0,0,0|0,0,0]=2 4692 B9R0.28 COC(=O)C(C)(N)C(F)F Amb27645352 [0,2,0,0,0,0|2,0,0]=4 4693 B9R0.28 COC(=O)C(C)(O)C(C)C Amb26446314 [0,2,0,0,0,0|2,0,0]=4 4694 B9R0.28 COC(=O)C(F)(F)C(C)O Amb27445275 [0,2,0,0,0,0|1,0,0]=3 4695 B9R0.28 COC(=O)[C@@](C)(N)C(C)C Amb24456742 [0,2,0,0,0,0|1,0,0]=3 4696 B9R0.28 COC(=O)[C@@](C)(N)C(F)F Amb27792710 [0,2,0,0,0,0|2,0,0]=4 4697 B9R0.28 COC(=O)[C@@](C)(N)[C@@H](C)O Amb28245860 [0,2,0,0,0,0|0,0,0]=2 4698 B9R0.28 COC(=O)[C@@](C)(N)[C@H](C)O Amb27185503 [0,2,0,0,0,0|0,0,0]=2 4699 B9R0.28 COC(=O)[C@](C)(N)[C@H](C)O Amb28055991 [0,2,0,0,0,0|0,0,0]=2 4700 B9R0.28 C[C@@](O)(C(=O)O)[C@@H](O)CO Amb27823380 [0,2,0,0,0,0|1,0,0]=3 4701 B9R0.28 C[C@@](O)(C(=O)O)[C@H](O)CO Amb27411591 [0,2,0,0,0,0|1,0,0]=3 4702 B9R0.28 C[C@](O)(C(=O)O)[C@@H](O)CO Amb28289809 [0,2,0,0,0,0|1,0,0]=3 4703 B9R0.28 C[C@](O)(C(=O)O)[C@H](O)CN Amb27623544 [0,2,0,0,0,0|1,0,0]=3 4704 B9R0.28 C\C(=N/O)C(C)(C)C(=O)O Amb27472982 [0,2,0,0,0,0|1,0,1]=4 4705 B9R0.28 NC(CF)C(F)(F)C(=O)O Amb27841809 [0,2,0,0,0,0|2,0,0]=4 4706 B9R0.28 NC(CO)C(F)(F)C(=O)O Amb27213323 [0,2,0,0,0,0|2,0,0]=4 4707 B9R0.28 N[C@H](CO)C(F)(F)C(=O)O Amb28204164 [0,2,0,0,0,0|2,0,0]=4 4708 B9R0.29 C#CC(C)C(CC)C(=O)O Amb28119988 [0,2,0,0,0,0|2,0,0]=4 4709 B9R0.29 C=C(C)C(CN)C(=O)OC Amb33199522 [0,2,0,0,0,0|1,0,1]=4 4710 B9R0.29 C=C(C)C(NC)C(C)OC Amb28049639 [0,2,0,0,0,0|2,0,0]=4 4711 B9R0.29 C=C(C)C(NN)C(C)OC Amb27473210 [0,2,0,0,0,0|2,0,0]=4 4712 B9R0.29 C=CC(C(=O)OC)N(C)O Amb27195676 [0,2,0,0,0,0|2,0,0]=4 4713 B9R0.29 C=CC(C)C(C#N)C(=O)O Amb35741472 [0,2,0,0,0,0|1,0,1]=4 4714 B9R0.29 C=C[C@@H](C(=O)OC)[C@H](C)O Amb27766608 [0,2,0,0,0,0|1,0,0]=3 4715 B9R0.29 C=C[C@@H](C)[C@H](CC)C(=O)O Amb28251365 [0,2,0,0,0,0|2,0,0]=4 4716 B9R0.29 C=C[C@@H](C)[C@H](OC)C(=O)O Amb27173620 [0,2,0,0,0,0|2,0,0]=4 4717 B9R0.29 CC(C#N)C(C#N)C(=O)O Amb27596061 [0,2,0,0,0,0|1,0,1]=4 4718 B9R0.29 CC(CN)C(CN)C(=O)O Amb27953003 [0,2,0,0,0,0|1,0,0]=3 4719 B9R0.29 CC(CO)C(C#N)C(=O)O Amb35741474 [0,2,0,0,0,0|0,0,1]=3 4720 B9R0.29 CCC(C(=O)O)C(C)C#N Amb35719051 [0,2,0,0,0,0|2,0,0]=4 4721 B9R0.29 CCC(C(=O)O)C(C)CCl Amb27969167 [0,2,0,0,0,0|2,0,0]=4 4722 B9R0.29 CCC(C(=O)O)[C@@H](C)CC Amb28050112 [0,2,0,0,0,0|2,0,0]=4 4723 B9R0.29 CCC(C(=O)OC)C(C)N Amb27778309 [0,2,0,0,0,0|2,0,0]=4 4724 B9R0.29 CCC(C(=O)OC)C(C)O Amb25325694 [0,2,0,0,0,0|1,0,0]=3 4725 B9R0.29 CCC(C(=O)OC)[C@@H](C)O Amb27270936 [0,2,0,0,0,0|1,0,0]=3 4726 B9R0.29 CCC(C)C(C#N)C(=O)O Amb28072843 [0,2,0,0,0,0|1,0,1]=4 4727 B9R0.29 CCC(C)C(CN)C(=O)O Amb25978406 [0,2,0,0,0,0|1,0,0]=3 4728 B9R0.29 CCC(C)C(CN)C(N)=O Amb32418136 [0,2,0,0,0,0|2,0,0]=4 4729 B9R0.29 CCC(C)C(N=O)C(=O)O Amb28119173 [0,2,0,0,0,0|1,0,1]=4 4730 B9R0.29 CCC(C)C(NC)C(=O)O Amb33551329 [0,2,0,0,0,0|1,0,0]=3 4731 B9R0.29 CCC(C)C(NC)C(=O)O Amb4018745 [0,2,0,0,0,0|1,0,0]=3 4732 B9R0.29 CCC(C)C(NS)C(=O)O Amb27876164 [0,2,0,0,0,0|1,0,0]=3 4733 B9R0.29 CCC(C)C(OC)C(=O)O Amb24563898 [0,2,0,0,0,0|2,0,0]=4 4734 B9R0.29 CCC(C)C(ON)C(=O)O Amb27494007 [0,2,0,0,0,0|1,0,0]=3 4735 B9R0.29 CCC(C)[C@H](NC)C(=O)O Amb27390153 [0,2,0,0,0,0|1,0,0]=3 4736 B9R0.29 CCC(N)C(CC)C(=O)O Amb28041915 [0,2,0,0,0,0|2,0,0]=4 4737 B9R0.29 CCC(O)C(CC)C(=O)O Amb18310733 [0,2,0,0,0,0|1,0,0]=3 4738 B9R0.29 CCC(O)C(OC)C(=O)O Amb18644355 [0,2,0,0,0,0|1,0,0]=3 4739 B9R0.29 CC[C@@H](C(=O)OC)[C@@H](C)N Amb27975666 [0,2,0,0,0,0|2,0,0]=4 4740 B9R0.29 CC[C@@H](C(=O)OC)[C@@H](C)O Amb27951770 [0,2,0,0,0,0|1,0,0]=3 4741 B9R0.29 CC[C@H](C(=O)O)[C@H](N)CC Amb27461449 [0,2,0,0,0,0|2,0,0]=4 4742 B9R0.29 CC[C@H](C)[C@@H](OC)C(=O)O Amb28239702 [0,2,0,0,0,0|2,0,0]=4 4743 B9R0.29 CC[C@H](C)[C@H](CC)C(=O)O Amb28340911 [0,2,0,0,0,0|2,0,0]=4 4744 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb16183967 [0,2,0,0,0,0|1,0,0]=3 4745 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb22747123 [0,2,0,0,0,0|1,0,0]=3 4746 B9R0.29 CNC(=O)C(NC)C(C)C Amb27246326 [0,2,0,0,0,0|2,0,0]=4 4747 B9R0.29 CNC(C(=O)O)C(C)OC Amb24117895 [0,2,0,0,0,0|0,0,0]=2 4748 B9R0.29 CNC(C(=O)OC)C(C)C Amb9239395 [0,2,0,0,0,0|1,0,0]=3 4749 B9R0.29 CNC(C(=O)OC)C(C)O Amb28126781 [0,2,0,0,0,0|0,0,0]=2 4750 B9R0.29 CNC(C(N)=O)C(C)OC Amb27191735 [0,2,0,0,0,0|1,0,0]=3 4751 B9R0.29 CN[C@@H](C(=O)O)[C@@H](C)OC Amb33347469 [0,2,0,0,0,0|0,0,0]=2 4752 B9R0.29 CN[C@@H](C(=O)OC)C(C)C Amb22745354 [0,2,0,0,0,0|1,0,0]=3 4753 B9R0.29 CN[C@@H](C(=O)OC)C(C)O Amb23603655 [0,2,0,0,0,0|0,0,0]=2 4754 B9R0.29 CN[C@@H](C(=O)OC)[C@@H](C)O Amb27770605 [0,2,0,0,0,0|0,0,0]=2 4755 B9R0.29 CN[C@@H](C(=O)OC)[C@H](C)O Amb27491244 [0,2,0,0,0,0|0,0,0]=2 4756 B9R0.29 CN[C@H](C(=O)OC)C(C)C Amb16183826 [0,2,0,0,0,0|1,0,0]=3 4757 B9R0.29 CN[C@H](C(=O)OC)C(C)C Amb33813302 [0,2,0,0,0,0|1,0,0]=3 4758 B9R0.29 CN[C@H](C(=O)OC)[C@@H](C)O Amb27808325 [0,2,0,0,0,0|0,0,0]=2 4759 B9R0.29 CN[C@H](C(=O)OC)[C@@H](C)O Amb33952233 [0,2,0,0,0,0|0,0,0]=2 4760 B9R0.29 CN[C@H](C(=O)OC)[C@H](C)O Amb27436113 [0,2,0,0,0,0|0,0,0]=2 4761 B9R0.29 COC(=O)C(C#N)C(C)C Amb18643719 [0,2,0,0,0,0|1,0,1]=4 4762 B9R0.29 COC(=O)C(C=O)C(C)C Amb18644091 [0,2,0,0,0,0|2,0,0]=4 4763 B9R0.29 COC(=O)C(CCl)C(C)C Amb27969166 [0,2,0,0,0,0|2,0,0]=4 4764 B9R0.29 COC(=O)C(CN)C(=O)O Amb27235543 [0,2,0,0,0,0|0,0,2]=4 4765 B9R0.29 COC(=O)C(CN)C(C)C Amb25744585 [0,2,0,0,0,0|1,0,0]=3 4766 B9R0.29 COC(=O)C(CN)C(F)F Amb26570984 [0,2,0,0,0,0|2,0,0]=4 4767 B9R0.29 COC(=O)C(CN)N(C)C Amb28043563 [0,2,0,0,0,0|2,0,0]=4 4768 B9R0.29 COC(=O)C(CO)C(C)C Amb27161897 [0,2,0,0,0,0|2,0,0]=4 4769 B9R0.29 COC(=O)C(NN)C(C)C Amb27867029 [0,2,0,0,0,0|1,0,0]=3 4770 B9R0.29 COC(=O)C(ON)C(C)C Amb32660228 [0,2,0,0,0,0|1,0,0]=3 4771 B9R0.29 COC(=O)[C@@H](CN)[C@@H](C)O Amb27221421 [0,2,0,0,0,0|0,0,0]=2 4772 B9R0.29 COC(=O)[C@@H](CO)C(C)C Amb27617037 [0,2,0,0,0,0|2,0,0]=4 4773 B9R0.29 COC(=O)[C@@H](SC)[C@H](C)O Amb28050788 [0,2,0,0,0,0|1,0,0]=3 4774 B9R0.29 COC(=O)[C@H](CN)C(C)C Amb27468636 [0,2,0,0,0,0|1,0,0]=3 4775 B9R0.29 COC(=O)[C@H](OC)[C@H](C)O Amb27171390 [0,2,0,0,0,0|1,0,0]=3 4776 B9R0.29 COC(=O)[C@H](SC)[C@@H](C)Cl Amb27657293 [0,2,0,0,0,0|2,0,0]=4 4777 B9R0.29 COC(=O)\C(=N\O)C(C)O Amb27457855 [0,2,0,0,0,0|0,0,2]=4 4778 B9R0.29 COC(C(=O)NO)C(C)C Amb27752732 [0,2,0,0,0,0|2,0,0]=4 4779 B9R0.29 COC(C(N)=O)C(O)CO Amb27794891 [0,2,0,0,0,0|2,0,0]=4 4780 B9R0.29 C\C=C(\C(=O)OC)[C@@H](C)O Amb28292206 [0,2,0,0,0,0|1,0,1]=4 4781 B9R0.29 NCC(C(=O)O)C(O)CF Amb27955957 [0,2,0,0,0,0|0,0,0]=2 4782 B9R0.29 [C-]#[N+]C(C(=O)OC)C(C)C Amb2689490 [0,2,0,0,0,0|1,0,1]=4 4783 B9R0.29 [C-]#[N+][C@@H](C(=O)OC)C(C)C Amb33747507 [0,2,0,0,0,0|1,0,1]=4 4784 B9R0.29 [C-]#[N+][C@H](C(=O)OC)C(C)C Amb33747506 [0,2,0,0,0,0|1,0,1]=4 4785 B9R0.32 C#CC(C)(C)C(N)C(=O)O Amb27967135 [0,2,0,0,0,0|1,0,0]=3 4786 B9R0.32 C=C(C(=O)O)C(C)(C)CO Amb33197717 [0,2,0,0,0,0|1,0,1]=4 4787 B9R0.32 C=CC(C)(C)[C@H](N)C(=O)O Amb26904663 [0,2,0,0,0,0|1,0,0]=3 4788 B9R0.32 CC(=O)C(F)C(C)(O)CF Amb27802464 [0,2,0,0,0,0|2,0,0]=4 4789 B9R0.32 CC(C(=O)O)C(C)(C)CO Amb33200362 [0,2,0,0,0,0|1,0,0]=3 4790 B9R0.32 CC(C(N)=O)C(C)(C)CO Amb28364750 [0,2,0,0,0,0|2,0,0]=4 4791 B9R0.32 CC(C)(CCl)[C@H](N)C(=O)O Amb27879456 [0,2,0,0,0,0|1,0,0]=3 4792 B9R0.32 CC(C)(CF)C(N)C(=O)O Amb33376924 [0,2,0,0,0,0|1,0,0]=3 4793 B9R0.32 CC(C)(CF)C(O)C(=O)O Amb33376921 [0,2,0,0,0,0|2,0,0]=4 4794 B9R0.32 CC(C)(CN)C(O)C(=O)O Amb533284 [0,2,0,0,0,0|2,0,0]=4 4795 B9R0.32 CC(C)(CN)[C@H](O)C(=O)O Amb27174464 [0,2,0,0,0,0|2,0,0]=4 4796 B9R0.32 CC(C)(CO)C(=O)C(=O)O Amb27465183 [0,2,0,0,0,0|1,0,1]=4 4797 B9R0.32 CC(C)(CO)C(N)C(=O)O Amb17593671 [0,2,0,0,0,0|0,0,0]=2 4798 B9R0.32 CC(C)(CO)C(O)C(=O)Cl Amb24480409 [0,2,0,0,0,0|2,0,0]=4 4799 B9R0.32 CC(C)(CO)C(O)C(=O)O Amb18644357 [0,2,0,0,0,0|1,0,0]=3 4800 B9R0.32 CC(C)(CO)C(O)C(=O)[O-] Amb24118017 [0,2,0,0,0,0|1,0,1]=4 4801 B9R0.32 CC(C)(CO)C(O)C(=O)[O-] Amb32675100 [0,2,0,0,0,0|1,0,1]=4 4802 B9R0.32 CC(C)(CO)C(O)C(N)=O Amb3428050 [0,2,0,0,0,0|2,0,0]=4 4803 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O Amb27815004 [0,2,0,0,0,0|1,0,0]=3 4804 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)[O-] Amb32666639 [0,2,0,0,0,0|1,0,1]=4 4805 B9R0.32 CC(C)(CO)[C@@H](O)C(N)=O Amb27880826 [0,2,0,0,0,0|2,0,0]=4 4806 B9R0.32 CC(C)(CO)[C@H](O)C(=O)O Amb27397678 [0,2,0,0,0,0|1,0,0]=3 4807 B9R0.32 CC(C)(CS)C(N)C(=O)O Amb25889914 [0,2,0,0,0,0|0,1,0]=3 4808 B9R0.32 CC(C)C(N)P(=O)(O)CCl Amb28385579 [0,2,0,0,0,0|2,0,0]=4 4809 B9R0.32 CC(O)(C#N)C(O)C(=O)O Amb27596550 [0,2,0,0,0,0|1,0,0]=3 4810 B9R0.32 CCC(C)(C)C(C)C(=O)O Amb26991539 [0,2,0,0,0,0|2,0,0]=4 4811 B9R0.32 CCC(C)(C)C(N)C(=O)O Amb27750376 [0,2,0,0,0,0|1,0,0]=3 4812 B9R0.32 CCC(C)(C)C(N)C(=O)O Amb28555548 [0,2,0,0,0,0|1,0,0]=3 4813 B9R0.32 CCC(C)(C)C(O)C(=O)O Amb26603809 [0,2,0,0,0,0|2,0,0]=4 4814 B9R0.32 CCC(C)(C)[C@@H](C)C(=O)O Amb33727263 [0,2,0,0,0,0|2,0,0]=4 4815 B9R0.32 CCC(C)(C)[C@H](C)C(=O)O Amb33744638 [0,2,0,0,0,0|2,0,0]=4 4816 B9R0.32 CCC(C)(C)[C@H](N)C(=O)O Amb34916559 [0,2,0,0,0,0|1,0,0]=3 4817 B9R0.32 CCC(C)(F)C(N)C(=O)O Amb28399318 [0,2,0,0,0,0|1,0,0]=3 4818 B9R0.32 CCC(C)(N)C(C)C(=O)O Amb33036321 [0,2,0,0,0,0|2,0,0]=4 4819 B9R0.32 CCC(C)(N)C(O)C(=O)O Amb27389918 [0,2,0,0,0,0|2,0,0]=4 4820 B9R0.32 CCC(C)(O)C(=O)C(=O)O Amb22731859 [0,2,0,0,0,0|1,0,1]=4 4821 B9R0.32 CCC(C)(O)C(C)C(=O)O Amb18990593 [0,2,0,0,0,0|1,0,0]=3 4822 B9R0.32 CCC(C)(O)C(Cl)C(=O)O Amb27184930 [0,2,0,0,0,0|1,0,0]=3 4823 B9R0.32 CCC(C)(O)C(O)C(=O)O Amb27810824 [0,2,0,0,0,0|1,0,0]=3 4824 B9R0.32 CCC(F)(F)C(F)C(=O)O Amb32675226 [0,2,0,0,0,0|2,0,0]=4 4825 B9R0.32 CCC(F)(F)C(N)C(=O)O Amb33743871 [0,2,0,0,0,0|1,0,0]=3 4826 B9R0.32 CCP(=O)(O)C(N)C(C)C Amb27265835 [0,2,0,0,0,0|2,0,0]=4 4827 B9R0.32 CC[C@@](C)(O)C(=O)C(=O)O Amb27952470 [0,2,0,0,0,0|1,0,1]=4 4828 B9R0.32 CC[C@@](C)(S)[C@H](N)C(=O)O Amb28067632 [0,2,0,0,0,0|0,1,0]=3 4829 B9R0.32 CC[C@](C)(O)[C@H](O)C(=O)O Amb27615052 [0,2,0,0,0,0|1,0,0]=3 4830 B9R0.32 CNC(C)(C)C(O)C(=O)O Amb27411390 [0,2,0,0,0,0|2,0,0]=4 4831 B9R0.32 COC(C)(C)C(Br)C(=O)O Amb10070092 [0,2,0,0,0,0|1,0,0]=3 4832 B9R0.32 COC(C)(C)C(C)C(=O)O Amb27247404 [0,2,0,0,0,0|1,0,0]=3 4833 B9R0.32 COC(C)(C)C(Cl)C(N)=O Amb28045800 [0,2,0,0,0,0|2,0,0]=4 4834 B9R0.32 COC(C)(C)C(N)C(=O)O Amb10070091 [0,2,0,0,0,0|0,0,0]=2 4835 B9R0.32 COC(C)(C)C(O)C(=O)O Amb27830980 [0,2,0,0,0,0|1,0,0]=3 4836 B9R0.32 COC(C)(C)C(S)C(=O)O Amb28436888 [0,2,0,0,0,0|1,0,0]=3 4837 B9R0.32 COC(C)(C)[C@@H](N)C(=O)O Amb28250822 [0,2,0,0,0,0|0,0,0]=2 4838 B9R0.32 COP(=O)(O)C(N)C(C)C Amb27596865 [0,2,0,0,0,0|2,0,0]=4 4839 B9R0.32 CSC(C)(C)C(Cl)C(=O)O Amb27863425 [0,2,0,0,0,0|1,1,0]=4 4840 B9R0.32 CSC(C)(C)[C@@H](N)C(=O)O Amb24482204 [0,2,0,0,0,0|0,1,0]=3 4841 B9R0.32 C[C@@](O)(CF)[C@@H](N)C(=O)O Amb24627279 [0,2,0,0,0,0|0,0,0]=2 4842 B9R0.32 C[C@@](O)(CF)[C@H](N)C(=O)O Amb27810949 [0,2,0,0,0,0|0,0,0]=2 4843 B9R0.32 C[C@](O)(CN)[C@H](O)C(=O)O Amb25701236 [0,2,0,0,0,0|1,0,0]=3 4844 B9R0.32 NC(C(=O)O)C(F)(F)CO Amb28071021 [0,2,0,0,0,0|1,0,0]=3 4845 B9R0.32 O=C(O)C(S)C(F)(F)CF Amb27248300 [0,2,0,0,0,0|2,0,0]=4 4846 B9R0.41 C=C(C(=O)O)C(CC)OC Amb25757932 [0,2,0,0,0,0|1,0,1]=4 4847 B9R0.41 C=C(C(=O)O)C(OC)OC Amb33281755 [0,2,0,0,0,0|1,0,1]=4 4848 B9R0.41 C=C(C)C(N)C(OC)OC Amb27615085 [0,2,0,0,0,0|2,0,0]=4 4849 B9R0.41 C=C[C@H](OC)[C@@H](C)C(=O)O Amb27411501 [0,2,0,0,0,0|1,0,1]=4 4850 B9R0.41 CCC(C#N)C(C)C(=O)O Amb35700324 [0,2,0,0,0,0|2,0,0]=4 4851 B9R0.41 CCC(C#N)C(N)C(=O)O Amb33065501 [0,2,0,0,0,0|1,0,0]=3 4852 B9R0.41 CCC(C#N)C(N)C(N)=O Amb32867909 [0,2,0,0,0,0|2,0,0]=4 4853 B9R0.41 CCC(C#N)[C@@H](N)C(=O)O Amb33308678 [0,2,0,0,0,0|1,0,0]=3 4854 B9R0.41 CCC(C#N)[C@H](N)C(=O)O Amb33036453 [0,2,0,0,0,0|1,0,0]=3 4855 B9R0.41 CCC(CC)C(C)C(=O)O Amb18831490 [0,2,0,0,0,0|2,0,0]=4 4856 B9R0.41 CCC(CC)C(N)C(=O)O Amb19375421 [0,2,0,0,0,0|1,0,0]=3 4857 B9R0.41 CCC(CC)C(N)C(=O)O Amb4134815 [0,2,0,0,0,0|1,0,0]=3 4858 B9R0.41 CCC(CC)C(N)C(N)=O Amb18307119 [0,2,0,0,0,0|2,0,0]=4 4859 B9R0.41 CCC(CC)C(O)C(=O)O Amb19013419 [0,2,0,0,0,0|2,0,0]=4 4860 B9R0.41 CCC(CC)[C@@H](C)C(=O)O Amb33730913 [0,2,0,0,0,0|2,0,0]=4 4861 B9R0.41 CCC(CC)[C@@H](N)C(=O)O Amb17612760 [0,2,0,0,0,0|1,0,0]=3 4862 B9R0.41 CCC(CC)[C@H](C)C(=O)O Amb25255941 [0,2,0,0,0,0|2,0,0]=4 4863 B9R0.41 CCC(CC)[C@H](N)C(=O)O Amb17612761 [0,2,0,0,0,0|1,0,0]=3 4864 B9R0.41 CCC(CC)[C@H](N)C(N)=O Amb28120381 [0,2,0,0,0,0|2,0,0]=4 4865 B9R0.41 CCC(CF)C(N)C(=O)O Amb28290093 [0,2,0,0,0,0|1,0,0]=3 4866 B9R0.41 CCC(CN)C(O)C(=O)O Amb24700895 [0,2,0,0,0,0|2,0,0]=4 4867 B9R0.41 CCC(OC)C(=O)C(=O)O Amb33320140 [0,2,0,0,0,0|1,0,1]=4 4868 B9R0.41 CCC(OC)C(C)C(=O)O Amb27413515 [0,2,0,0,0,0|1,0,0]=3 4869 B9R0.41 CCC(OC)C(N)C(=O)O Amb24381341 [0,2,0,0,0,0|0,0,0]=2 4870 B9R0.41 CCC(OC)C(N)C(N)=O Amb27249334 [0,2,0,0,0,0|1,0,0]=3 4871 B9R0.41 CCC(OC)C(O)C(=O)O Amb25695288 [0,2,0,0,0,0|1,0,0]=3 4872 B9R0.41 CC[C@H](CF)[C@H](N)C(=O)O Amb28077201 [0,2,0,0,0,0|1,0,0]=3 4873 B9R0.41 CC[C@H](OC)[C@H](N)C(=O)O Amb27779324 [0,2,0,0,0,0|0,0,0]=2 4874 B9R0.41 COC(CO)C(O)C(=O)O Amb27790653 [0,2,0,0,0,0|1,0,0]=3 4875 B9R0.41 COC(CO)C(O)C(N)=O Amb28434693 [0,2,0,0,0,0|2,0,0]=4 4876 B9R0.41 COC(OC)C(Br)C(C)=O Amb26369823 [0,2,0,0,0,0|2,0,0]=4 4877 B9R0.41 COC(OC)C(C)C(=O)O Amb24401121 [0,2,0,0,0,0|1,0,0]=3 4878 B9R0.41 COC(OC)C(C)C(C)=O Amb19650817 [0,2,0,0,0,0|2,0,0]=4 4879 B9R0.41 COC(OC)C(C)C(N)=O Amb28046900 [0,2,0,0,0,0|2,0,0]=4 4880 B9R0.41 COC(OC)C(Cl)C(C)=O Amb17594151 [0,2,0,0,0,0|2,0,0]=4 4881 B9R0.41 COC(OC)C(F)C(C)=O Amb26844407 [0,2,0,0,0,0|2,0,0]=4 4882 B9R0.41 COC(OC)C(N)C(=O)O Amb27443034 [0,2,0,0,0,0|0,0,0]=2 4883 B9R0.41 COC(OC)C(O)C(=O)O Amb33342039 [0,2,0,0,0,0|1,0,0]=3 4884 B9R0.41 CO[C@H](CO)[C@@H](O)C(=O)O Amb28137968 [0,2,0,0,0,0|1,0,0]=3 4885 B9R0.41 C\C=C(\CO)C(N)C(=O)O Amb27615038 [0,2,0,0,0,0|0,0,1]=3 4886 B9R0.41 N[C@H](C(=O)O)C(CO)CO Amb27655595 [0,2,0,0,0,0|0,0,0]=2 4887 B9R0.33 C#CCC(C(=O)O)C(C)O Amb27237558 [0,2,0,0,0,0|1,0,0]=3 4888 B9R0.33 C=C(C)C(NCC)C(=O)O Amb28050492 [0,2,0,0,0,0|1,0,1]=4 4889 B9R0.33 C=CCC(C(=O)O)C(C)C Amb18643926 [0,2,0,0,0,0|2,0,0]=4 4890 B9R0.33 CC(C)C(CC#N)C(=O)O Amb35711779 [0,2,0,0,0,0|1,0,1]=4 4891 B9R0.33 CC(C)C(CCF)C(=O)O Amb27837856 [0,2,0,0,0,0|2,0,0]=4 4892 B9R0.33 CC(C)C(CCN)C(=O)O Amb22371125 [0,2,0,0,0,0|1,0,0]=3 4893 B9R0.33 CC(C)C(CCN)C(=O)O Amb24426418 [0,2,0,0,0,0|1,0,0]=3 4894 B9R0.33 CC(C)C(N=C=O)C(=O)O Amb25952521 [0,2,0,0,0,0|1,0,1]=4 4895 B9R0.33 CC(C)C(N=C=S)C(=O)O Amb33471521 [0,2,0,0,0,0|1,0,1]=4 4896 B9R0.33 CC(C)C(NC#N)C(=O)O Amb30030789 [0,2,0,0,0,0|1,0,0]=3 4897 B9R0.33 CC(C)C(NC#N)C(N)=O Amb27883617 [0,2,0,0,0,0|2,0,0]=4 4898 B9R0.33 CC(C)C(NC=O)C(=O)O Amb4018743 [0,2,0,0,0,0|1,0,0]=3 4899 B9R0.33 CC(C)C(NN=O)C(=O)O Amb28198835 [0,2,0,0,0,0|1,0,0]=3 4900 B9R0.33 CC(C)[C@@H](N=C=O)C(=O)O Amb33471340 [0,2,0,0,0,0|1,0,1]=4 4901 B9R0.33 CC(C)[C@@H](N=C=S)C(=O)O Amb33471569 [0,2,0,0,0,0|1,0,1]=4 4902 B9R0.33 CC(C)[C@@H](N=[N+]=[N-])C(=O)O Amb32620196 [0,2,0,0,0,0|1,0,1]=4 4903 B9R0.33 CC(C)[C@@H](NC#N)C(=O)O Amb30030642 [0,2,0,0,0,0|1,0,0]=3 4904 B9R0.33 CC(C)[C@@H](NC=O)C(=O)O Amb22745192 [0,2,0,0,0,0|1,0,0]=3 4905 B9R0.33 CC(C)[C@H](N=C=O)C(=O)O Amb33471334 [0,2,0,0,0,0|1,0,1]=4 4906 B9R0.33 CC(C)[C@H](N=C=S)C(=O)O Amb33471564 [0,2,0,0,0,0|1,0,1]=4 4907 B9R0.33 CC(C)[C@H](N=[N+]=[N-])C(=O)O Amb32620170 [0,2,0,0,0,0|1,0,1]=4 4908 B9R0.33 CC(C)[C@H](NC#N)C(=O)O Amb30030779 [0,2,0,0,0,0|1,0,0]=3 4909 B9R0.33 CC(C)[C@H](NC=O)C(=O)O Amb4018781 [0,2,0,0,0,0|1,0,0]=3 4910 B9R0.33 CC(C)[C@H](NN=O)C(=O)O Amb27810805 [0,2,0,0,0,0|1,0,0]=3 4911 B9R0.33 CC(O)C(CCO)C(N)=O Amb27467700 [0,2,0,0,0,0|2,0,0]=4 4912 B9R0.33 CC(O)C(NC#N)C(=O)O Amb30031280 [0,2,0,0,0,0|0,0,0]=2 4913 B9R0.33 CC(O)[C@@H](N=[N+]=[N-])C(=O)O Amb32620191 [0,2,0,0,0,0|0,0,1]=3 4914 B9R0.33 CC(O)[C@H](N=[N+]=[N-])C(=O)O Amb32620236 [0,2,0,0,0,0|0,0,1]=3 4915 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [0,2,0,0,0,0|2,0,0]=4 4916 B9R0.33 CCCC(C(=O)O)C(C)N Amb33036414 [0,2,0,0,0,0|2,0,0]=4 4917 B9R0.33 CCCC(C(=O)O)C(C)O Amb26422276 [0,2,0,0,0,0|1,0,0]=3 4918 B9R0.33 CCC[C@H](C(=O)O)[C@H](C)O Amb27221692 [0,2,0,0,0,0|1,0,0]=3 4919 B9R0.33 CCNC(C(=O)O)C(C)C Amb19514760 [0,2,0,0,0,0|1,0,0]=3 4920 B9R0.33 CCNC(C(=O)O)C(C)C Amb9327924 [0,2,0,0,0,0|1,0,0]=3 4921 B9R0.33 CCN[C@@H](C(=O)O)C(C)C Amb33347482 [0,2,0,0,0,0|1,0,0]=3 4922 B9R0.33 CCN[C@H](C(=O)O)C(C)C Amb25230589 [0,2,0,0,0,0|1,0,0]=3 4923 B9R0.33 CCN[C@H](C(=O)O)C(C)O Amb27629796 [0,2,0,0,0,0|0,0,0]=2 4924 B9R0.33 CCOC(C(=O)O)C(C)C Amb6267583 [0,2,0,0,0,0|2,0,0]=4 4925 B9R0.33 CCSC(C(=O)O)C(C)C Amb6680206 [0,2,0,0,0,0|2,0,0]=4 4926 B9R0.33 COCC(C(=O)O)C(C)C Amb26443509 [0,2,0,0,0,0|2,0,0]=4 4927 B9R0.33 COCC(C(=O)O)N(C)O Amb27976733 [0,2,0,0,0,0|2,0,0]=4 4928 B9R0.33 CS(=O)C(CCN)C(=O)O Amb27425024 [0,2,0,0,0,0|1,0,1]=4 4929 B9R0.33 CSCC(C(=O)O)C(C)C Amb27639484 [0,2,0,0,0,0|2,0,0]=4 4930 B9R0.33 C[C@@H](O)[C@H](N=[N+]=[N-])C(=O)O Amb28385001 [0,2,0,0,0,0|0,0,1]=3 4931 B9R0.33 C[C@@H](O)[C@H](NC#N)C(=O)O Amb30031230 [0,2,0,0,0,0|0,0,0]=2 4932 B9R0.33 C[C@H](O)[C@H](N=[N+]=[N-])C(=O)O Amb27646477 [0,2,0,0,0,0|0,0,1]=3 4933 B9R0.33 C\C=C\C(C(=O)O)C(C)C Amb18643944 [0,2,0,0,0,0|2,0,0]=4 4934 B9R0.33 C\C=N\[C@H](C(=O)O)C(C)C Amb27831817 [0,2,0,0,0,0|1,0,1]=4 4935 B9R0.33 N#CNC(C(=O)O)C(=O)O Amb30031225 [0,2,0,0,0,0|1,0,1]=4 4936 B9R0.33 NCCC(C(=O)O)C(=O)O Amb27797430 [0,2,0,0,0,0|1,0,1]=4 4937 B9R0.54 C=C(C)C(C(=O)O)C(C)C Amb18643917 [0,2,0,0,0,0|2,0,0]=4 4938 B9R0.54 C=C(C)[C@H](C(=O)O)C(C)C Amb27222321 [0,2,0,0,0,0|2,0,0]=4 4939 B9R0.54 CC(=O)C(C(N)=O)C(C)C Amb27618094 [0,2,0,0,0,0|2,0,0]=4 4940 B9R0.54 CC(C)C(C(=O)O)C(=O)O Amb2689019 [0,2,0,0,0,0|2,0,0]=4 4941 B9R0.54 CC(C)C(C(=O)O)C(C)C Amb17593626 [0,2,0,0,0,0|2,0,0]=4 4942 B9R0.54 CC(C)C(C(=O)O)C(C)N Amb24420001 [0,2,0,0,0,0|1,0,0]=3 4943 B9R0.54 CC(C)C(C(=O)O)C(C)N Amb28555623 [0,2,0,0,0,0|1,0,0]=3 4944 B9R0.54 CC(C)C(C(=O)O)C(C)O Amb18990640 [0,2,0,0,0,0|1,0,0]=3 4945 B9R0.54 CC(C)C(C(=O)O)C(F)F Amb33006059 [0,2,0,0,0,0|2,0,0]=4 4946 B9R0.54 CC(C)C(C(=O)O)N(C)C Amb19343274 [0,2,0,0,0,0|1,0,0]=3 4947 B9R0.54 CC(C)C(C(=O)O)N(C)C Amb6619070 [0,2,0,0,0,0|1,0,0]=3 4948 B9R0.54 CC(C)C(C(=O)O)N(C)Cl Amb28251094 [0,2,0,0,0,0|1,0,0]=3 4949 B9R0.54 CC(C)C(C(N)=O)C(=O)O Amb28050146 [0,2,0,0,0,0|1,0,0]=3 4950 B9R0.54 CC(C)C(C(N)=O)C(C)N Amb28130035 [0,2,0,0,0,0|2,0,0]=4 4951 B9R0.54 CC(C)C(C(N)=O)C(N)=O Amb27230644 [0,2,0,0,0,0|2,0,0]=4 4952 B9R0.54 CC(C)C(C(N)=O)N(C)N Amb18644210 [0,2,0,0,0,0|2,0,0]=4 4953 B9R0.54 CC(C)[C@@H](C(=O)O)N(C)C Amb8630219 [0,2,0,0,0,0|1,0,0]=3 4954 B9R0.54 CC(C)[C@H](C(=O)O)N(C)C Amb24053107 [0,2,0,0,0,0|1,0,0]=3 4955 B9R0.54 CC(C)[C@H](C(=O)O)N(C)C Amb34913643 [0,2,0,0,0,0|1,0,0]=3 4956 B9R0.54 CC(N)C(C(=O)O)C(C)O Amb27201636 [0,2,0,0,0,0|0,0,0]=2 4957 B9R0.54 C[C@@H](O)[C@@H](C(=O)O)N(C)C Amb27493848 [0,2,0,0,0,0|0,0,0]=2 4958 B9R0.72 C=CC(C(=O)O)C(C)(C)C Amb27839076 [0,2,0,0,0,0|2,0,0]=4 4959 B9R0.72 CC(C)(C)C(CF)C(=O)O Amb28140824 [0,2,0,0,0,0|2,0,0]=4 4960 B9R0.72 CC(C)(C)C(CN)C(=O)O Amb22745168 [0,2,0,0,0,0|1,0,0]=3 4961 B9R0.72 CC(C)(C)C(CN)C(=O)O Amb34140533 [0,2,0,0,0,0|1,0,0]=3 4962 B9R0.72 CC(C)(C)C(CO)C(=O)O Amb28050066 [0,2,0,0,0,0|2,0,0]=4 4963 B9R0.72 CC(C)(C)C(NN)C(=O)O Amb27413490 [0,2,0,0,0,0|1,0,0]=3 4964 B9R0.72 CC(C)(C)C(ON)C(=O)O Amb28121246 [0,2,0,0,0,0|1,0,0]=3 4965 B9R0.72 CC(C)(C)[C@@H](NN)C(=O)O Amb27790437 [0,2,0,0,0,0|1,0,0]=3 4966 B9R0.72 CC(C)(C)[C@H](CN)C(=O)O Amb26629662 [0,2,0,0,0,0|1,0,0]=3 4967 B9R0.72 CC(C)(C)[C@H](CO)C(=O)O Amb27787642 [0,2,0,0,0,0|2,0,0]=4 4968 B9R0.72 CC(C)(F)C(CN)C(=O)O Amb33273751 [0,2,0,0,0,0|1,0,0]=3 4969 B9R0.72 CC(F)(F)C(CN)C(=O)O Amb32810102 [0,2,0,0,0,0|1,0,0]=3 4970 B9R0.72 CCC(C(=O)O)C(C)(C)C Amb18124683 [0,2,0,0,0,0|2,0,0]=4 4971 B9R0.72 CCC(C(=O)O)C(C)(C)F Amb24756885 [0,2,0,0,0,0|2,0,0]=4 4972 B9R0.72 CCC(C(=O)O)C(C)(C)N Amb26857945 [0,2,0,0,0,0|2,0,0]=4 4973 B9R0.72 CCC(C(=O)O)C(C)(C)O Amb18990620 [0,2,0,0,0,0|1,0,0]=3 4974 B9R0.72 CCC(C(=O)O)C(C)(F)F Amb32675223 [0,2,0,0,0,0|2,0,0]=4 4975 B9R0.72 CNC(C(=O)O)C(C)(C)C Amb18975753 [0,2,0,0,0,0|1,0,0]=3 4976 B9R0.72 CNC(C(=O)O)C(C)(C)O Amb18644319 [0,2,0,0,0,0|0,0,0]=2 4977 B9R0.72 CNC(C(=O)O)C(C)(C)S Amb27772393 [0,2,0,0,0,0|0,1,0]=3 4978 B9R0.72 CN[C@@H](C(=O)O)C(C)(C)C Amb24117092 [0,2,0,0,0,0|1,0,0]=3 4979 B9R0.72 CN[C@@H](C(=O)O)C(C)(C)S Amb28291638 [0,2,0,0,0,0|0,1,0]=3 4980 B9R0.72 CN[C@@H](C(N)=O)C(C)(C)C Amb24117093 [0,2,0,0,0,0|2,0,0]=4 4981 B9R0.72 CN[C@H](C(=O)O)C(C)(C)C Amb27615056 [0,2,0,0,0,0|1,0,0]=3 4982 B9R0.72 CN[C@H](C(=O)O)C(C)(C)O Amb27252117 [0,2,0,0,0,0|0,0,0]=2 4983 B9R0.72 COC(C(=O)O)C(C)(C)C Amb24382480 [0,2,0,0,0,0|2,0,0]=4 4984 B9R0.72 CO[C@H](C(=O)O)C(C)(C)C Amb25864953 [0,2,0,0,0,0|2,0,0]=4 4985 B9R0.72 CS(=O)(=O)C(CN)C(=O)O Amb27754418 [0,2,0,0,0,0|1,0,1]=4 4986 B9R0.72 CSC(C(=O)O)C(C)(C)C Amb28145113 [0,2,0,0,0,0|2,0,0]=4 4987 B9R0.72 NCC(C(=O)O)C(F)(F)F Amb10841964 [0,2,0,0,0,0|2,0,0]=4 4988 B9R0.72 NCC(C(=O)O)S(=O)(=O)O Amb21982536 [0,2,0,0,0,0|2,0,0]=4 4989 B9R0.72 [C-]#[N+]C(C(=O)O)C(C)(C)C Amb27786900 [0,2,0,0,0,0|1,0,1]=4 4990 B9R0.76 CC(=O)C(O)(CO)C(C)O Amb28324374 [0,2,0,0,0,0|2,0,0]=4 4991 B9R0.76 CC(=O)[C@@](O)(CO)[C@H](C)O Amb28382432 [0,2,0,0,0,0|2,0,0]=4 4992 B9R0.76 CC(C)C(C)(CO)C(=O)O Amb27849972 [0,2,0,0,0,0|2,0,0]=4 4993 B9R0.76 CC(C)C(F)(CN)C(=O)O Amb25135307 [0,2,0,0,0,0|1,0,0]=3 4994 B9R0.76 CC(C)C(N)(CN)C(=O)O Amb27667118 [0,2,0,0,0,0|1,0,0]=3 4995 B9R0.76 CC(C)C(N)(CO)C(=O)O Amb8515984 [0,2,0,0,0,0|1,0,0]=3 4996 B9R0.76 CC(C)C(O)(CO)C(=O)O Amb27461352 [0,2,0,0,0,0|2,0,0]=4 4997 B9R0.76 CC(C)[C@@](N)(CN)C(=O)O Amb27468639 [0,2,0,0,0,0|1,0,0]=3 4998 B9R0.76 CC(C)[C@](C)(C#N)C(=O)O Amb27241345 [0,2,0,0,0,0|1,0,1]=4 4999 B9R0.76 CC(C)[C@](N)(CO)C(=O)O Amb25103828 [0,2,0,0,0,0|1,0,0]=3 5000 B9R0.76 CCC(N)(C(=O)O)C(C)C Amb24460296 [0,2,0,0,0,0|1,0,0]=3 5001 B9R0.76 CCC(N)(C(=O)O)C(C)O Amb27955481 [0,2,0,0,0,0|0,0,0]=2 5002 B9R0.76 CCC(N)(C(N)=O)C(C)C Amb18289873 [0,2,0,0,0,0|2,0,0]=4 5003 B9R0.76 CCC(O)(C(=O)O)C(C)C Amb24459544 [0,2,0,0,0,0|2,0,0]=4 5004 B9R0.76 CCC(O)(C(=O)O)C(C)O Amb27413859 [0,2,0,0,0,0|1,0,0]=3 5005 B9R0.76 CC[C@@](C)(C(C)=O)[C@H](C)O Amb27226907 [0,2,0,0,0,0|2,0,0]=4 5006 B9R0.76 CC[C@@](O)(C(=O)O)[C@H](C)O Amb27874115 [0,2,0,0,0,0|1,0,0]=3 5007 B9R0.76 CNC(C)(C(=O)O)C(F)F Amb29890323 [0,2,0,0,0,0|2,0,0]=4 5008 B9R0.76 CNC(C)(C(N)=O)C(C)C Amb18289562 [0,2,0,0,0,0|2,0,0]=4 5009 B9R0.76 CN[C@](C)(C(N)=O)C(C)C Amb28128407 [0,2,0,0,0,0|2,0,0]=4 5010 B9R0.76 NC(CO)(C(=O)O)C(F)F Amb27838004 [0,2,0,0,0,0|2,0,0]=4 5011 B9R0.76 N[C@@](CO)(C(=O)O)C(F)F Amb24649833 [0,2,0,0,0,0|2,0,0]=4 5012 B9R0.49 CC(C(C)(N)O)S(=O)(=O)O Amb28398129 [0,2,0,0,0,0|2,0,0]=4 5013 B9R0.49 CC(C)(C)C(N)P(=O)(O)O Amb1150406 [0,2,0,0,0,0|2,0,0]=4 5014 B9R0.49 CC(C)(S)[C@@H](N)P(=O)(O)O Amb27476157 [0,2,0,0,0,0|1,1,0]=4 5015 B9R0.49 CC(C)(S)[C@H](N)P(=O)(O)O Amb27598044 [0,2,0,0,0,0|1,1,0]=4 5016 B9R0.80 CC(C)(C)C(C)(C)C(=O)O Amb18124686 [0,2,0,0,0,0|2,0,0]=4 5017 B9R0.80 CC(C)(C)C(C)(F)C(=O)O Amb27847029 [0,2,0,0,0,0|2,0,0]=4 5018 B9R0.80 CC(C)(C)C(C)(N)C(=O)O Amb33856589 [0,2,0,0,0,0|1,0,0]=3 5019 B9R0.80 CC(C)(C)C(C)(O)C(=O)O Amb18644262 [0,2,0,0,0,0|2,0,0]=4 5020 B9R0.80 CC(C)(C)[C@@](C)(N)C(=O)O Amb28143043 [0,2,0,0,0,0|1,0,0]=3 5021 B9R0.80 CC(C)(C)[C@@](C)(O)C(=O)O Amb28182896 [0,2,0,0,0,0|2,0,0]=4 5022 B9R0.80 CC(C)(C)[C@](C)(N)C(N)=O Amb27797175 [0,2,0,0,0,0|2,0,0]=4 5023 B9R0.80 CC(C)(C)[C@](C)(O)C(=O)O Amb27759796 [0,2,0,0,0,0|2,0,0]=4 5024 B9R0.80 CC(C)(F)C(C)(C)C(=O)O Amb26013877 [0,2,0,0,0,0|2,0,0]=4 5025 B9R0.80 CC(C)(F)C(C)(F)C(=O)O Amb33743294 [0,2,0,0,0,0|2,0,0]=4 5026 B9R0.80 CC(C)(F)C(F)(F)C(=O)O Amb33410095 [0,2,0,0,0,0|2,0,0]=4 5027 B9R0.80 CC(C)(N)C(C)(C)C(=O)O Amb19283404 [0,2,0,0,0,0|2,0,0]=4 5028 B9R0.80 CC(C)(N)C(C)(C)C(=O)O Amb9782738 [0,2,0,0,0,0|2,0,0]=4 5029 B9R0.80 CC(C)(O)C(C)(C)C(=O)O Amb18281599 [0,2,0,0,0,0|1,0,0]=3 5030 B9R0.80 CC(C)(O)C(C)(O)C(=O)O Amb27975752 [0,2,0,0,0,0|1,0,0]=3 5031 B9R0.80 CC(C)(O)C(F)(F)C(=O)O Amb18796751 [0,2,0,0,0,0|1,0,0]=3 5032 B9R0.80 CC(C)(O)[C@@](C)(N)C(=O)O Amb25117586 [0,2,0,0,0,0|0,0,0]=2 5033 B9R0.80 CC(C)(O)[C@](C)(N)C(=O)O Amb28135986 [0,2,0,0,0,0|0,0,0]=2 5034 B9R0.80 CC(C)(S)C(C)(O)C(=O)O Amb27592186 [0,2,0,0,0,0|1,1,0]=4 5035 B9R0.80 CC(C)(S)[C@@](C)(N)C(=O)O Amb9786787 [0,2,0,0,0,0|0,1,0]=3 5036 B9R0.80 CC(C)C(C)(N)P(=O)(O)O Amb8516018 [0,2,0,0,0,0|2,0,0]=4 5037 B9R0.80 CC(F)(F)C(C)(C)C(=O)O Amb28458455 [0,2,0,0,0,0|2,0,0]=4 5038 B9R0.80 CC(F)(F)C(O)(O)C(=O)O Amb28118872 [0,2,0,0,0,0|2,0,0]=4 5039 B9R0.80 CC(N)(C(=O)O)C(F)(F)Br Amb28341050 [0,2,0,0,0,0|2,0,0]=4 5040 B9R0.80 CC(N)(C(=O)O)C(F)(F)Cl Amb27233426 [0,2,0,0,0,0|2,0,0]=4 5041 B9R0.80 CC(N)(C(=O)O)C(F)(F)F Amb1091768 [0,2,0,0,0,0|2,0,0]=4 5042 B9R0.80 CC(N)(C(=O)O)C(F)(F)F Amb19330378 [0,2,0,0,0,0|2,0,0]=4 5043 B9R0.80 CC(O)C(C)(N)P(=O)(O)O Amb27667950 [0,2,0,0,0,0|1,0,0]=3 5044 B9R0.80 C[C@@](N)(C(=O)O)C(F)(F)Cl Amb27841808 [0,2,0,0,0,0|2,0,0]=4 5045 B7R1.2 C=C1COC(=O)C1 Amb24589821 [1,0,0,1,0,0|1,0,1]=4 5046 B7R1.2 C=C1COC(C)C1 Amb35695393 [1,0,0,1,0,0|2,0,0]=4 5047 B7R1.2 CC1=COC(=O)C1 Amb27624758 [1,0,0,1,0,0|1,0,1]=4 5048 B7R1.2 CC1=NOC(=O)C1 Amb22274079 [1,0,0,1,0,0|1,0,1]=4 5049 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,0,0,1,0,0|2,0,0]=4 5050 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|2,0,0]=4 5051 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,0,0,1,0,0|1,0,0]=3 5052 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,1,0]=4 5053 B7R1.2 CC1CC(=O)NN1 Amb493880 [1,0,0,1,0,0|2,0,0]=4 5054 B7R1.2 CC1CC(N)=NO1 Amb26627705 [1,0,0,1,0,0|2,0,0]=4 5055 B7R1.2 CC1CC(O)CO1 Amb28430079 [1,0,0,1,0,0|1,0,1]=4 5056 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|2,0,0]=4 5057 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|2,0,0]=4 5058 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 5059 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 5060 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|2,0,0]=4 5061 B7R1.2 CN1CC(O)CO1 Amb27980980 [1,0,0,1,0,0|2,0,0]=4 5062 B7R1.2 CN1C[C@H](O)CO1 Amb27761726 [1,0,0,1,0,0|2,0,0]=4 5063 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,0,0,1,0,0|2,0,0]=4 5064 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|2,0,0]=4 5065 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|2,0,0]=4 5066 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 5067 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 5068 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|2,0,0]=4 5069 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,0,0,1,0,0|2,0,0]=4 5070 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|2,0,0]=4 5071 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 5072 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,0,0,1,0,0|2,0,0]=4 5073 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|2,0,0]=4 5074 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [1,0,0,1,0,0|1,0,1]=4 5075 B7R1.2 NC1CCC(=O)C1 Amb22494268 [1,0,0,1,0,0|2,0,0]=4 5076 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 5077 B7R1.2 NC1CNC(=O)C1 Amb33544169 [1,0,0,1,0,0|2,0,0]=4 5078 B7R1.2 NC1COC(=O)C1 Amb30594428 [1,0,0,1,0,0|1,0,0]=3 5079 B7R1.2 NC1COC(=O)C1 Amb9782136 [1,0,0,1,0,0|1,0,0]=3 5080 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 5081 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 5082 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [1,0,0,1,0,0|2,0,0]=4 5083 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [1,0,0,1,0,0|1,0,0]=3 5084 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [1,0,0,1,0,0|1,0,0]=3 5085 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 5086 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [1,0,0,1,0,0|2,0,0]=4 5087 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|1,0,0]=3 5088 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|1,0,0]=3 5089 B7R1.2 O=C1C=C(O)CO1 Amb628324 [1,0,0,1,0,0|0,0,2]=4 5090 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [1,0,0,1,0,0|1,0,1]=4 5091 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [1,0,0,1,0,0|1,0,1]=4 5092 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [1,0,0,1,0,0|1,0,1]=4 5093 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|1,0,0]=3 5094 B7R1.2 O=C1CC(I)CO1 Amb27401189 [1,0,0,1,0,0|1,0,0]=3 5095 B7R1.2 O=C1CC(O)CN1 Amb19958404 [1,0,0,1,0,0|1,0,0]=3 5096 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,0,0,1,0,0|0,0,0]=2 5097 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|1,1,0]=4 5098 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [1,0,0,1,0,0|2,0,0]=4 5099 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [1,0,0,1,0,0|2,0,0]=4 5100 B7R1.2 O=C1CCC(F)C1 Amb21963553 [1,0,0,1,0,0|2,0,0]=4 5101 B7R1.2 O=C1CCC(O)C1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 5102 B7R1.2 O=C1CCC(O)O1 Amb22740957 [1,0,0,1,0,0|2,0,0]=4 5103 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [1,0,0,1,0,0|1,0,0]=3 5104 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [1,0,0,1,0,0|2,0,0]=4 5105 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [1,0,0,1,0,0|1,0,0]=3 5106 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [1,0,0,1,0,0|2,0,0]=4 5107 B7R1.2 O=C1COC(=O)C1 Amb2721303 [1,0,0,1,0,0|0,0,2]=4 5108 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [1,0,0,1,0,0|1,0,0]=3 5109 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,0,0,1,0,0|0,0,0]=2 5110 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|1,1,0]=4 5111 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [1,0,0,1,0,0|1,0,0]=3 5112 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,0,0,1,0,0|0,0,0]=2 5113 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|1,1,0]=4 5114 B7R1.2 O=C1OC(O)CS1 Amb28066979 [1,0,0,1,0,0|1,1,0]=4 5115 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 5116 B7R1.2 O=C1OCC(F)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 5117 B7R1.2 O=S1CCC(O)C1 Amb26600157 [1,0,0,1,0,0|2,0,0]=4 5118 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [1,0,0,1,0,0|2,0,0]=4 5119 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [1,0,0,1,0,0|2,0,0]=4 5120 B7R1.2 OC1CCC(O)C1 Amb8513837 [1,0,0,1,0,0|1,0,1]=4 5121 B7R1.2 OC1CCN(O)C1 Amb27430271 [1,0,0,1,0,0|2,0,0]=4 5122 B7R1.2 OC1C[C@H](O)CO1 Amb27650382 [1,0,0,1,0,0|0,0,2]=4 5123 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [1,0,0,1,0,0|1,0,1]=4 5124 B7R1.2 O[C@@H]1CO[C@@H](O)C1 Amb27478741 [1,0,0,1,0,0|0,0,2]=4 5125 B7R1.2 O[C@@H]1CO[C@H](O)C1 Amb27797261 [1,0,0,1,0,0|0,0,2]=4 5126 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [1,0,0,1,0,0|1,0,1]=4 5127 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [1,0,0,1,0,0|1,0,1]=4 5128 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 5129 B7R1.12 C=C1CC1C(=O)O Amb9774969 [1,0,0,1,0,0|1,0,1]=4 5130 B7R1.12 CC(=O)C1CC1C Amb25720437 [1,0,0,1,0,0|2,0,0]=4 5131 B7R1.12 CC(=O)C1OC1C Amb25920285 [1,0,0,1,0,0|1,0,0]=3 5132 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [1,0,0,1,0,0|2,0,0]=4 5133 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [1,0,0,1,0,0|1,0,0]=3 5134 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [1,0,0,1,0,0|2,0,0]=4 5135 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [1,0,0,1,0,0|1,0,0]=3 5136 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [1,0,0,1,0,0|1,1,0]=4 5137 B7R1.12 CC(O)[C@@H]1O[C@H]1C Amb27660940 [1,0,0,1,0,0|1,0,1]=4 5138 B7R1.12 CC1=CC1C(=O)O Amb27157805 [1,0,0,1,0,0|1,0,1]=4 5139 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [1,0,0,1,0,0|2,0,0]=4 5140 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|1,0,0]=3 5141 B7R1.12 CC1CC1C(N)=O Amb8858378 [1,0,0,1,0,0|2,0,0]=4 5142 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|0,0,0]=2 5143 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|0,1,0]=3 5144 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|0,1,0]=3 5145 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|1,0,0]=3 5146 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|2,0,0]=4 5147 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|1,0,0]=3 5148 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [1,0,0,1,0,0|2,0,0]=4 5149 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|1,0,0]=3 5150 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|0,0,0]=2 5151 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|0,0,0]=2 5152 B7R1.12 C[C@H](O)[C@@H]1O[C@H]1C Amb28345454 [1,0,0,1,0,0|1,0,1]=4 5153 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|1,0,0]=3 5154 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [1,0,0,1,0,0|2,0,0]=4 5155 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|1,0,0]=3 5156 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|0,0,0]=2 5157 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|0,0,0]=2 5158 B7R1.12 NC(=O)C1CC1Br Amb27838278 [1,0,0,1,0,0|2,0,0]=4 5159 B7R1.12 NC(=O)C1CC1F Amb26026786 [1,0,0,1,0,0|2,0,0]=4 5160 B7R1.12 NC(=O)C1CC1N Amb18279694 [1,0,0,1,0,0|2,0,0]=4 5161 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [1,0,0,1,0,0|2,0,0]=4 5162 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [1,0,0,1,0,0|2,0,0]=4 5163 B7R1.12 NC1CC1C(=O)O Amb7762823 [1,0,0,1,0,0|1,0,0]=3 5164 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [1,0,0,1,0,0|1,0,0]=3 5165 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [1,0,0,1,0,0|1,0,0]=3 5166 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [1,0,0,1,0,0|2,0,0]=4 5167 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [1,0,0,1,0,0|2,0,0]=4 5168 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [1,0,0,1,0,0|2,0,0]=4 5169 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 5170 B7R1.12 O=C(O)C1CC1Br Amb27760446 [1,0,0,1,0,0|1,0,0]=3 5171 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [1,0,0,1,0,0|1,0,0]=3 5172 B7R1.12 O=C(O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,0]=3 5173 B7R1.12 O=C(O)C1CC1I Amb26047069 [1,0,0,1,0,0|1,0,0]=3 5174 B7R1.12 O=C(O)C1CC1S Amb20246988 [1,0,0,1,0,0|0,1,0]=3 5175 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [1,0,0,1,0,0|1,0,0]=3 5176 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [1,0,0,1,0,0|1,0,0]=3 5177 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,0]=3 5178 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [1,0,0,1,0,0|1,0,0]=3 5179 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,0]=3 5180 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,0]=3 5181 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [1,0,0,1,0,0|1,0,0]=3 5182 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,0]=3 5183 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [1,0,0,1,0,0|1,0,0]=3 5184 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [1,0,0,1,0,0|1,0,0]=3 5185 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,0]=3 5186 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [1,0,0,1,0,0|1,0,0]=3 5187 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,0]=3 5188 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,0]=3 5189 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [1,0,0,1,0,0|2,0,0]=4 5190 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [1,0,0,1,0,0|2,0,0]=4 5191 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [1,0,0,1,0,0|1,0,0]=3 5192 B7R1.16 CC1(N)CC(=O)C1 Amb31308099 [1,0,0,1,0,0|2,0,0]=4 5193 B7R1.16 CC1(N)CC(=O)C1 Amb32675476 [1,0,0,1,0,0|2,0,0]=4 5194 B7R1.16 O=C1CC(Cl)(Cl)O1 Amb28120599 [1,0,0,1,0,0|2,0,0]=4 5195 B7R1.16 O=S1(=O)CC(O)C1 Amb22229261 [1,0,0,1,0,0|1,0,1]=4 5196 B7R1.20 C=C(C)CC1CO1 Amb33199536 [1,0,0,1,0,0|2,0,0]=4 5197 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|2,0,0]=4 5198 B7R1.20 CC(=O)OC1CO1 Amb25261586 [1,0,0,1,0,0|2,0,0]=4 5199 B7R1.20 NC(=O)CC1CC1 Amb33552967 [1,0,0,1,0,0|2,0,0]=4 5200 B7R1.20 NC(=O)OC1CO1 Amb27184555 [1,0,0,1,0,0|2,0,0]=4 5201 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|2,0,0]=4 5202 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|1,0,0]=3 5203 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|0,0,0]=2 5204 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|0,0,0]=2 5205 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|0,0,0]=2 5206 B7R1.20 O=[N+]([O-])CC1CO1 Amb23589333 [1,0,0,1,0,0|1,0,1]=4 5207 B7R1.4 C=C1CCOC1=O Amb3941636 [1,0,0,1,0,0|1,0,1]=4 5208 B7R1.4 C=C1COCC1N Amb31252146 [1,0,0,1,0,0|2,0,0]=4 5209 B7R1.4 C=C1COCC1N Amb32795022 [1,0,0,1,0,0|2,0,0]=4 5210 B7R1.4 CC1C=CCC1O Amb28324626 [1,0,0,1,0,0|2,0,0]=4 5211 B7R1.4 CC1CCCC1=O Amb8514830 [1,0,0,1,0,0|2,0,0]=4 5212 B7R1.4 CC1CCNC1=O Amb10603701 [1,0,0,1,0,0|2,0,0]=4 5213 B7R1.4 CC1CCOC1=O Amb16185414 [1,0,0,1,0,0|1,0,0]=3 5214 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|2,0,0]=4 5215 B7R1.4 CC1COCC1N Amb26929448 [1,0,0,1,0,0|1,0,1]=4 5216 B7R1.4 CC1COCC1O Amb26864629 [1,0,0,1,0,0|1,0,1]=4 5217 B7R1.4 CC1CONC1=O Amb33714888 [1,0,0,1,0,0|2,0,0]=4 5218 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|1,0,1]=4 5219 B7R1.4 CC1OCCC1N Amb32660981 [1,0,0,1,0,0|1,0,1]=4 5220 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 5221 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [1,0,0,1,0,0|2,0,0]=4 5222 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|2,0,0]=4 5223 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|1,0,1]=4 5224 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|1,0,1]=4 5225 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [1,0,0,1,0,0|1,0,1]=4 5226 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|1,0,1]=4 5227 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|1,0,1]=4 5228 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|1,0,1]=4 5229 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [1,0,0,1,0,0|1,0,1]=4 5230 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [1,0,0,1,0,0|1,0,1]=4 5231 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [1,0,0,1,0,0|2,0,0]=4 5232 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [1,0,0,1,0,0|2,0,0]=4 5233 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [1,0,0,1,0,0|1,0,1]=4 5234 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|1,0,1]=4 5235 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [1,0,0,1,0,0|1,0,1]=4 5236 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [1,0,0,1,0,0|1,0,1]=4 5237 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|1,0,1]=4 5238 B7R1.4 N=C1OCCN1N Amb27803735 [1,0,0,1,0,0|2,0,0]=4 5239 B7R1.4 NC1=CCOC1=O Amb22234102 [1,0,0,1,0,0|0,0,2]=4 5240 B7R1.4 NC1C=CCC1O Amb18639380 [1,0,0,1,0,0|1,0,0]=3 5241 B7R1.4 NC1C=NCC1N Amb27774521 [1,0,0,1,0,0|2,0,0]=4 5242 B7R1.4 NC1CCC=C1Br Amb33295394 [1,0,0,1,0,0|2,0,0]=4 5243 B7R1.4 NC1CCC=C1Br Amb33484034 [1,0,0,1,0,0|2,0,0]=4 5244 B7R1.4 NC1CCCC1=O Amb17939050 [1,0,0,1,0,0|1,0,0]=3 5245 B7R1.4 NC1CCCC1=O Amb28994832 [1,0,0,1,0,0|1,0,0]=3 5246 B7R1.4 NC1CCCC1O Amb13951342 [1,0,0,1,0,0|1,0,1]=4 5247 B7R1.4 NC1CCCC1O Amb8385206 [1,0,0,1,0,0|1,0,1]=4 5248 B7R1.4 NC1CCNC1=O Amb21955321 [1,0,0,1,0,0|1,0,0]=3 5249 B7R1.4 NC1CCNC1=O Amb6739903 [1,0,0,1,0,0|1,0,0]=3 5250 B7R1.4 NC1CCOC1=O Amb17614991 [1,0,0,1,0,0|0,0,0]=2 5251 B7R1.4 NC1CCOC1=O Amb6609049 [1,0,0,1,0,0|0,0,0]=2 5252 B7R1.4 NC1CCOC1=O Amb9761351 [1,0,0,1,0,0|0,0,0]=2 5253 B7R1.4 NC1CCOC1O Amb27408022 [1,0,0,1,0,0|0,0,2]=4 5254 B7R1.4 NC1CCSC1=O Amb1151877 [1,0,0,1,0,0|0,1,0]=3 5255 B7R1.4 NC1CCSC1=O Amb2720274 [1,0,0,1,0,0|0,1,0]=3 5256 B7R1.4 NC1CNCC1O Amb22235661 [1,0,0,1,0,0|1,0,1]=4 5257 B7R1.4 NC1COCC1=O Amb18202885 [1,0,0,1,0,0|1,0,0]=3 5258 B7R1.4 NC1COCC1=O Amb33328736 [1,0,0,1,0,0|1,0,0]=3 5259 B7R1.4 NC1COCC1N Amb23590778 [1,0,0,1,0,0|1,0,1]=4 5260 B7R1.4 NC1COCC1N Amb32665881 [1,0,0,1,0,0|1,0,1]=4 5261 B7R1.4 NC1COCC1O Amb18277417 [1,0,0,1,0,0|0,0,1]=3 5262 B7R1.4 NC1COCC1O Amb19515137 [1,0,0,1,0,0|0,0,1]=3 5263 B7R1.4 NC1CONC1=O Amb1865548 [1,0,0,1,0,0|1,0,0]=3 5264 B7R1.4 NC1CSCC1=O Amb18202693 [1,0,0,1,0,0|1,1,0]=4 5265 B7R1.4 NC1CSCC1O Amb2693597 [1,0,0,1,0,0|0,1,1]=4 5266 B7R1.4 NC1CSCC1O Amb5634210 [1,0,0,1,0,0|0,1,1]=4 5267 B7R1.4 NC1CSCC1O Amb8565080 [1,0,0,1,0,0|0,1,1]=4 5268 B7R1.4 NC1CSNC1=O Amb27435893 [1,0,0,1,0,0|1,1,0]=4 5269 B7R1.4 NN1CCCC1=O Amb8496496 [1,0,0,1,0,0|2,0,0]=4 5270 B7R1.4 NN1CCCC1=O Amb9174227 [1,0,0,1,0,0|2,0,0]=4 5271 B7R1.4 NN1CCNC1=O Amb5722000 [1,0,0,1,0,0|2,0,0]=4 5272 B7R1.4 NN1CCOC1=O Amb10068971 [1,0,0,1,0,0|1,0,0]=3 5273 B7R1.4 NN1CCOC1=O Amb33532698 [1,0,0,1,0,0|1,0,0]=3 5274 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [1,0,0,1,0,0|1,0,1]=4 5275 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [1,0,0,1,0,0|1,0,1]=4 5276 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [1,0,0,1,0,0|1,0,1]=4 5277 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [1,0,0,1,0,0|1,0,1]=4 5278 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [1,0,0,1,0,0|1,0,1]=4 5279 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [1,0,0,1,0,0|1,0,1]=4 5280 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [1,0,0,1,0,0|1,0,0]=3 5281 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [1,0,0,1,0,0|1,0,0]=3 5282 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [1,0,0,1,0,0|0,0,0]=2 5283 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|0,0,0]=2 5284 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [1,0,0,1,0,0|0,0,0]=2 5285 B7R1.4 N[C@@H]1CNC[C@@H]1O Amb25911176 [1,0,0,1,0,0|1,0,1]=4 5286 B7R1.4 N[C@@H]1COC[C@@H]1F Amb31188298 [1,0,0,1,0,0|1,0,1]=4 5287 B7R1.4 N[C@@H]1COC[C@@H]1F Amb33456080 [1,0,0,1,0,0|1,0,1]=4 5288 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [1,0,0,1,0,0|1,0,1]=4 5289 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [1,0,0,1,0,0|1,0,1]=4 5290 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [1,0,0,1,0,0|0,0,1]=3 5291 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [1,0,0,1,0,0|0,0,1]=3 5292 B7R1.4 N[C@@H]1COC[C@H]1F Amb33719125 [1,0,0,1,0,0|1,0,1]=4 5293 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [1,0,0,1,0,0|1,0,1]=4 5294 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [1,0,0,1,0,0|1,0,1]=4 5295 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [1,0,0,1,0,0|0,0,1]=3 5296 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [1,0,0,1,0,0|0,0,1]=3 5297 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [1,0,0,1,0,0|0,0,1]=3 5298 B7R1.4 N[C@@H]1COC[C@H]1O Amb33715897 [1,0,0,1,0,0|0,0,1]=3 5299 B7R1.4 N[C@@H]1CONC1=O Amb533888 [1,0,0,1,0,0|1,0,0]=3 5300 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [1,0,0,1,0,0|0,1,1]=4 5301 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [1,0,0,1,0,0|0,1,1]=4 5302 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [1,0,0,1,0,0|0,1,1]=4 5303 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [1,0,0,1,0,0|1,0,1]=4 5304 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [1,0,0,1,0,0|1,0,1]=4 5305 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [1,0,0,1,0,0|1,0,1]=4 5306 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [1,0,0,1,0,0|1,0,1]=4 5307 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [1,0,0,1,0,0|1,0,0]=3 5308 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [1,0,0,1,0,0|1,0,0]=3 5309 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [1,0,0,1,0,0|0,0,0]=2 5310 B7R1.4 N[C@H]1CCOC1=O Amb541960 [1,0,0,1,0,0|0,0,0]=2 5311 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [1,0,0,1,0,0|0,0,0]=2 5312 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [1,0,0,1,0,0|0,1,0]=3 5313 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [1,0,0,1,0,0|0,1,0]=3 5314 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [1,0,0,1,0,0|0,1,0]=3 5315 B7R1.4 N[C@H]1CNC[C@H]1O Amb27621416 [1,0,0,1,0,0|1,0,1]=4 5316 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [1,0,0,1,0,0|1,0,0]=3 5317 B7R1.4 N[C@H]1COC[C@@H]1N Amb26937236 [1,0,0,1,0,0|1,0,1]=4 5318 B7R1.4 N[C@H]1COC[C@@H]1O Amb10608341 [1,0,0,1,0,0|0,0,1]=3 5319 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [1,0,0,1,0,0|0,0,1]=3 5320 B7R1.4 N[C@H]1COC[C@H]1F Amb35825425 [1,0,0,1,0,0|1,0,1]=4 5321 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [1,0,0,1,0,0|0,0,1]=3 5322 B7R1.4 N[C@H]1COC[C@H]1O Amb33774994 [1,0,0,1,0,0|0,0,1]=3 5323 B7R1.4 N[C@H]1CONC1=O Amb2719694 [1,0,0,1,0,0|1,0,0]=3 5324 B7R1.4 O=C1CCCC1Br Amb16234114 [1,0,0,1,0,0|2,0,0]=4 5325 B7R1.4 O=C1CCCC1Cl Amb3939970 [1,0,0,1,0,0|2,0,0]=4 5326 B7R1.4 O=C1CCCC1F Amb28050533 [1,0,0,1,0,0|2,0,0]=4 5327 B7R1.4 O=C1CCCC1I Amb25756212 [1,0,0,1,0,0|2,0,0]=4 5328 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|2,0,0]=4 5329 B7R1.4 O=C1CCCC1S Amb27838260 [1,0,0,1,0,0|2,0,0]=4 5330 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [1,0,0,1,0,0|2,0,0]=4 5331 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [1,0,0,1,0,0|2,0,0]=4 5332 B7R1.4 O=C1CCOC1=O Amb27849805 [1,0,0,1,0,0|1,0,1]=4 5333 B7R1.4 O=C1NCCC1Br Amb20623055 [1,0,0,1,0,0|2,0,0]=4 5334 B7R1.4 O=C1NCCC1Cl Amb28050511 [1,0,0,1,0,0|2,0,0]=4 5335 B7R1.4 O=C1NCCC1F Amb25838145 [1,0,0,1,0,0|2,0,0]=4 5336 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 5337 B7R1.4 O=C1NCCC1S Amb18202686 [1,0,0,1,0,0|2,0,0]=4 5338 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 5339 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 5340 B7R1.4 O=C1OCCC1Br Amb3940058 [1,0,0,1,0,0|1,0,0]=3 5341 B7R1.4 O=C1OCCC1F Amb27642041 [1,0,0,1,0,0|1,0,0]=3 5342 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|1,0,0]=3 5343 B7R1.4 O=C1OCCC1O Amb5718058 [1,0,0,1,0,0|1,0,0]=3 5344 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|1,0,0]=3 5345 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [1,0,0,1,0,0|1,0,0]=3 5346 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [1,0,0,1,0,0|1,0,0]=3 5347 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [1,0,0,1,0,0|1,0,0]=3 5348 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [1,0,0,1,0,0|1,0,0]=3 5349 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [1,0,0,1,0,0|1,0,0]=3 5350 B7R1.4 O=C1OCNC1Br Amb25299209 [1,0,0,1,0,0|2,0,0]=4 5351 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [1,0,0,1,0,0|1,1,0]=4 5352 B7R1.4 OC1C=CCC1O Amb17593080 [1,0,0,1,0,0|2,0,0]=4 5353 B7R1.4 OC1COCC1Br Amb25321008 [1,0,0,1,0,0|1,0,1]=4 5354 B7R1.4 OC1COCC1F Amb26475960 [1,0,0,1,0,0|1,0,1]=4 5355 B7R1.4 OC1COCC1I Amb24332672 [1,0,0,1,0,0|1,0,1]=4 5356 B7R1.4 OC1COCC1O Amb532982 [1,0,0,1,0,0|1,0,1]=4 5357 B7R1.4 OC1COCC1S Amb27970973 [1,0,0,1,0,0|1,0,1]=4 5358 B7R1.4 O[C@@H]1C=CC[C@H]1O Amb28139433 [1,0,0,1,0,0|2,0,0]=4 5359 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [1,0,0,1,0,0|1,0,1]=4 5360 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [1,0,0,1,0,0|1,0,1]=4 5361 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [1,0,0,1,0,0|1,0,1]=4 5362 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [1,0,0,1,0,0|1,0,1]=4 5363 B7R1.4 O[C@H]1C=CC[C@H]1O Amb24622453 [1,0,0,1,0,0|2,0,0]=4 5364 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [1,0,0,1,0,0|1,0,1]=4 5365 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [1,0,0,1,0,0|1,0,1]=4 5366 B7R1.4 O[C@H]1COC[C@H]1O Amb22406017 [1,0,0,1,0,0|1,0,1]=4 5367 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [1,0,0,1,0,0|0,1,1]=4 5368 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [1,0,0,1,0,0|0,1,1]=4 5369 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|2,0,0]=4 5370 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,1,0,0|2,0,0]=4 5371 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,1,0,0|2,0,0]=4 5372 B7R1.8 CCC1CCC1=O Amb28137082 [1,0,0,1,0,0|2,0,0]=4 5373 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|2,0,0]=4 5374 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,1,0,0|2,0,0]=4 5375 B7R1.8 O=C1CCC1CO Amb24722181 [1,0,0,1,0,0|2,0,0]=4 5376 B7R1.8 O=C1NCC1CO Amb28196532 [1,0,0,1,0,0|2,0,0]=4 5377 B7R1.8 O=CC1CCC1F Amb32943810 [1,0,0,1,0,0|2,0,0]=4 5378 B7R1.8 OCC1CCC1O Amb26956761 [1,0,0,1,0,0|1,0,1]=4 5379 B7R1.8 OCC1NC[C@@H]1O Amb27265630 [1,0,0,1,0,0|0,0,1]=3 5380 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [1,0,0,1,0,0|1,0,1]=4 5381 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [1,0,0,1,0,0|1,0,1]=4 5382 B7R1.8 OC[C@H]1NC[C@H]1O Amb28383856 [1,0,0,1,0,0|0,0,1]=3 5383 B7R1.8 OC[C@H]1SC[C@@H]1O Amb28136441 [1,0,0,1,0,0|1,0,1]=4 5384 B7R1.8 OC[C@H]1SC[C@H]1O Amb27195387 [1,0,0,1,0,0|1,0,1]=4 5385 B7R1.15 CC1C(=O)CC1O Amb28423178 [1,0,0,1,0,0|1,0,0]=3 5386 B7R1.15 CC1CC(=O)C1C Amb33551302 [1,0,0,1,0,0|2,0,0]=4 5387 B7R1.15 CC1NC(=O)C1C Amb22364651 [1,0,0,1,0,0|2,0,0]=4 5388 B7R1.15 CC1NC(=O)C1N Amb26077932 [1,0,0,1,0,0|1,0,0]=3 5389 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [1,0,0,1,0,0|2,0,0]=4 5390 B7R1.15 C[C@@H]1NC(=O)[C@H]1Br Amb28051851 [1,0,0,1,0,0|2,0,0]=4 5391 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [1,0,0,1,0,0|1,0,0]=3 5392 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [1,0,0,1,0,0|1,0,0]=3 5393 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [1,0,0,1,0,0|2,0,0]=4 5394 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [1,0,0,1,0,0|2,0,0]=4 5395 B7R1.15 C[C@H]1OC(=O)[C@H]1N Amb27629736 [1,0,0,1,0,0|0,0,0]=2 5396 B7R1.17 CC1(C)OCC1N Amb26946725 [1,0,0,1,0,0|1,0,1]=4 5397 B7R1.17 CC1(O)CCC1N Amb24117490 [1,0,0,1,0,0|1,0,1]=4 5398 B7R1.17 CC1(O)CCC1N Amb25968766 [1,0,0,1,0,0|1,0,1]=4 5399 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664480 [1,0,0,1,0,0|1,0,1]=4 5400 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664481 [1,0,0,1,0,0|1,0,1]=4 5401 B7R1.18 C=C(C)C1CCN1 Amb33199611 [1,0,0,1,0,0|2,0,0]=4 5402 B7R1.18 CC(=O)C1CCC1 Amb4037098 [1,0,0,1,0,0|2,0,0]=4 5403 B7R1.18 CC(=O)C1CCN1 Amb28142364 [1,0,0,1,0,0|1,0,0]=3 5404 B7R1.18 CC(=O)C1COC1 Amb27397483 [1,0,0,1,0,0|2,0,0]=4 5405 B7R1.18 CC(O)C1COC1 Amb33715759 [1,0,0,1,0,0|1,0,1]=4 5406 B7R1.18 N=C(N)C1CCN1 Amb28410949 [1,0,0,1,0,0|2,0,0]=4 5407 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [1,0,0,1,0,0|2,0,0]=4 5408 B7R1.18 NC(=O)C1CCC1 Amb33552668 [1,0,0,1,0,0|2,0,0]=4 5409 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|1,0,0]=3 5410 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|1,0,0]=3 5411 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [1,0,0,1,0,0|1,0,0]=3 5412 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [1,0,0,1,0,0|2,0,0]=4 5413 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [1,0,0,1,0,0|2,0,0]=4 5414 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|1,0,1]=4 5415 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|1,0,0]=3 5416 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|0,0,0]=2 5417 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|0,0,0]=2 5418 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,0]=3 5419 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|1,0,0]=3 5420 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,1,0,0|2,0,0]=4 5421 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,1,0,0|2,0,0]=4 5422 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,1,0,0|1,0,0]=3 5423 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,1,0]=4 5424 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|0,0,0]=2 5425 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|0,0,0]=2 5426 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|1,0,0]=3 5427 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|0,0,0]=2 5428 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|0,0,0]=2 5429 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|1,0,0]=3 5430 B7R1.19 C=C(C)C1(N)CC1 Amb33199908 [1,0,0,1,0,0|2,0,0]=4 5431 B7R1.19 CC(=O)C1(Br)CC1 Amb22498709 [1,0,0,1,0,0|2,0,0]=4 5432 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [1,0,0,1,0,0|2,0,0]=4 5433 B7R1.19 CC(=O)C1(C)CO1 Amb9677568 [1,0,0,1,0,0|2,0,0]=4 5434 B7R1.19 CC(=O)C1(Cl)CC1 Amb20671915 [1,0,0,1,0,0|2,0,0]=4 5435 B7R1.19 CC(=O)C1(F)CC1 Amb22388893 [1,0,0,1,0,0|2,0,0]=4 5436 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [1,0,0,1,0,0|1,0,0]=3 5437 B7R1.19 CC(=O)C1(N)CC1 Amb28827658 [1,0,0,1,0,0|1,0,0]=3 5438 B7R1.19 CC(=O)[C@@]1(C)CO1 Amb28050546 [1,0,0,1,0,0|2,0,0]=4 5439 B7R1.19 CC(O)C1(C)CO1 Amb27763622 [1,0,0,1,0,0|1,0,1]=4 5440 B7R1.19 CC(O)C1(N)CC1 Amb29849543 [1,0,0,1,0,0|1,0,1]=4 5441 B7R1.19 CC1(C(=O)Cl)CC1 Amb16230812 [1,0,0,1,0,0|2,0,0]=4 5442 B7R1.19 CC1(C(=O)O)CC1 Amb2779924 [1,0,0,1,0,0|1,0,0]=3 5443 B7R1.19 CC1(C(=O)O)CO1 Amb33542864 [1,0,0,1,0,0|1,0,0]=3 5444 B7R1.19 CC1(C(N)=O)CC1 Amb19958822 [1,0,0,1,0,0|2,0,0]=4 5445 B7R1.19 N=C(N)C1(N)CC1 Amb35595082 [1,0,0,1,0,0|2,0,0]=4 5446 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [1,0,0,1,0,0|2,0,0]=4 5447 B7R1.19 NC(=O)C1(Cl)CC1 Amb28187965 [1,0,0,1,0,0|2,0,0]=4 5448 B7R1.19 NC(=O)C1(F)CC1 Amb27851813 [1,0,0,1,0,0|2,0,0]=4 5449 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [1,0,0,1,0,0|1,0,0]=3 5450 B7R1.19 NC(=O)C1(N)CC1 Amb33544868 [1,0,0,1,0,0|1,0,0]=3 5451 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [1,0,0,1,0,0|2,0,0]=4 5452 B7R1.19 NC1(C(=O)O)CC1 Amb4296883 [1,0,0,1,0,0|0,0,0]=2 5453 B7R1.19 NC1(C(=O)O)CC1 Amb6223185 [1,0,0,1,0,0|0,0,0]=2 5454 B7R1.19 NC1([PH](=O)O)CC1 Amb27655512 [1,0,0,1,0,0|1,0,0]=3 5455 B7R1.19 O=C(O)C1(Br)CC1 Amb33544592 [1,0,0,1,0,0|1,0,0]=3 5456 B7R1.19 O=C(O)C1(Cl)CC1 Amb25841916 [1,0,0,1,0,0|1,0,0]=3 5457 B7R1.19 O=C(O)C1(F)CC1 Amb22001836 [1,0,0,1,0,0|1,0,0]=3 5458 B7R1.19 O=C(O)C1(O)CC1 Amb6609000 [1,0,0,1,0,0|1,0,0]=3 5459 B7R1.22 C=CC(N)C1CC1 Amb25296753 [1,0,0,1,0,0|2,0,0]=4 5460 B7R1.22 C=CC(N)C1CC1 Amb33527190 [1,0,0,1,0,0|2,0,0]=4 5461 B7R1.22 C=CC(O)C1CO1 Amb25806064 [1,0,0,1,0,0|2,0,0]=4 5462 B7R1.22 C=C[C@@H](O)[C@@H]1CO1 Amb27216477 [1,0,0,1,0,0|2,0,0]=4 5463 B7R1.22 C=C[C@@H](O)[C@H]1CO1 Amb27422599 [1,0,0,1,0,0|2,0,0]=4 5464 B7R1.22 C=C[C@H](N)C1CC1 Amb27175395 [1,0,0,1,0,0|2,0,0]=4 5465 B7R1.22 C=C[C@H](O)[C@H]1CO1 Amb26432088 [1,0,0,1,0,0|2,0,0]=4 5466 B7R1.22 CC(C=O)C1CC1 Amb25376838 [1,0,0,1,0,0|2,0,0]=4 5467 B7R1.22 NC(CO)C1CC1 Amb18282445 [1,0,0,1,0,0|1,0,1]=4 5468 B7R1.22 NC(CO)C1CC1 Amb19374057 [1,0,0,1,0,0|1,0,1]=4 5469 B7R1.22 N[C@@H](CO)C1CC1 Amb24077521 [1,0,0,1,0,0|1,0,1]=4 5470 B7R1.22 N[C@@H](CO)C1CC1 Amb25798421 [1,0,0,1,0,0|1,0,1]=4 5471 B7R1.22 N[C@H](CO)C1CC1 Amb24077489 [1,0,0,1,0,0|1,0,1]=4 5472 B7R1.22 N[C@H](CO)C1CC1 Amb24568257 [1,0,0,1,0,0|1,0,1]=4 5473 B7R1.22 O=CC(F)C1CC1 Amb27777027 [1,0,0,1,0,0|2,0,0]=4 5474 B7R1.22 O=CC(O)C1CC1 Amb27593028 [1,0,0,1,0,0|2,0,0]=4 5475 B7R1.22 OCC(O)C1CO1 Amb26046743 [1,0,0,1,0,0|1,0,1]=4 5476 B7R1.22 OC[C@@H](O)[C@H]1CO1 Amb27432222 [1,0,0,1,0,0|1,0,1]=4 5477 B7R1.23 CC1(Br)CC1C=O Amb25679179 [1,0,0,1,0,0|2,0,0]=4 5478 B7R1.23 CC1(C)CC1C=O Amb28071200 [1,0,0,1,0,0|2,0,0]=4 5479 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [1,0,0,1,0,0|2,0,0]=4 5480 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|2,0,0]=4 5481 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [1,0,0,1,0,0|2,0,0]=4 5482 B7R1.23 C[C@]1(Br)C[C@@H]1C=O Amb27215359 [1,0,0,1,0,0|2,0,0]=4 5483 B7R1.27 C=C1CC1(N)CO Amb27463476 [1,0,0,1,0,0|2,0,0]=4 5484 B7R1.27 C=CC1(N)CC1C Amb27965807 [1,0,0,1,0,0|2,0,0]=4 5485 B7R1.27 CC1(C=O)CC1F Amb27431004 [1,0,0,1,0,0|2,0,0]=4 5486 B7R1.27 CC1CC1(C)C=O Amb25076193 [1,0,0,1,0,0|2,0,0]=4 5487 B7R1.27 CC1CC1(N)CO Amb27209727 [1,0,0,1,0,0|1,0,1]=4 5488 B7R1.27 CC1OC1(C)C=O Amb28071199 [1,0,0,1,0,0|1,0,0]=3 5489 B7R1.27 CC1OC1(C)CO Amb27480879 [1,0,0,1,0,0|1,0,1]=4 5490 B7R1.27 C[C@@H]1C[C@]1(C)C=O Amb27493432 [1,0,0,1,0,0|2,0,0]=4 5491 B7R1.27 C[C@@H]1O[C@@]1(C)CO Amb27207277 [1,0,0,1,0,0|1,0,1]=4 5492 B7R1.27 C[C@H]1C[C@]1(N)CO Amb27192484 [1,0,0,1,0,0|1,0,1]=4 5493 B7R1.27 C[C@H]1O[C@]1(C)CO Amb27451635 [1,0,0,1,0,0|1,0,1]=4 5494 B7R1.30 CC1C(=O)C1(C)C Amb28321957 [1,0,0,1,0,0|2,0,0]=4 5495 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,1|1,0,1]=4 5496 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,1|1,0,1]=4 5497 B9R1.35 CC(=O)C1CCC(O)O1 Amb27838664 [0,0,0,1,0,1|2,0,0]=4 5498 B9R1.35 CC(C)C1COC(=O)N1 Amb10071773 [0,0,0,1,0,1|2,0,0]=4 5499 B9R1.35 CC(C)C1NCC(=O)N1 Amb27948988 [0,0,0,1,0,1|2,0,0]=4 5500 B9R1.35 CC(C)[C@@H]1COC(=O)N1 Amb8515206 [0,0,0,1,0,1|2,0,0]=4 5501 B9R1.35 CC(C)[C@H]1COC(=O)C1 Amb27242562 [0,0,0,1,0,1|2,0,0]=4 5502 B9R1.35 CC(C)[C@H]1COC(=O)N1 Amb8385596 [0,0,0,1,0,1|2,0,0]=4 5503 B9R1.35 CC(N)C1=CC(=O)ON1 Amb27971191 [0,0,0,1,0,1|1,0,1]=4 5504 B9R1.35 CC(O)C1CC(=O)NN1 Amb28285281 [0,0,0,1,0,1|1,0,0]=3 5505 B9R1.35 CC(O)C1CCC(=O)O1 Amb25998293 [0,0,0,1,0,1|2,0,0]=4 5506 B9R1.35 CC(O)C1CNC(=O)C1 Amb27258070 [0,0,0,1,0,1|2,0,0]=4 5507 B9R1.35 CC(O)C1CNC(O)=N1 Amb27444197 [0,0,0,1,0,1|2,0,0]=4 5508 B9R1.35 CC(O)[C@H]1C=CC(=O)O1 Amb27632756 [0,0,0,1,0,1|2,0,0]=4 5509 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,1|1,0,1]=4 5510 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,1|1,0,1]=4 5511 B9R1.35 CC1C=CC(C(=O)O)O1 Amb18642586 [0,0,0,1,0,1|2,0,0]=4 5512 B9R1.35 CC1CC(C(=O)O)=NO1 Amb25694020 [0,0,0,1,0,1|0,0,2]=4 5513 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,1|2,0,0]=4 5514 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,1|1,0,0]=3 5515 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [0,0,0,1,0,1|1,1,0]=4 5516 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,1|2,0,0]=4 5517 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,0,0,1,0,1|2,0,0]=4 5518 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,0,0,1,0,1|2,0,0]=4 5519 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,0,0,1,0,1|2,0,0]=4 5520 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,0,0,1,0,1|2,0,0]=4 5521 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,0,0,1,0,1|2,0,0]=4 5522 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [0,0,0,1,0,1|2,0,0]=4 5523 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|1,0,0]=3 5524 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|1,0,0]=3 5525 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,1|2,0,0]=4 5526 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [0,0,0,1,0,1|1,1,0]=4 5527 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [0,0,0,1,0,1|1,1,0]=4 5528 B9R1.35 CN1C=C(C(=O)O)NO1 Amb27793566 [0,0,0,1,0,1|1,0,1]=4 5529 B9R1.35 C[C@@H](F)[C@@H]1COC(=O)N1 Amb33715177 [0,0,0,1,0,1|2,0,0]=4 5530 B9R1.35 C[C@@H](O)C1CNC(=O)C1 Amb27390672 [0,0,0,1,0,1|2,0,0]=4 5531 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NN1 Amb27632305 [0,0,0,1,0,1|1,0,0]=3 5532 B9R1.35 C[C@@H](O)[C@@H]1C[C@@H](O)CN1 Amb27810862 [0,0,0,1,0,1|1,0,1]=4 5533 B9R1.35 C[C@@H](O)[C@H]1CC(=O)NN1 Amb27422060 [0,0,0,1,0,1|1,0,0]=3 5534 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)O)S1 Amb28347473 [0,0,0,1,0,1|2,0,0]=4 5535 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [0,0,0,1,0,1|1,0,1]=4 5536 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,0,0,1,0,1|2,0,0]=4 5537 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,1|2,0,0]=4 5538 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,0,0,1,0,1|2,0,0]=4 5539 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,1|2,0,0]=4 5540 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,0,0,1,0,1|2,0,0]=4 5541 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,0,0,1,0,1|2,0,0]=4 5542 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,0,0,1,0,1|2,0,0]=4 5543 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|1,0,0]=3 5544 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|1,0,0]=3 5545 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,1|1,0,0]=3 5546 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [0,0,0,1,0,1|1,1,0]=4 5547 B9R1.35 C[C@H](O)C1CNC(=O)C1 Amb27838586 [0,0,0,1,0,1|2,0,0]=4 5548 B9R1.35 C[C@H](O)[C@@H]1C=CC(=O)O1 Amb27213832 [0,0,0,1,0,1|2,0,0]=4 5549 B9R1.35 C[C@H](O)[C@@H]1COC(=O)O1 Amb27197946 [0,0,0,1,0,1|1,0,0]=3 5550 B9R1.35 C[C@H](O)[C@H]1C=CC(=O)O1 Amb28435793 [0,0,0,1,0,1|2,0,0]=4 5551 B9R1.35 C[C@H](O)[C@H]1CC(=O)NN1 Amb27789842 [0,0,0,1,0,1|1,0,0]=3 5552 B9R1.35 C[C@H](O)[C@H]1CNC(=O)C1 Amb27968562 [0,0,0,1,0,1|2,0,0]=4 5553 B9R1.35 C[C@H](O)[C@H]1COC(=O)C1 Amb27980502 [0,0,0,1,0,1|1,0,0]=3 5554 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,0,0,1,0,1|2,0,0]=4 5555 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,0,0,1,0,1|2,0,0]=4 5556 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,0,0,1,0,1|2,0,0]=4 5557 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,0,0,1,0,1|2,0,0]=4 5558 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|1,0,0]=3 5559 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|1,0,0]=3 5560 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [0,0,0,1,0,1|1,1,0]=4 5561 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [0,0,0,1,0,1|1,1,0]=4 5562 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,1,0,1|2,0,0]=4 5563 B9R1.35 NC(=O)C1CC(F)CN1 Amb32666337 [0,0,0,1,0,1|2,0,0]=4 5564 B9R1.35 NC(=O)C1CC(O)CN1 Amb1152420 [0,0,0,1,0,1|1,0,0]=3 5565 B9R1.35 NC(=O)C1CC(O)CN1 Amb32668520 [0,0,0,1,0,1|1,0,0]=3 5566 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,1,0,1|2,0,0]=4 5567 B9R1.35 NC(=O)[C@@H]1CC(O)CN1 Amb28054059 [0,0,0,1,0,1|1,0,0]=3 5568 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,1,0,1|2,0,0]=4 5569 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,1,0,1|2,0,0]=4 5570 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,1,0,1|1,0,0]=3 5571 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb28985696 [0,0,0,1,0,1|1,0,0]=3 5572 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb10808100 [0,0,0,1,0,1|2,0,0]=4 5573 B9R1.35 NC(=O)[C@@H]1C[C@H](O)CN1 Amb27476480 [0,0,0,1,0,1|1,0,0]=3 5574 B9R1.35 NC(=O)[C@H]1C[C@@H](O)CN1 Amb27628841 [0,0,0,1,0,1|1,0,0]=3 5575 B9R1.35 NC(=O)[C@H]1C[C@H](F)CN1 Amb27205380 [0,0,0,1,0,1|2,0,0]=4 5576 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,1,0,1|1,0,0]=3 5577 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,0,0,1,0,1|2,0,0]=4 5578 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,0,0,1,0,1|2,0,0]=4 5579 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,0,0,1,0,1|1,0,0]=3 5580 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,0,0,1,0,1|2,0,0]=4 5581 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [0,0,0,1,0,1|2,0,0]=4 5582 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,0,0,1,0,1|2,0,0]=4 5583 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,0,0,1,0,1|2,0,0]=4 5584 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,0,0,1,0,1|2,0,0]=4 5585 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,0,0,1,0,1|2,0,0]=4 5586 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,0,0,1,0,1|2,0,0]=4 5587 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,0,0,1,0,1|1,0,0]=3 5588 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,0,0,1,0,1|1,0,0]=3 5589 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,0,0,1,0,1|1,0,0]=3 5590 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,0,0,1,0,1|1,0,0]=3 5591 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,0,0,1,0,1|2,0,0]=4 5592 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,0,0,1,0,1|2,0,0]=4 5593 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,0,0,1,0,1|2,0,0]=4 5594 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,0,0,1,0,1|2,0,0]=4 5595 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,0,0,1,0,1|2,0,0]=4 5596 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,0,0,1,0,1|1,0,0]=3 5597 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,0,0,1,0,1|1,0,0]=3 5598 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,0,0,1,0,1|1,0,0]=3 5599 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,0,0,1,0,1|2,0,0]=4 5600 B9R1.35 O=C(O)C1=CC(O)CC1 Amb27619747 [0,0,0,1,0,1|1,0,1]=4 5601 B9R1.35 O=C(O)C1=C[C@@H](O)CC1 Amb27412374 [0,0,0,1,0,1|1,0,1]=4 5602 B9R1.35 O=C(O)C1=NC[C@@H](O)C1 Amb28198348 [0,0,0,1,0,1|0,0,2]=4 5603 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,0,0,1,0,1|1,0,0]=3 5604 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,0,0,1,0,1|1,0,0]=3 5605 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,0,0,1,0,1|1,0,0]=3 5606 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,1,0,1|0,0,0]=2 5607 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,1,0,1|0,0,0]=2 5608 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,1,0,1|0,0,0]=2 5609 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,0,0,1,0,1|1,0,0]=3 5610 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,0,0,1,0,1|2,0,0]=4 5611 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,1|2,0,0]=4 5612 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,1|2,0,0]=4 5613 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,1,0,1|1,0,0]=3 5614 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,0,0,1,0,1|1,1,0]=4 5615 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,1,0,1|0,0,0]=2 5616 B9R1.35 O=C(O)C1NC(O)CS1 Amb26536906 [0,0,0,1,0,1|1,0,0]=3 5617 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,1,0,1|0,0,0]=2 5618 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,0,0,1,0,1|0,1,0]=3 5619 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,1,0,1|1,0,0]=3 5620 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,1,0,1|1,0,0]=3 5621 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,0,0,1,0,1|1,1,0]=4 5622 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,0,0,1,0,1|1,0,0]=3 5623 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,0,0,1,0,1|1,0,0]=3 5624 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,0,0,1,0,1|1,0,0]=3 5625 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,1,0,1|0,0,2]=4 5626 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,1,0,1|0,0,0]=2 5627 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,0,0,1,0,1|1,0,0]=3 5628 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|0,1,0]=3 5629 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,0,0,1,0,1|1,0,0]=3 5630 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,0,0,1,0,1|1,0,0]=3 5631 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,0,0,1,0,1|1,0,0]=3 5632 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,0,0,1,0,1|1,0,0]=3 5633 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|1,0,0]=3 5634 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,1,0,1|0,0,0]=2 5635 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,1,0,1|0,0,0]=2 5636 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,1,0,1|0,0,0]=2 5637 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,0,0,1,0,1|0,1,0]=3 5638 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,0,0,1,0,1|0,1,0]=3 5639 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,0,0,1,0,1|1,0,0]=3 5640 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,1,0,1|1,0,0]=3 5641 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [0,0,0,1,0,1|1,0,0]=3 5642 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,0,0,1,0,1|1,0,0]=3 5643 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,0,0,1,0,1|1,0,0]=3 5644 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,1,0,1|0,0,0]=2 5645 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,1,0,1|0,0,0]=2 5646 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,0,0,1,0,1|1,0,0]=3 5647 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,0,0,1,0,1|1,0,0]=3 5648 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,1,0,1|0,0,0]=2 5649 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,1,0,1|0,0,0]=2 5650 B9R1.35 O=C(O)[C@H]1O[C@H](O)CS1 Amb25288477 [0,0,0,1,0,1|1,0,0]=3 5651 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,1|0,0,2]=4 5652 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,1|0,0,2]=4 5653 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,1|0,0,2]=4 5654 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,1|0,0,2]=4 5655 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,0,0,1,0,1|1,0,0]=3 5656 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,0,0,1,0,1|1,0,0]=3 5657 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,0,0,1,0,1|1,0,0]=3 5658 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,0,0,1,0,1|2,0,0]=4 5659 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,0,0,1,0,1|1,0,0]=3 5660 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,0,0,1,0,1|2,0,0]=4 5661 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,0,0,1,0,1|2,0,0]=4 5662 B9R1.36 NC1CS(=O)(=O)CC1O Amb1420287 [0,0,0,1,0,1|1,0,1]=4 5663 B9R1.36 N[C@@H]1CS(=O)(=O)C[C@@H]1O Amb22757918 [0,0,0,1,0,1|1,0,1]=4 5664 B9R1.36 N[C@@H]1CS(=O)(=O)C[C@H]1O Amb2404841 [0,0,0,1,0,1|1,0,1]=4 5665 B9R1.36 N[C@@H]1CS(=O)(=O)C[C@H]1O Amb24107550 [0,0,0,1,0,1|1,0,1]=4 5666 B9R1.36 N[C@H]1CS(=O)(=O)C[C@@H]1O Amb10608835 [0,0,0,1,0,1|1,0,1]=4 5667 B9R1.36 N[C@H]1C[S+](=O)([O-])C[C@H]1O Amb17727759 [0,0,0,1,0,1|1,0,1]=4 5668 B9R1.38 CC1(C)NC(=O)CC1N Amb34932666 [0,0,0,1,0,1|2,0,0]=4 5669 B9R1.38 CC1(C)OC(=O)C=C1N Amb28193555 [0,0,0,1,0,1|1,0,1]=4 5670 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,0,0,1,0,1|2,0,0]=4 5671 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,0,0,1,0,1|1,0,1]=4 5672 B9R1.38 CC1(C)SC(=O)CC1N Amb28367437 [0,0,0,1,0,1|1,1,0]=4 5673 B9R1.38 CC1(Cl)OC(=O)OC1F Amb27955117 [0,0,0,1,0,1|2,0,0]=4 5674 B9R1.38 CC1(F)OC(=O)OC1Cl Amb26390809 [0,0,0,1,0,1|2,0,0]=4 5675 B9R1.38 CC1(O)NC(=O)NC1O Amb28423597 [0,0,0,1,0,1|2,0,0]=4 5676 B9R1.38 CC1CC(=O)OC1(C)C Amb28206444 [0,0,0,1,0,1|2,0,0]=4 5677 B9R1.38 CC1C[C@@H](N)P(=O)(O)O1 Amb27230015 [0,0,0,1,0,1|1,0,0]=3 5678 B9R1.38 CC1NC(=O)OC1(C)C Amb28457652 [0,0,0,1,0,1|2,0,0]=4 5679 B9R1.44 CC(=O)CC1(C)OC1C Amb28054341 [0,0,0,1,0,1|2,0,0]=4 5680 B9R1.44 CC1(CC(=O)O)CC1F Amb32664391 [0,0,0,1,0,1|2,0,0]=4 5681 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,0,0,1,0,1|1,0,0]=3 5682 B9R1.44 CC1CC1(N)CC(N)=O Amb27631646 [0,0,0,1,0,1|2,0,0]=4 5683 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,0,0,1,0,1|1,0,1]=4 5684 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,0,0,1,0,1|1,0,1]=4 5685 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,0,0,1,0,1|1,0,1]=4 5686 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,0,0,1,0,1|2,0,0]=4 5687 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,0,0,1,0,1|1,0,0]=3 5688 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,0,0,1,0,1|2,0,0]=4 5689 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,0,0,1,0,1|1,0,1]=4 5690 B9R1.55 CC(C)[C@@H]1NC(=O)[C@@H]1N Amb28349277 [0,0,0,1,0,1|2,0,0]=4 5691 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,0,0,1,0,1|2,0,0]=4 5692 B9R1.55 CC1OC(C(=O)[O-])C1O Amb28069594 [0,0,0,1,0,1|1,0,1]=4 5693 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,0,0,1,0,1|2,0,0]=4 5694 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,0,0,1,0,1|0,0,0]=2 5695 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,0,0,1,0,1|2,0,0]=4 5696 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,0,0,1,0,1|2,0,0]=4 5697 B9R1.69 CC1=CC(=O)OCC1O Amb28457807 [0,0,0,1,0,1|1,0,1]=4 5698 B9R1.69 CC1=C[C@@H](N)[C@@H](C)OC1 Amb27188228 [0,0,0,1,0,1|2,0,0]=4 5699 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,0,0,1,0,1|2,0,0]=4 5700 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,0,0,1,0,1|2,0,0]=4 5701 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,0,0,1,0,1|1,0,0]=3 5702 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,0,0,1,0,1|2,0,0]=4 5703 B9R1.69 CC1CNC(=O)NC1N Amb27229171 [0,0,0,1,0,1|2,0,0]=4 5704 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,0,0,1,0,1|2,0,0]=4 5705 B9R1.69 CC1NC(=O)COC1C Amb27440075 [0,0,0,1,0,1|2,0,0]=4 5706 B9R1.69 CC1OCC(=O)C=C1N Amb27799172 [0,0,0,1,0,1|1,0,1]=4 5707 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,0,0,1,0,1|2,0,0]=4 5708 B9R1.69 C[C@@H]1COC(=O)N[C@H]1C Amb27203324 [0,0,0,1,0,1|2,0,0]=4 5709 B9R1.69 C[C@@H]1OC(O)CCC1=O Amb28351368 [0,0,0,1,0,1|2,0,0]=4 5710 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [0,0,0,1,0,1|2,0,0]=4 5711 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,0,0,1,0,1|2,0,0]=4 5712 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,0,0,1,0,1|2,0,0]=4 5713 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,0,0,1,0,1|2,0,0]=4 5714 B9R1.69 C[C@H]1C[C@@H](O)CCC1=O Amb28253634 [0,0,0,1,0,1|2,0,0]=4 5715 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,0,0,1,0,1|2,0,0]=4 5716 B9R1.69 NC1CC(O)CCC1=O Amb28430066 [0,0,0,1,0,1|1,0,0]=3 5717 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,0,0,1,0,1|1,0,0]=3 5718 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,0,0,1,0,1|1,0,0]=3 5719 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,0,0,1,0,1|1,0,0]=3 5720 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,0,0,1,0,1|1,0,0]=3 5721 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,0,0,1,0,1|2,0,0]=4 5722 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,0,0,1,0,1|2,0,0]=4 5723 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,0,0,1,0,1|2,0,0]=4 5724 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,0,0,1,0,1|2,0,0]=4 5725 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [0,0,0,1,0,1|2,0,0]=4 5726 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,0,0,1,0,1|2,0,0]=4 5727 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,0,0,1,0,1|2,0,0]=4 5728 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,0,0,1,0,1|2,0,0]=4 5729 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,0,0,1,0,1|2,0,0]=4 5730 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,0,0,1,0,1|2,0,0]=4 5731 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,0,0,1,0,1|2,0,0]=4 5732 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [0,0,0,1,0,1|2,0,0]=4 5733 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [0,0,0,1,0,1|2,0,0]=4 5734 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,0,0,1,0,1|1,0,0]=3 5735 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,0,0,1,0,1|1,0,0]=3 5736 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,0,0,1,0,1|1,0,0]=3 5737 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,0,0,1,0,1|0,0,0]=2 5738 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,0,0,1,0,1|1,0,0]=3 5739 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,0,0,1,0,1|2,0,0]=4 5740 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,0,0,1,0,1|2,0,0]=4 5741 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,0,0,1,0,1|2,0,0]=4 5742 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,0,0,1,0,1|2,0,0]=4 5743 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,0,0,1,0,1|2,0,0]=4 5744 B9R1.137 CC(=O)CC(N)C1CC1 Amb27228240 [0,0,0,1,0,1|2,0,0]=4 5745 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,0,0,1,0,1|2,0,0]=4 5746 B9R1.137 NC(=O)CC(N)C1CC1 Amb18988331 [0,0,0,1,0,1|2,0,0]=4 5747 B9R1.137 NC(=O)CC(N)C1CC1 Amb33549860 [0,0,0,1,0,1|2,0,0]=4 5748 B9R1.137 NC(=O)C[C@@H](N)C1CC1 Amb25259754 [0,0,0,1,0,1|2,0,0]=4 5749 B9R1.137 NC(=O)C[C@H](N)C1CC1 Amb28347712 [0,0,0,1,0,1|2,0,0]=4 5750 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,0,0,1,0,1|1,0,0]=3 5751 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,0,0,1,0,1|1,0,0]=3 5752 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,0,0,1,0,1|1,0,0]=3 5753 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,0,0,1,0,1|1,0,0]=3 5754 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,0,0,1,0,1|1,0,0]=3 5755 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,0,0,1,0,1|2,0,0]=4 5756 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,0,0,1,0,1|2,0,0]=4 5757 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,0,0,1,0,1|2,0,0]=4 5758 B9R1.139 CC1(C)C(Br)C1C(=O)O Amb28078793 [0,0,0,1,0,1|2,0,0]=4 5759 B9R1.139 CC1(C)C(C(=O)O)[C@H]1Cl Amb28043135 [0,0,0,1,0,1|2,0,0]=4 5760 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,0,0,1,0,1|2,0,0]=4 5761 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27247272 [0,0,0,1,0,1|2,0,0]=4 5762 B9R1.139 C[C@H]1[C@@H](C(=O)O)C1(C)C Amb28429827 [0,0,0,1,0,1|2,0,0]=4 5763 B9R1.152 C=C(C)C1(N)CC(O)C1 Amb33199183 [0,0,0,1,0,1|2,0,0]=4 5764 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,0,0,1,0,1|1,0,1]=4 5765 B9R1.152 CC1(C(=O)O)CC(Cl)C1 Amb27460159 [0,0,0,1,0,1|2,0,0]=4 5766 B9R1.152 CC1(C(=O)O)CC(F)C1 Amb32906768 [0,0,0,1,0,1|2,0,0]=4 5767 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb25889781 [0,0,0,1,0,1|2,0,0]=4 5768 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb33456976 [0,0,0,1,0,1|2,0,0]=4 5769 B9R1.152 CC1(C(=O)O)CC(O)C1 Amb33361249 [0,0,0,1,0,1|1,0,0]=3 5770 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,0,0,1,0,1|2,0,0]=4 5771 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,0,0,1,0,1|1,0,0]=3 5772 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,0,0,1,0,1|1,0,0]=3 5773 B9R1.152 CC1CC(N)(C(N)=O)C1 Amb27465840 [0,0,0,1,0,1|2,0,0]=4 5774 B9R1.152 CN1CC(N)(C(=O)O)C1 Amb28312895 [0,0,0,1,0,1|2,0,0]=4 5775 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb23440223 [0,0,0,1,0,1|2,0,0]=4 5776 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb24730954 [0,0,0,1,0,1|2,0,0]=4 5777 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb23439475 [0,0,0,1,0,1|2,0,0]=4 5778 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb25275111 [0,0,0,1,0,1|2,0,0]=4 5779 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328633 [0,0,0,1,0,1|1,0,0]=3 5780 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328634 [0,0,0,1,0,1|1,0,0]=3 5781 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb26579071 [0,0,0,1,0,1|1,0,0]=3 5782 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb30585191 [0,0,0,1,0,1|1,0,0]=3 5783 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb26585144 [0,0,0,1,0,1|0,0,0]=2 5784 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb28992378 [0,0,0,1,0,1|0,0,0]=2 5785 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb25784332 [0,0,0,1,0,1|2,0,0]=4 5786 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb33484269 [0,0,0,1,0,1|2,0,0]=4 5787 B9R1.152 NC1CC(O)(C(=O)O)C1 Amb27194402 [0,0,0,1,0,1|2,0,0]=4 5788 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb26959446 [0,0,0,1,0,1|1,0,0]=3 5789 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb32655998 [0,0,0,1,0,1|1,0,0]=3 5790 B9R1.152 N[C@]1(C(=O)O)C[C@H](F)C1 Amb22746505 [0,0,0,1,0,1|1,0,0]=3 5791 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb25297893 [0,0,0,1,0,1|0,0,0]=2 5792 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb32679390 [0,0,0,1,0,1|0,0,0]=2 5793 B9R1.152 O=C(O)C1(F)CC(F)C1 Amb34162941 [0,0,0,1,0,1|2,0,0]=4 5794 B9R1.152 O=C(O)C1(F)CC(O)C1 Amb34142466 [0,0,0,1,0,1|1,0,0]=3 5795 B9R1.152 O=C(O)[C@]1(F)C[C@@H](O)C1 Amb34912853 [0,0,0,1,0,1|1,0,0]=3 5796 B9R1.152 O=C(O)[C@]1(F)C[C@H](O)C1 Amb34161934 [0,0,0,1,0,1|1,0,0]=3 5797 B9R1.152 O=C(O)[C@]1(O)C[C@@H](O)C1 Amb34147022 [0,0,0,1,0,1|1,0,0]=3 5798 B9R1.152 O=C(O)[C@]1(O)C[C@H](O)C1 Amb34136524 [0,0,0,1,0,1|1,0,0]=3 5799 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,0,1,0,1|2,0,0]=4 5800 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,0,1,0,1|2,0,0]=4 5801 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,1|2,0,0]=4 5802 B9R1.161 CC(N)C1CC1C(=O)O Amb27441985 [0,0,0,1,0,1|2,0,0]=4 5803 B9R1.161 CC(O)C1CC1C(=O)O Amb25888760 [0,0,0,1,0,1|1,0,0]=3 5804 B9R1.161 CC(O)[C@@H]1C[C@@H]1C(=O)O Amb28457538 [0,0,0,1,0,1|1,0,0]=3 5805 B9R1.161 CC(O)[C@@H]1C[C@H]1C(=O)O Amb27489157 [0,0,0,1,0,1|1,0,0]=3 5806 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,0,0,1,0,1|2,0,0]=4 5807 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,0,0,1,0,1|2,0,0]=4 5808 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,0,0,1,0,1|1,0,0]=3 5809 B9R1.164 CC1(Cl)CC(C(=O)O)C1 Amb28364447 [0,0,0,1,0,1|2,0,0]=4 5810 B9R1.164 CC1(F)CC(C(=O)O)C1 Amb23439467 [0,0,0,1,0,1|2,0,0]=4 5811 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,0,0,1,0,1|1,0,0]=3 5812 B9R1.164 C[C@]1(Cl)C[C@@H](C(=O)O)C1 Amb27170444 [0,0,0,1,0,1|2,0,0]=4 5813 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 Amb26394027 [0,0,0,1,0,1|2,0,0]=4 5814 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 Amb28350729 [0,0,0,1,0,1|2,0,0]=4 5815 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,0,0,1,0,1|1,0,0]=3 5816 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,0,0,1,0,1|1,0,0]=3 5817 B9R1.164 C[C@]1(O)C[C@H](C(=O)[O-])C1 Amb34913076 [0,0,0,1,0,1|1,0,1]=4 5818 B9R1.164 O=C(O)C1CC(O)(O)C1 Amb27490909 [0,0,0,1,0,1|2,0,0]=4 5819 B9R1.169 CC(=O)C1(C)OC1(C)O Amb24636952 [0,0,0,1,0,1|2,0,0]=4 5820 B9R1.169 CC1(Br)CC1(C)C(=O)O Amb27792919 [0,0,0,1,0,1|2,0,0]=4 5821 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,0,0,1,0,1|1,0,0]=3 5822 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,0,0,1,0,1|1,0,0]=3 5823 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,0,0,1,0,1|1,0,0]=3 5824 B9R1.169 CC1(C)C[C@@]1(N)C(N)=O Amb25887316 [0,0,0,1,0,1|2,0,0]=4 5825 B9R1.169 CC1(C)C[C@]1(N)C(N)=O Amb28254983 [0,0,0,1,0,1|2,0,0]=4 5826 B9R1.169 C[C@]1(Br)C[C@@]1(C)C(=O)O Amb27419957 [0,0,0,1,0,1|2,0,0]=4 5827 B9R1.169 NC1(C(=O)O)CC1(F)F Amb25233043 [0,0,0,1,0,1|2,0,0]=4 5828 B9R1.169 N[C@]1(C(=O)O)CC1(F)F Amb25874004 [0,0,0,1,0,1|2,0,0]=4 5829 B9R1.170 CC(=O)CC1CC1(C)O Amb28461242 [0,0,0,1,0,1|2,0,0]=4 5830 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,0,0,1,0,1|2,0,0]=4 5831 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,1,0,1,0,0|2,0,0]=4 5832 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|2,0,0]=4 5833 B9R1.3 CC1OCCC(=O)C1C Amb33715158 [0,1,0,1,0,0|2,0,0]=4 5834 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,1,0,1,0,0|2,0,0]=4 5835 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,1,0,1,0,0|2,0,0]=4 5836 B9R1.3 NC1C(O)CCCC1O Amb18642840 [0,1,0,1,0,0|1,0,1]=4 5837 B9R1.3 N[C@@H]1[C@@H](O)CCC[C@H]1O Amb27230391 [0,1,0,1,0,0|1,0,1]=4 5838 B9R1.3 N[C@H]1[C@@H](O)CCC[C@H]1O Amb27469070 [0,1,0,1,0,0|1,0,1]=4 5839 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,1,0,1,0,0|2,0,0]=4 5840 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,1,0,1,0,0|2,0,0]=4 5841 B9R1.37 C=C1C(=O)OC(C)C1O Amb28315459 [0,1,0,1,0,0|1,0,1]=4 5842 B9R1.37 CC1=C(N)C(C)OC1=O Amb27174518 [0,1,0,1,0,0|1,0,1]=4 5843 B9R1.37 CC1=C(O)C(=O)CC1O Amb28315501 [0,1,0,1,0,0|1,0,1]=4 5844 B9R1.37 CC1=C(O)C(=O)OC1C Amb8393149 [0,1,0,1,0,0|1,0,1]=4 5845 B9R1.37 CC1=C(O)C(O)C(=O)O1 Amb25769590 [0,1,0,1,0,0|1,0,1]=4 5846 B9R1.37 CC1=CC(=O)C(O)C1O Amb27838677 [0,1,0,1,0,0|2,0,0]=4 5847 B9R1.37 CC1C(=O)CC(O)C1C Amb27838809 [0,1,0,1,0,0|2,0,0]=4 5848 B9R1.37 CC1C(=O)OC(=O)C1C Amb27266073 [0,1,0,1,0,0|1,0,1]=4 5849 B9R1.37 CC1C(=O)OC(=O)[C@H]1N Amb27664717 [0,1,0,1,0,0|0,0,1]=3 5850 B9R1.37 CC1CN(O)C(=O)C1N Amb25888759 [0,1,0,1,0,0|1,0,0]=3 5851 B9R1.37 CC1OC(=O)C(=O)C1C Amb24360322 [0,1,0,1,0,0|1,0,1]=4 5852 B9R1.37 CC1OC(=O)C(N)=C1N Amb27185472 [0,1,0,1,0,0|1,0,1]=4 5853 B9R1.37 CC1OC(=O)C(N)C1C Amb27424680 [0,1,0,1,0,0|1,0,0]=3 5854 B9R1.37 CC1OC(=O)C(O)C1Br Amb27966842 [0,1,0,1,0,0|1,0,1]=4 5855 B9R1.37 CC1OC(=O)C(O)C1I Amb27253078 [0,1,0,1,0,0|1,0,1]=4 5856 B9R1.37 C[C@@H]1C(=O)C[C@@H](O)[C@H]1C Amb27199145 [0,1,0,1,0,0|2,0,0]=4 5857 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30588539 [0,1,0,1,0,0|1,0,0]=3 5858 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30640026 [0,1,0,1,0,0|1,0,0]=3 5859 B9R1.37 C[C@@H]1OC(=O)C(N)=C1O Amb27850737 [0,1,0,1,0,0|0,0,2]=4 5860 B9R1.37 C[C@@H]1OC(=O)C(O)=C1O Amb25332813 [0,1,0,1,0,0|1,0,1]=4 5861 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@@H]1C Amb27203003 [0,1,0,1,0,0|1,0,0]=3 5862 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@H]1C Amb25946352 [0,1,0,1,0,0|1,0,0]=3 5863 B9R1.37 C[C@@H]1OC(=O)[C@@H](O)[C@@H]1O Amb27857584 [0,1,0,1,0,0|1,0,0]=3 5864 B9R1.37 C[C@@H]1OC(=O)[C@H](N)[C@@H]1C Amb27961355 [0,1,0,1,0,0|1,0,0]=3 5865 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@@H]1O Amb25327544 [0,1,0,1,0,0|1,0,0]=3 5866 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@H]1I Amb2612169 [0,1,0,1,0,0|1,0,1]=4 5867 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@H]1O Amb24714713 [0,1,0,1,0,0|1,0,0]=3 5868 B9R1.37 C[C@H]1CN(O)C(=O)[C@@H]1N Amb24587752 [0,1,0,1,0,0|1,0,0]=3 5869 B9R1.37 C[C@H]1CN(O)C(=O)[C@H]1N Amb27215974 [0,1,0,1,0,0|1,0,0]=3 5870 B9R1.37 C[C@H]1OC(=N)[C@@H](O)[C@H]1O Amb27775523 [0,1,0,1,0,0|2,0,0]=4 5871 B9R1.37 C[C@H]1OC(=N)[C@H](O)[C@H]1O Amb27775524 [0,1,0,1,0,0|2,0,0]=4 5872 B9R1.37 C[C@H]1OC(=O)[C@@H](O)[C@@H]1O Amb27438513 [0,1,0,1,0,0|1,0,0]=3 5873 B9R1.37 C[C@H]1OC(=O)[C@@H](O)[C@H]1O Amb27640250 [0,1,0,1,0,0|1,0,0]=3 5874 B9R1.37 C[C@H]1OC(=O)[C@H](N)[C@H]1C Amb27421606 [0,1,0,1,0,0|1,0,0]=3 5875 B9R1.37 C[C@H]1OC(=O)[C@H](O)[C@@H]1O Amb27642097 [0,1,0,1,0,0|1,0,0]=3 5876 B9R1.37 C[C@H]1OC(=O)[C@H](O)[C@H]1O Amb27432207 [0,1,0,1,0,0|1,0,0]=3 5877 B9R1.37 C[C@H]1[C@H](N)C(=O)O[C@@H]1C Amb26415247 [0,1,0,1,0,0|1,0,0]=3 5878 B9R1.37 NC1C(=O)N(O)CC1O Amb27956515 [0,1,0,1,0,0|0,0,0]=2 5879 B9R1.37 N[C@H]1C(=O)N(O)C[C@@H]1O Amb27480613 [0,1,0,1,0,0|0,0,0]=2 5880 B9R1.37 N[C@H]1C(=O)N(O)C[C@H]1O Amb27218653 [0,1,0,1,0,0|0,0,0]=2 5881 B9R1.37 N[C@H]1C[C@H](O)[C@@H](N)[C@@H]1O Amb27816640 [0,1,0,1,0,0|1,0,1]=4 5882 B9R1.37 O=C1CC(O)C(O)C1O Amb28054442 [0,1,0,1,0,0|1,0,1]=4 5883 B9R1.37 O=C1OC(O)C(Br)C1Br Amb21811590 [0,1,0,1,0,0|2,0,0]=4 5884 B9R1.37 O=C1OC(O)C(O)C1O Amb24419120 [0,1,0,1,0,0|1,0,0]=3 5885 B9R1.41 C=C(C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|2,0,0]=4 5886 B9R1.41 C=C(C)[C@@H]1CNC[C@H]1O Amb32944875 [0,1,0,1,0,0|2,0,0]=4 5887 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|2,0,0]=4 5888 B9R1.41 CC(=O)C1CCOC1C Amb25882003 [0,1,0,1,0,0|2,0,0]=4 5889 B9R1.41 CC(=O)C1CNCC1C Amb28346154 [0,1,0,1,0,0|2,0,0]=4 5890 B9R1.41 CC(=O)C1CNCC1O Amb33213407 [0,1,0,1,0,0|1,0,0]=3 5891 B9R1.41 CC(=O)C1COCC1O Amb32951053 [0,1,0,1,0,0|2,0,0]=4 5892 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [0,1,0,1,0,0|2,0,0]=4 5893 B9R1.41 CC(=O)[C@@H]1CNC[C@H]1O Amb32945575 [0,1,0,1,0,0|1,0,0]=3 5894 B9R1.41 CC(=O)[C@@H]1COC[C@H]1O Amb32951076 [0,1,0,1,0,0|2,0,0]=4 5895 B9R1.41 CC(C)C1C=COC1=O Amb27427630 [0,1,0,1,0,0|2,0,0]=4 5896 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|2,0,0]=4 5897 B9R1.41 CC(C)[C@@H]1NCCC1=O Amb18832683 [0,1,0,1,0,0|2,0,0]=4 5898 B9R1.41 CC(N)C1CCOC1=O Amb28240358 [0,1,0,1,0,0|2,0,0]=4 5899 B9R1.41 CC(O)C1CCCC1=O Amb27762504 [0,1,0,1,0,0|2,0,0]=4 5900 B9R1.41 CC(O)C1CCOC1=O Amb27755525 [0,1,0,1,0,0|1,0,0]=3 5901 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [0,1,0,1,0,0|2,0,0]=4 5902 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [0,1,0,1,0,0|1,0,0]=3 5903 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [0,1,0,1,0,0|1,0,0]=3 5904 B9R1.41 CC1CCNC1C(N)=O Amb26893292 [0,1,0,1,0,0|2,0,0]=4 5905 B9R1.41 CC1CCNC1C(N)=O Amb33307145 [0,1,0,1,0,0|2,0,0]=4 5906 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [0,1,0,1,0,0|1,0,0]=3 5907 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [0,1,0,1,0,0|2,0,0]=4 5908 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [0,1,0,1,0,0|2,0,0]=4 5909 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [0,1,0,1,0,0|1,0,0]=3 5910 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [0,1,0,1,0,0|1,0,0]=3 5911 B9R1.41 CC1CNCC1C(N)=O Amb26454427 [0,1,0,1,0,0|2,0,0]=4 5912 B9R1.41 CC1CNCC1C(N)=O Amb32663022 [0,1,0,1,0,0|2,0,0]=4 5913 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [0,1,0,1,0,0|2,0,0]=4 5914 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [0,1,0,1,0,0|2,0,0]=4 5915 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [0,1,0,1,0,0|1,0,0]=3 5916 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [0,1,0,1,0,0|1,0,0]=3 5917 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [0,1,0,1,0,0|0,1,0]=3 5918 B9R1.41 C[C@@H](O)[C@@H]1CCOC1=O Amb27488640 [0,1,0,1,0,0|1,0,0]=3 5919 B9R1.41 C[C@@H](O)[C@H]1CC=CC1=O Amb27854025 [0,1,0,1,0,0|2,0,0]=4 5920 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [0,1,0,1,0,0|2,0,0]=4 5921 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|2,0,0]=4 5922 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|2,0,0]=4 5923 B9R1.41 C[C@@H]1CCN[C@@H]1C(N)=O Amb27446302 [0,1,0,1,0,0|2,0,0]=4 5924 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [0,1,0,1,0,0|1,0,0]=3 5925 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [0,1,0,1,0,0|2,0,0]=4 5926 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [0,1,0,1,0,0|2,0,0]=4 5927 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [0,1,0,1,0,0|1,0,0]=3 5928 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [0,1,0,1,0,0|1,0,0]=3 5929 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [0,1,0,1,0,0|1,0,0]=3 5930 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|2,0,0]=4 5931 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb26066427 [0,1,0,1,0,0|2,0,0]=4 5932 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [0,1,0,1,0,0|1,0,0]=3 5933 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [0,1,0,1,0,0|2,0,0]=4 5934 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [0,1,0,1,0,0|2,0,0]=4 5935 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [0,1,0,1,0,0|1,0,0]=3 5936 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [0,1,0,1,0,0|1,0,0]=3 5937 B9R1.41 C[C@H](O)[C@H]1CCOC1=O Amb27618909 [0,1,0,1,0,0|1,0,0]=3 5938 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|2,0,0]=4 5939 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|2,0,0]=4 5940 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [0,1,0,1,0,0|1,0,0]=3 5941 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [0,1,0,1,0,0|1,0,0]=3 5942 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [0,1,0,1,0,0|2,0,0]=4 5943 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [0,1,0,1,0,0|1,0,0]=3 5944 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [0,1,0,1,0,0|0,0,0]=2 5945 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [0,1,0,1,0,0|0,0,0]=2 5946 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [0,1,0,1,0,0|1,0,0]=3 5947 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|2,0,0]=4 5948 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|1,0,0]=3 5949 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [0,1,0,1,0,0|2,0,0]=4 5950 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [0,1,0,1,0,0|1,0,0]=3 5951 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|1,0,0]=3 5952 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [0,1,0,1,0,0|2,0,0]=4 5953 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|1,0,0]=3 5954 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [0,1,0,1,0,0|1,0,0]=3 5955 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [0,1,0,1,0,0|2,0,0]=4 5956 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [0,1,0,1,0,0|2,0,0]=4 5957 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [0,1,0,1,0,0|1,0,0]=3 5958 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [0,1,0,1,0,0|2,0,0]=4 5959 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [0,1,0,1,0,0|1,0,0]=3 5960 B9R1.41 NC1COCC1C(=O)O Amb24709230 [0,1,0,1,0,0|2,0,0]=4 5961 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [0,1,0,1,0,0|2,0,0]=4 5962 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [0,1,0,1,0,0|2,0,0]=4 5963 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [0,1,0,1,0,0|2,0,0]=4 5964 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [0,1,0,1,0,0|2,0,0]=4 5965 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [0,1,0,1,0,0|2,0,0]=4 5966 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [0,1,0,1,0,0|1,0,0]=3 5967 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [0,1,0,1,0,0|1,0,0]=3 5968 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [0,1,0,1,0,0|2,0,0]=4 5969 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [0,1,0,1,0,0|2,0,0]=4 5970 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [0,1,0,1,0,0|1,0,0]=3 5971 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [0,1,0,1,0,0|2,0,0]=4 5972 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [0,1,0,1,0,0|2,0,0]=4 5973 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [0,1,0,1,0,0|2,0,0]=4 5974 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [0,1,0,1,0,0|2,0,0]=4 5975 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|2,0,0]=4 5976 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|2,0,0]=4 5977 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [0,1,0,1,0,0|1,0,0]=3 5978 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [0,1,0,1,0,0|1,0,0]=3 5979 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [0,1,0,1,0,0|1,0,0]=3 5980 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [0,1,0,1,0,0|2,0,0]=4 5981 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [0,1,0,1,0,0|2,0,0]=4 5982 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [0,1,0,1,0,0|2,0,0]=4 5983 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [0,1,0,1,0,0|2,0,0]=4 5984 B9R1.41 O=C(O)C1=CCCC1O Amb27251744 [0,1,0,1,0,0|1,0,1]=4 5985 B9R1.41 O=C(O)C1=NCCC1O Amb28137087 [0,1,0,1,0,0|0,0,2]=4 5986 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 5987 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,1,0]=4 5988 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [0,1,0,1,0,0|1,0,0]=3 5989 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [0,1,0,1,0,0|1,0,0]=3 5990 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [0,1,0,1,0,0|0,0,0]=2 5991 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [0,1,0,1,0,0|0,0,0]=2 5992 B9R1.41 O=C(O)C1COCC1O Amb27270738 [0,1,0,1,0,0|1,0,0]=3 5993 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [0,1,0,1,0,0|1,0,0]=3 5994 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|1,0,0]=3 5995 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [0,1,0,1,0,0|0,0,0]=2 5996 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [0,1,0,1,0,0|0,0,0]=2 5997 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [0,1,0,1,0,0|2,0,0]=4 5998 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [0,1,0,1,0,0|0,0,0]=2 5999 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [0,1,0,1,0,0|0,0,0]=2 6000 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [0,1,0,1,0,0|1,0,0]=3 6001 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [0,1,0,1,0,0|1,0,0]=3 6002 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [0,1,0,1,0,0|0,0,0]=2 6003 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [0,1,0,1,0,0|0,0,0]=2 6004 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [0,1,0,1,0,0|0,0,0]=2 6005 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [0,1,0,1,0,0|1,0,0]=3 6006 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [0,1,0,1,0,0|1,0,0]=3 6007 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [0,1,0,1,0,0|0,0,0]=2 6008 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [0,1,0,1,0,0|0,0,0]=2 6009 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [0,1,0,1,0,0|1,0,0]=3 6010 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 6011 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [0,1,0,1,0,0|0,0,0]=2 6012 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [0,1,0,1,0,0|0,0,0]=2 6013 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [0,1,0,1,0,0|0,0,0]=2 6014 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [0,1,0,1,0,0|1,0,0]=3 6015 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [0,1,0,1,0,0|0,0,0]=2 6016 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [0,1,0,1,0,0|0,0,0]=2 6017 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [0,1,0,1,0,0|0,0,0]=2 6018 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [0,1,0,1,0,0|1,0,0]=3 6019 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [0,1,0,1,0,0|0,0,0]=2 6020 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [0,1,0,1,0,0|0,0,0]=2 6021 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [0,1,0,1,0,0|0,0,0]=2 6022 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [0,1,0,1,0,0|0,1,0]=3 6023 B9R1.81 COC(=O)C1CCC1C Amb25110041 [0,1,0,1,0,0|2,0,0]=4 6024 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,1,0,0|2,0,0]=4 6025 B9R1.81 COC(=O)C1CCC1N Amb32664922 [0,1,0,1,0,0|2,0,0]=4 6026 B9R1.81 COC(=O)C1CNC1C Amb30594216 [0,1,0,1,0,0|2,0,0]=4 6027 B9R1.81 COC(=O)C1NCC1=O Amb28208249 [0,1,0,1,0,0|0,0,2]=4 6028 B9R1.81 COC(=O)C1NCC1C Amb28070582 [0,1,0,1,0,0|1,0,0]=3 6029 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,1,0,0|2,0,0]=4 6030 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,1,0,0|2,0,0]=4 6031 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb30633597 [0,1,0,1,0,0|2,0,0]=4 6032 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33714361 [0,1,0,1,0,0|2,0,0]=4 6033 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33719044 [0,1,0,1,0,0|2,0,0]=4 6034 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb27617550 [0,1,0,1,0,0|2,0,0]=4 6035 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb33719045 [0,1,0,1,0,0|2,0,0]=4 6036 B9R1.81 COC(=O)[C@@H]1CN[C@H]1C Amb34913691 [0,1,0,1,0,0|2,0,0]=4 6037 B9R1.81 COC(=O)[C@H]1CC[C@H]1C Amb25919237 [0,1,0,1,0,0|2,0,0]=4 6038 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,1,0,0|2,0,0]=4 6039 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb34144031 [0,1,0,1,0,0|2,0,0]=4 6040 B9R1.81 O=C1NCC1C(O)CF Amb27760296 [0,1,0,1,0,0|2,0,0]=4 6041 B9R1.81 O=C1NC[C@H]1[C@H](O)CF Amb27205323 [0,1,0,1,0,0|2,0,0]=4 6042 B9R1.81 O=C[C@@H](O)[C@@H]1SC[C@@H]1O Amb28129425 [0,1,0,1,0,0|1,0,1]=4 6043 B9R1.81 OC[C@H](O)[C@H]1NC[C@H]1O Amb27216406 [0,1,0,1,0,0|0,0,2]=4 6044 B9R1.93 C#CC1CC1(N)C(=O)O Amb23456002 [0,1,0,1,0,0|1,0,0]=3 6045 B9R1.93 C=CC1CC1(N)C(=O)O Amb10068409 [0,1,0,1,0,0|1,0,0]=3 6046 B9R1.93 C=CC1CC1(N)[PH](=O)O Amb27970647 [0,1,0,1,0,0|2,0,0]=4 6047 B9R1.93 C=C[C@@H]1C[C@@]1(N)C(=O)O Amb26958678 [0,1,0,1,0,0|1,0,0]=3 6048 B9R1.93 C=C[C@@H]1C[C@]1(N)[PH](=O)O Amb27421893 [0,1,0,1,0,0|2,0,0]=4 6049 B9R1.93 C=C[C@H]1C[C@@]1(N)C(=O)O Amb27221097 [0,1,0,1,0,0|1,0,0]=3 6050 B9R1.93 C=C[C@H]1C[C@]1(N)C(=O)O Amb25105090 [0,1,0,1,0,0|1,0,0]=3 6051 B9R1.93 CC1(C(=O)O)CC1C#N Amb28397281 [0,1,0,1,0,0|2,0,0]=4 6052 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [0,1,0,1,0,0|1,0,0]=3 6053 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [0,1,0,1,0,0|1,0,0]=3 6054 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [0,1,0,1,0,0|2,0,0]=4 6055 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [0,1,0,1,0,0|1,0,0]=3 6056 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [0,1,0,1,0,0|2,0,0]=4 6057 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [0,1,0,1,0,0|1,0,0]=3 6058 B9R1.93 CC[C@@H]1C[C@@]1(N)C(N)=O Amb27215769 [0,1,0,1,0,0|2,0,0]=4 6059 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [0,1,0,1,0,0|1,0,0]=3 6060 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [0,1,0,1,0,0|2,0,0]=4 6061 B9R1.93 CC[C@H]1C[C@@]1(N)C(N)=O Amb28286397 [0,1,0,1,0,0|2,0,0]=4 6062 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [0,1,0,1,0,0|1,0,0]=3 6063 B9R1.93 CC[C@H]1C[C@]1(N)C(N)=O Amb28286982 [0,1,0,1,0,0|2,0,0]=4 6064 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [0,1,0,1,0,0|1,0,0]=3 6065 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [0,1,0,1,0,0|1,0,0]=3 6066 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [0,1,0,1,0,0|2,0,0]=4 6067 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [0,1,0,1,0,0|1,0,0]=3 6068 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [0,1,0,1,0,0|0,0,0]=2 6069 B9R1.93 NCC1CC1(N)C(=O)O Amb27873291 [0,1,0,1,0,0|1,0,0]=3 6070 B9R1.93 NC[C@@H]1C[C@@]1(N)C(=O)O Amb24763621 [0,1,0,1,0,0|1,0,0]=3 6071 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [0,1,0,1,0,0|0,0,0]=2 6072 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [0,1,0,1,0,0|0,0,0]=2 6073 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [0,1,0,1,0,0|0,0,0]=2 6074 B9R1.93 O=C(O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|2,0,0]=4 6075 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,1,0,0|2,0,0]=4 6076 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,1,0,0|1,0,0]=3 6077 B9R1.96 COC1CCC1C(=O)O Amb26516125 [0,1,0,1,0,0|1,0,0]=3 6078 B9R1.96 COC1CCC1C(N)=O Amb27645560 [0,1,0,1,0,0|2,0,0]=4 6079 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [0,1,0,1,0,0|1,0,0]=3 6080 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [0,1,0,1,0,0|1,0,0]=3 6081 B9R1.96 C\C=C1/CN[C@@H]1C(=O)O Amb25075476 [0,1,0,1,0,0|1,0,1]=4 6082 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [0,1,0,1,0,0|2,0,0]=4 6083 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [0,1,0,1,0,0|2,0,0]=4 6084 B9R1.96 O=C(O)C1C=CC1CO Amb27875148 [0,1,0,1,0,0|1,0,1]=4 6085 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|2,0,0]=4 6086 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [0,1,0,1,0,0|1,0,0]=3 6087 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [0,1,0,1,0,0|2,0,0]=4 6088 B9R1.96 O=C(O)[C@H]1C=C[C@H]1CO Amb27783406 [0,1,0,1,0,0|1,0,1]=4 6089 B9R1.101 C#CC(=O)C(N)C1CC1 Amb27655830 [0,1,0,1,0,0|2,0,0]=4 6090 B9R1.101 C=CC(=O)C(N)C1CC1 Amb27867676 [0,1,0,1,0,0|2,0,0]=4 6091 B9R1.101 CCC(=O)C(N)C1CC1 Amb27430948 [0,1,0,1,0,0|2,0,0]=4 6092 B9R1.101 COC(=O)C(Br)C1CC1 Amb26638854 [0,1,0,1,0,0|2,0,0]=4 6093 B9R1.101 COC(=O)C(Cl)C1CC1 Amb20623820 [0,1,0,1,0,0|2,0,0]=4 6094 B9R1.101 COC(=O)C(N)C1CC1 Amb13883561 [0,1,0,1,0,0|1,0,0]=3 6095 B9R1.101 COC(=O)C(N)C1CC1 Amb19149335 [0,1,0,1,0,0|1,0,0]=3 6096 B9R1.101 COC(=O)C(O)C1CC1 Amb22059072 [0,1,0,1,0,0|2,0,0]=4 6097 B9R1.101 COC(=O)C(S)C1CC1 Amb24384464 [0,1,0,1,0,0|2,0,0]=4 6098 B9R1.101 COC(=O)N(N)C1CC1 Amb33191645 [0,1,0,1,0,0|2,0,0]=4 6099 B9R1.101 COC(=O)[C@@H](N)C1CC1 Amb2699131 [0,1,0,1,0,0|1,0,0]=3 6100 B9R1.101 COC(=O)[C@@H](N)C1CC1 Amb8630385 [0,1,0,1,0,0|1,0,0]=3 6101 B9R1.101 COC(=O)[C@H](N)C1CC1 Amb2699130 [0,1,0,1,0,0|1,0,0]=3 6102 B9R1.101 COC(=O)[C@H](N)C1CC1 Amb33836774 [0,1,0,1,0,0|1,0,0]=3 6103 B9R1.101 NNC(=O)C(N)C1CC1 Amb27795794 [0,1,0,1,0,0|2,0,0]=4 6104 B9R1.101 N\C(=N/O)C(N)C1CC1 Amb25147192 [0,1,0,1,0,0|2,0,0]=4 6105 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,1,0,1,0,0|2,0,0]=4 6106 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [0,1,0,1,0,0|2,0,0]=4 6107 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [0,1,0,1,0,0|1,0,0]=3 6108 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [0,1,0,1,0,0|2,0,0]=4 6109 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [0,1,0,1,0,0|2,0,0]=4 6110 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [0,1,0,1,0,0|1,0,0]=3 6111 B9R1.110 CC(C(=O)[O-])C1COC1 Amb35752725 [0,1,0,1,0,0|1,0,1]=4 6112 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [0,1,0,1,0,0|1,0,0]=3 6113 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [0,1,0,1,0,0|1,0,0]=3 6114 B9R1.110 NC(=O)C(N)C1CCC1 Amb27237393 [0,1,0,1,0,0|2,0,0]=4 6115 B9R1.110 NC(=O)C(N)C1COC1 Amb33065789 [0,1,0,1,0,0|1,0,0]=3 6116 B9R1.110 NC(C(=O)O)C1=CCC1 Amb27792901 [0,1,0,1,0,0|1,0,1]=4 6117 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [0,1,0,1,0,0|1,0,0]=3 6118 B9R1.110 NC(C(=O)O)C1CNC1 Amb30040080 [0,1,0,1,0,0|1,0,0]=3 6119 B9R1.110 NC(C(=O)O)C1COC1 Amb22405987 [0,1,0,1,0,0|0,0,0]=2 6120 B9R1.110 NC(C(=O)O)C1CSC1 Amb27844776 [0,1,0,1,0,0|0,1,0]=3 6121 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [0,1,0,1,0,0|1,0,0]=3 6122 B9R1.110 N[C@@H](C(=O)O)C1COC1 Amb22737550 [0,1,0,1,0,0|0,0,0]=2 6123 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [0,1,0,1,0,0|1,0,0]=3 6124 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [0,1,0,1,0,0|1,0,0]=3 6125 B9R1.110 N[C@H](C(=O)O)C1COC1 Amb22737551 [0,1,0,1,0,0|0,0,0]=2 6126 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [0,1,0,1,0,0|2,0,0]=4 6127 B9R1.110 O=C(O)C(F)C1COC1 Amb33165607 [0,1,0,1,0,0|1,0,0]=3 6128 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [0,1,0,1,0,0|2,0,0]=4 6129 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [0,1,0,1,0,0|1,0,0]=3 6130 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [0,1,0,1,0,0|2,0,0]=4 6131 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [0,1,0,1,0,0|2,0,0]=4 6132 B9R1.110 O=C([O-])C(O)C1COC1 Amb32650165 [0,1,0,1,0,0|1,0,1]=4 6133 B9R1.111 CC(C(=O)O)C1(C)CC1 Amb18832624 [0,1,0,1,0,0|2,0,0]=4 6134 B9R1.111 CC(C(=O)O)C1(F)CC1 Amb27491857 [0,1,0,1,0,0|2,0,0]=4 6135 B9R1.111 CC(C(=O)O)C1(N)CC1 Amb18832571 [0,1,0,1,0,0|2,0,0]=4 6136 B9R1.111 CC(C(=O)O)C1(O)CC1 Amb27875945 [0,1,0,1,0,0|1,0,0]=3 6137 B9R1.111 CC1(C(N)C(=O)O)CC1 Amb25146159 [0,1,0,1,0,0|1,0,0]=3 6138 B9R1.111 CC1(C(N)C(=O)O)CC1 Amb30869387 [0,1,0,1,0,0|1,0,0]=3 6139 B9R1.111 CC1(C(O)C(=O)O)CC1 Amb33361276 [0,1,0,1,0,0|2,0,0]=4 6140 B9R1.111 CC1([C@@H](N)C(=O)O)CC1 Amb27630930 [0,1,0,1,0,0|1,0,0]=3 6141 B9R1.111 CC1([C@H](N)C(=O)O)CC1 Amb27965965 [0,1,0,1,0,0|1,0,0]=3 6142 B9R1.111 CC1([C@H](N)C(=O)O)CC1 Amb28989798 [0,1,0,1,0,0|1,0,0]=3 6143 B9R1.111 C[C@@H](C(=O)O)C1(C)CC1 Amb33738113 [0,1,0,1,0,0|2,0,0]=4 6144 B9R1.111 C[C@H](C(=O)O)C1(C)CC1 Amb33744643 [0,1,0,1,0,0|2,0,0]=4 6145 B9R1.111 NC(C(=O)O)C1(N)CC1 Amb26850724 [0,1,0,1,0,0|1,0,0]=3 6146 B9R1.111 NC(C(=O)O)C1(S)CC1 Amb27785321 [0,1,0,1,0,0|0,1,0]=3 6147 B9R1.111 NC1(C(O)C(=O)O)CC1 Amb27235816 [0,1,0,1,0,0|2,0,0]=4 6148 B9R1.111 N[C@@H](C(=O)O)C1(O)CC1 Amb22751391 [0,1,0,1,0,0|0,0,0]=2 6149 B9R1.111 N[C@H](C(=O)O)C1(O)CC1 Amb24117270 [0,1,0,1,0,0|0,0,0]=2 6150 B9R1.111 N[C@H](C(=O)O)C1(O)CC1 Amb27216712 [0,1,0,1,0,0|0,0,0]=2 6151 B9R1.127 C#CC1(C)CC1C(=O)O Amb4041187 [0,1,0,1,0,0|2,0,0]=4 6152 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|2,0,0]=4 6153 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|2,0,0]=4 6154 B9R1.132 CC1C(=O)OCC1CO Amb27853141 [0,1,0,1,0,0|1,0,0]=3 6155 B9R1.132 CC1OC\C(=N/O)C1C Amb35681044 [0,1,0,1,0,0|2,0,0]=4 6156 B9R1.132 CC1ON=C(CO)C1C Amb27661074 [0,1,0,1,0,0|2,0,0]=4 6157 B9R1.132 CCC1COC(=O)C1N Amb28285145 [0,1,0,1,0,0|1,0,0]=3 6158 B9R1.132 CC[C@@H]1COC(=O)[C@H]1N Amb28345688 [0,1,0,1,0,0|1,0,0]=3 6159 B9R1.132 CC[C@@H]1OCC(O)[C@H]1N Amb27229240 [0,1,0,1,0,0|1,0,1]=4 6160 B9R1.132 CN1C(=O)OCC1CO Amb22504497 [0,1,0,1,0,0|2,0,0]=4 6161 B9R1.132 CO[C@H]1COC(=O)[C@@H]1O Amb27432154 [0,1,0,1,0,0|1,0,0]=3 6162 B9R1.132 C[C@@H]1C(=O)OC[C@H]1CO Amb28065887 [0,1,0,1,0,0|1,0,0]=3 6163 B9R1.132 C[C@H]1C(=O)NC[C@@H]1CO Amb27805447 [0,1,0,1,0,0|2,0,0]=4 6164 B9R1.132 NC1C(=O)NCC1CF Amb27663222 [0,1,0,1,0,0|2,0,0]=4 6165 B9R1.132 NC1C(=O)NCC1CO Amb28125787 [0,1,0,1,0,0|1,0,0]=3 6166 B9R1.132 NC1C(=O)OCC1CO Amb27804109 [0,1,0,1,0,0|0,0,0]=2 6167 B9R1.132 NC1C(=O)OCC1CS Amb27637863 [0,1,0,1,0,0|0,1,0]=3 6168 B9R1.132 NN1C(=O)CCC1CO Amb27983528 [0,1,0,1,0,0|2,0,0]=4 6169 B9R1.132 O=C1OCC(CO)C1O Amb27197070 [0,1,0,1,0,0|1,0,0]=3 6170 B9R1.132 O=CC1OCC(O)C1O Amb27256563 [0,1,0,1,0,0|1,0,1]=4 6171 B9R1.132 O=C[C@@H]1OC[C@@H](O)[C@H]1O Amb27629808 [0,1,0,1,0,0|1,0,1]=4 6172 B9R1.132 O=C[C@@H]1OC[C@H](O)[C@@H]1O Amb28457584 [0,1,0,1,0,0|1,0,1]=4 6173 B9R1.138 CC1(C)CNC(=O)C1N Amb25224596 [0,1,0,1,0,0|2,0,0]=4 6174 B9R1.138 CC1(C)COC(=O)C1Cl Amb27477382 [0,1,0,1,0,0|2,0,0]=4 6175 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,1,0,1,0,0|1,0,0]=3 6176 B9R1.138 CC1(C)COC(=O)C1N Amb28935018 [0,1,0,1,0,0|1,0,0]=3 6177 B9R1.138 CC1(C)COC(=O)C1O Amb532977 [0,1,0,1,0,0|2,0,0]=4 6178 B9R1.138 CC1(C)COC(=O)[C@@H]1Br Amb22747532 [0,1,0,1,0,0|2,0,0]=4 6179 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,1,0,1,0,0|1,0,0]=3 6180 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb33338971 [0,1,0,1,0,0|1,0,0]=3 6181 B9R1.138 CC1(C)COC(=O)[C@@H]1O Amb2719697 [0,1,0,1,0,0|2,0,0]=4 6182 B9R1.138 CC1(C)COC(=O)[C@H]1Br Amb27479666 [0,1,0,1,0,0|2,0,0]=4 6183 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,1,0,1,0,0|1,0,0]=3 6184 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb33330894 [0,1,0,1,0,0|1,0,0]=3 6185 B9R1.138 CC1(C)COC(=O)[C@H]1O Amb3939674 [0,1,0,1,0,0|2,0,0]=4 6186 B9R1.138 CC1(C)CSC(=O)C1N Amb28250198 [0,1,0,1,0,0|1,1,0]=4 6187 B9R1.138 CC1(C)CSC(=O)C1N Amb34930436 [0,1,0,1,0,0|1,1,0]=4 6188 B9R1.138 CC1(C)NOC(=O)[C@H]1N Amb25032224 [0,1,0,1,0,0|1,0,0]=3 6189 B9R1.138 CC1(O)CCC(=O)C1O Amb28128781 [0,1,0,1,0,0|2,0,0]=4 6190 B9R1.138 CC1(O)CCC(O)C1N Amb27873074 [0,1,0,1,0,0|1,0,1]=4 6191 B9R1.138 CC1C(=O)C=CC1(C)O Amb27838630 [0,1,0,1,0,0|2,0,0]=4 6192 B9R1.138 C[C@H]1C(=O)CC[C@@]1(C)O Amb28194858 [0,1,0,1,0,0|2,0,0]=4 6193 B9R1.141 C[C@H]1[C@@H](C)[C@]1(C)C(=O)O Amb28248727 [0,1,0,1,0,0|2,0,0]=4 6194 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [0,1,0,1,0,0|2,0,0]=4 6195 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [0,1,0,1,0,0|2,0,0]=4 6196 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [0,1,0,1,0,0|1,0,0]=3 6197 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [0,1,0,1,0,0|2,0,0]=4 6198 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [0,1,0,1,0,0|1,0,0]=3 6199 B9R1.159 C[C@@H]1CC[C@@]1(N)C(N)=O Amb28346845 [0,1,0,1,0,0|2,0,0]=4 6200 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [0,1,0,1,0,0|1,0,0]=3 6201 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [0,1,0,1,0,0|1,0,0]=3 6202 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [0,1,0,1,0,0|2,0,0]=4 6203 B9R1.159 NC1(C(=O)O)CCC1O Amb27482724 [0,1,0,1,0,0|0,0,0]=2 6204 B9R1.159 NC1CCC1(F)C(=O)O Amb27768660 [0,1,0,1,0,0|2,0,0]=4 6205 B9R1.159 N[C@@H]1CC[C@]1(F)C(=O)O Amb27188263 [0,1,0,1,0,0|2,0,0]=4 6206 B9R1.159 N[C@H]1CC[C@@]1(N)C(=O)O Amb27216513 [0,1,0,1,0,0|1,0,0]=3 6207 B9R1.159 N[C@]1(C(=O)O)CC[C@@H]1O Amb28058284 [0,1,0,1,0,0|0,0,0]=2 6208 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [0,1,0,1,0,0|2,0,0]=4 6209 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|2,0,0]=4 6210 B9R1.185 COC(=O)C1OC1(C)C Amb4418353 [0,1,0,1,0,0|2,0,0]=4 6211 B9R1.188 COC(=O)C1(C)CC1Br Amb26533678 [0,1,0,1,0,0|2,0,0]=4 6212 B9R1.188 COC(=O)C1(C)CC1C Amb26415550 [0,1,0,1,0,0|2,0,0]=4 6213 B9R1.188 COC(=O)C1(C)CC1Cl Amb27650636 [0,1,0,1,0,0|2,0,0]=4 6214 B9R1.188 COC(=O)C1(N)CC1Br Amb24728828 [0,1,0,1,0,0|1,0,0]=3 6215 B9R1.188 COC(=O)[C@]1(C)C[C@H]1C Amb27636165 [0,1,0,1,0,0|2,0,0]=4 6216 B9R1.188 COC(=O)[C@]1(N)C[C@@H]1Br Amb28137741 [0,1,0,1,0,0|1,0,0]=3 6217 B9R1.188 COC(=O)[C@]1(N)C[C@@H]1C Amb27419940 [0,1,0,1,0,0|1,0,0]=3 6218 B9R1.188 COC(=O)[C@]1(N)C[C@H]1C Amb27619292 [0,1,0,1,0,0|1,0,0]=3 6219 B9R1.27 CC1COC(=O)\C1=N/N Amb27452261 [0,1,0,1,0,0|1,0,1]=4 6220 B9R1.27 CCC1C(=O)COC1C Amb30013811 [0,1,0,1,0,0|2,0,0]=4 6221 B9R1.27 CCN1C(=O)OCC1O Amb28134794 [0,1,0,1,0,0|2,0,0]=4 6222 B9R1.27 CC[C@@H]1C(=O)OC[C@H]1O Amb27456703 [0,1,0,1,0,0|1,0,0]=3 6223 B9R1.27 COC1C(=O)OCC1O Amb27237829 [0,1,0,1,0,0|1,0,0]=3 6224 B9R1.27 O=C1OCC(O)C1CO Amb27456568 [0,1,0,1,0,0|1,0,0]=3 6225 B9R1.27 O=C1OC[C@@H](O)[C@@H]1CO Amb27484769 [0,1,0,1,0,0|1,0,0]=3 6226 B9R1.32 CC1(C)NC(=O)C1CN Amb25789516 [0,1,0,1,0,0|2,0,0]=4 6227 B9R1.52 C=C1CC(N)C1C(=O)O Amb27590177 [0,1,0,1,0,0|1,0,1]=4 6228 B9R1.52 CC1=CC(C)C1C(=O)O Amb28281140 [0,1,0,1,0,0|2,0,0]=4 6229 B9R1.52 CC1CC(O)C1C(=O)O Amb28076807 [0,1,0,1,0,0|1,0,0]=3 6230 B9R1.52 CC1CN(C)[C@@H]1C(=O)O Amb30869400 [0,1,0,1,0,0|1,0,0]=3 6231 B9R1.52 CC1CN(C)[C@H]1C(=O)O Amb34915559 [0,1,0,1,0,0|1,0,0]=3 6232 B9R1.52 C[C@@H]1NC(=O)[C@@H]1[C@@H](C)O Amb27625871 [0,1,0,1,0,0|2,0,0]=4 6233 B9R1.52 C[C@H](O)[C@H]1C(=O)N[C@H]1C Amb27986117 [0,1,0,1,0,0|2,0,0]=4 6234 B9R1.52 C[C@H]1C[C@@H](O)[C@H]1C(=O)O Amb28057126 [0,1,0,1,0,0|1,0,0]=3 6235 B9R1.116 CCC(C(=O)O)C1CC1 Amb18832627 [0,1,0,1,0,0|2,0,0]=4 6236 B9R1.116 CNC(C(=O)O)C1CC1 Amb18975569 [0,1,0,1,0,0|1,0,0]=3 6237 B9R1.116 CNC(C(N)=O)C1CC1 Amb18975566 [0,1,0,1,0,0|2,0,0]=4 6238 B9R1.116 COC(C(=O)O)C1CC1 Amb24524177 [0,1,0,1,0,0|2,0,0]=4 6239 B9R1.116 NCC(C(=O)O)C1CC1 Amb26482230 [0,1,0,1,0,0|1,0,0]=3 6240 B9R1.116 NCC(C(N)=O)C1CC1 Amb27642892 [0,1,0,1,0,0|2,0,0]=4 6241 B9R1.116 NOC(C(=O)O)C1CC1 Amb26560827 [0,1,0,1,0,0|1,0,0]=3 6242 B9R1.116 NOC(C(=O)O)C1CC1 Amb32655968 [0,1,0,1,0,0|1,0,0]=3 6243 B9R1.116 O=C(O)C(CF)C1CC1 Amb27816769 [0,1,0,1,0,0|2,0,0]=4 6244 B9R1.116 O=C(O)C(NO)C1CC1 Amb27410795 [0,1,0,1,0,0|1,0,0]=3 6245 B9R1.130 CC1CC1(C#N)C(=O)O Amb28457724 [0,1,0,1,0,0|1,0,1]=4 6246 B9R1.130 CC1CC1(CN)C(=O)O Amb24502348 [0,1,0,1,0,0|1,0,0]=3 6247 B9R1.130 CC1CC1(CN)C(=O)O Amb33747377 [0,1,0,1,0,0|1,0,0]=3 6248 B9R1.130 CC1CC1(CO)C(=O)O Amb27876946 [0,1,0,1,0,0|2,0,0]=4 6249 B9R1.130 CCC1(C(=O)O)CC1F Amb27956509 [0,1,0,1,0,0|2,0,0]=4 6250 B9R1.130 CCC1(C(C)=O)OC1C Amb25242557 [0,1,0,1,0,0|2,0,0]=4 6251 B9R1.130 CC[C@@]1(C(=O)O)C[C@@H]1F Amb27631299 [0,1,0,1,0,0|2,0,0]=4 6252 B9R1.130 CC[C@@]1(C(=O)O)C[C@H]1F Amb27879637 [0,1,0,1,0,0|2,0,0]=4 6253 B9R1.130 CC[C@@]1(C(C)=O)O[C@H]1C Amb27427845 [0,1,0,1,0,0|2,0,0]=4 6254 B9R1.130 CC[C@]1(C(=O)O)C[C@H]1F Amb25082106 [0,1,0,1,0,0|2,0,0]=4 6255 B9R1.130 CN[C@]1(C(=O)O)C[C@H]1C Amb28347002 [0,1,0,1,0,0|1,0,0]=3 6256 B9R1.130 CSC1(C(=O)O)CC1C Amb24540432 [0,1,0,1,0,0|2,0,0]=4 6257 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33734028 [0,1,0,1,0,0|1,0,0]=3 6258 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33742278 [0,1,0,1,0,0|1,0,0]=3 6259 B9R1.166 CC(O)C1CNS1(=O)=O Amb27661175 [0,1,0,1,0,0|1,0,1]=4 6260 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,1,0,1,0,0|2,0,0]=4 6261 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,1,0,1,0,0|1,0,0]=3 6262 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,1,0,1,0,0|1,0,0]=3 6263 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,1,0,1,0,0|1,0,0]=3 6264 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,1,0,1,0,0|1,0,0]=3 6265 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,1,0,1,0,0|2,0,0]=4 6266 B9R1.166 C[C@@H](O)[C@H]1CNS1(=O)=O Amb27484919 [0,1,0,1,0,0|1,0,1]=4 6267 B9R1.166 C[C@H](O)[C@H]1CNS1(=O)=O Amb27205382 [0,1,0,1,0,0|1,0,1]=4 6268 B9R1.166 O=C(O)C1CCC1(F)F Amb24452747 [0,1,0,1,0,0|2,0,0]=4 6269 B9R1.166 O=C(O)C1NCC1(F)F Amb27813163 [0,1,0,1,0,0|1,0,0]=3 6270 B9R1.168 CC(=O)C1(C(C)O)CC1 Amb27836903 [0,1,0,1,0,0|2,0,0]=4 6271 B9R1.168 CC(=O)C1(C(C)O)CO1 Amb27754833 [0,1,0,1,0,0|2,0,0]=4 6272 B9R1.168 CC(=O)[C@@]1([C@@H](C)O)CO1 Amb28250208 [0,1,0,1,0,0|2,0,0]=4 6273 B9R1.168 CC(C)C1(C(=O)O)CC1 Amb18061747 [0,1,0,1,0,0|2,0,0]=4 6274 B9R1.168 CC(O)C1(C(N)=O)CC1 Amb27944915 [0,1,0,1,0,0|2,0,0]=4 6275 B9R1.65 CC1CC1(N)P(=O)(O)O Amb27185735 [0,1,0,1,0,0|2,0,0]=4 6276 B9R1.106 CC1(O)C(=O)NCC1O Amb27247145 [0,1,0,1,0,0|2,0,0]=4 6277 B9R1.106 CC1(O)C(=O)OCC1O Amb25182892 [0,1,0,1,0,0|1,0,0]=3 6278 B9R1.106 CC1CNC(=O)C1(C)N Amb32655252 [0,1,0,1,0,0|2,0,0]=4 6279 B9R1.106 C[C@@]1(Cl)C(=O)OC[C@H]1O Amb27472572 [0,1,0,1,0,0|1,0,0]=3 6280 B9R1.106 C[C@@]1(O)C(=O)OCC1O Amb28123700 [0,1,0,1,0,0|1,0,0]=3 6281 B9R1.106 C[C@@]1(O)C(=O)OC[C@@H]1O Amb27207785 [0,1,0,1,0,0|1,0,0]=3 6282 B9R1.106 C[C@]1(O)C(=O)OC[C@H]1O Amb22745011 [0,1,0,1,0,0|1,0,0]=3 6283 B9R1.165 CC(=O)C(C)(N)C1CC1 Amb27468046 [0,1,0,1,0,0|2,0,0]=4 6284 B9R1.165 CC(C)(C(=O)O)C1CC1 Amb33544781 [0,1,0,1,0,0|2,0,0]=4 6285 B9R1.165 CC(Cl)(C(=O)O)C1CC1 Amb27448215 [0,1,0,1,0,0|2,0,0]=4 6286 B9R1.165 CC(F)(C(=O)O)C1CC1 Amb27782191 [0,1,0,1,0,0|2,0,0]=4 6287 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb22492372 [0,1,0,1,0,0|1,0,0]=3 6288 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb33551932 [0,1,0,1,0,0|1,0,0]=3 6289 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb9725301 [0,1,0,1,0,0|1,0,0]=3 6290 B9R1.165 CC(N)(C(N)=O)C1CC1 Amb18949661 [0,1,0,1,0,0|2,0,0]=4 6291 B9R1.165 CC(N)(C(N)=O)C1CC1 Amb19374801 [0,1,0,1,0,0|2,0,0]=4 6292 B9R1.165 CC(O)(C(=O)O)C1CC1 Amb18952003 [0,1,0,1,0,0|2,0,0]=4 6293 B9R1.165 C[C@@](N)(C(=O)O)C1CC1 Amb27975393 [0,1,0,1,0,0|1,0,0]=3 6294 B9R1.165 C[C@@](N)(C(=O)O)[C@@H]1CO1 Amb27215310 [0,1,0,1,0,0|0,0,0]=2 6295 B9R1.165 C[C@@](N)(C(=O)O)[C@H]1CO1 Amb28346272 [0,1,0,1,0,0|0,0,0]=2 6296 B9R1.165 C[C@](N)(C(=O)O)C1CC1 Amb25975990 [0,1,0,1,0,0|1,0,0]=3 6297 B9R1.165 O=C(O)C(F)(F)C1CC1 Amb26390617 [0,1,0,1,0,0|2,0,0]=4 6298 B9R2.17 N[C@]12C[C@H]1COC2=O Amb27420696 [0,0,0,2,0,0|1,0,0]=3 6299 B9R2.144 O=C(O)C12CCC1C2 Amb28252733 [0,0,0,2,0,0|2,0,0]=4 6300 B9R2.147 O=C(O)C1C2CC1C2 Amb27634394 [0,0,0,2,0,0|2,0,0]=4 6301 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|2,0,0]=4 6302 B9R2.37 CC1C(=O)CC2OC21 Amb28316166 [0,0,0,2,0,0|2,0,0]=4 6303 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|2,0,0]=4 6304 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|2,0,0]=4 6305 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [1,0,0,0,0,1|1,0,1]=4 6306 B7R0.6 C=C(C)CCC(C)O Amb24062974 [1,0,0,0,0,1|2,0,0]=4 6307 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [1,0,0,0,0,1|2,0,0]=4 6308 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [1,0,0,0,0,1|2,0,0]=4 6309 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [1,0,0,0,0,1|1,0,1]=4 6310 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [1,0,0,0,0,1|1,0,1]=4 6311 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,0,0,0,0,1|0,0,2]=4 6312 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [1,0,0,0,0,1|2,0,0]=4 6313 B7R0.6 CC(=O)CCC(C)C Amb4605991 [1,0,0,0,0,1|2,0,0]=4 6314 B7R0.6 CC(=O)CCC(C)O Amb25829594 [1,0,0,0,0,1|1,0,0]=3 6315 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [1,0,0,0,0,1|1,0,0]=3 6316 B7R0.6 CC(=O)CNC(C)C Amb28126943 [1,0,0,0,0,1|2,0,0]=4 6317 B7R0.6 CC(=O)CNC(C)C Amb32661638 [1,0,0,0,0,1|2,0,0]=4 6318 B7R0.6 CC(=O)COC(C)C Amb9665256 [1,0,0,0,0,1|2,0,0]=4 6319 B7R0.6 CC(=O)CSC(C)C Amb22549127 [1,0,0,0,0,1|2,0,0]=4 6320 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,0,1|0,0,2]=4 6321 B7R0.6 CC(=O)NCC(C)C Amb3364211 [1,0,0,0,0,1|2,0,0]=4 6322 B7R0.6 CC(=O)NCC(C)N Amb18631377 [1,0,0,0,0,1|2,0,0]=4 6323 B7R0.6 CC(=O)NCC(C)O Amb9276316 [1,0,0,0,0,1|1,0,0]=3 6324 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,0,1|0,0,2]=4 6325 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [1,0,0,0,0,1|2,0,0]=4 6326 B7R0.6 CC(=O)OCC(C)O Amb24056158 [1,0,0,0,0,1|1,0,0]=3 6327 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [1,0,0,0,0,1|2,0,0]=4 6328 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [1,0,0,0,0,1|1,0,0]=3 6329 B7R0.6 CC(=O)SCC(C)O Amb27801534 [1,0,0,0,0,1|1,0,0]=3 6330 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [1,0,0,0,0,1|1,0,1]=4 6331 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [1,0,0,0,0,1|0,1,1]=4 6332 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [1,0,0,0,0,1|0,1,1]=4 6333 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,0,0,0,0,1|1,0,0]=3 6334 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [1,0,0,0,0,1|1,0,1]=4 6335 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [1,0,0,0,0,1|2,0,0]=4 6336 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [1,0,0,0,0,1|1,0,1]=4 6337 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [1,0,0,0,0,1|2,0,0]=4 6338 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,0,0,0,1|1,0,0]=3 6339 B7R0.6 CC(C)CCC(N)=O Amb8997711 [1,0,0,0,0,1|2,0,0]=4 6340 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [1,0,0,0,0,1|2,0,0]=4 6341 B7R0.6 CC(C)CNC(N)=O Amb1151241 [1,0,0,0,0,1|2,0,0]=4 6342 B7R0.6 CC(C)CNC(O)=S Amb27597328 [1,0,0,0,0,1|1,1,0]=4 6343 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [1,0,0,0,0,1|2,0,0]=4 6344 B7R0.6 CC(C)COC(N)=O Amb4020010 [1,0,0,0,0,1|2,0,0]=4 6345 B7R0.6 CC(C)CON(=O)O Amb33780821 [1,0,0,0,0,1|2,0,0]=4 6346 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [1,0,0,0,0,1|2,0,0]=4 6347 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,0,0,0,0,1|2,0,0]=4 6348 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [1,0,0,0,0,1|2,0,0]=4 6349 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,0,0,0,0,1|1,0,0]=3 6350 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,0,0,0,0,1|1,0,0]=3 6351 B7R0.6 CC(C)NCC(N)=O Amb2370772 [1,0,0,0,0,1|2,0,0]=4 6352 B7R0.6 CC(C)NCC(N)=O Amb399843 [1,0,0,0,0,1|2,0,0]=4 6353 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [1,0,0,0,0,1|2,0,0]=4 6354 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,0,0,0,0,1|1,0,0]=3 6355 B7R0.6 CC(C)OCC(N)=O Amb26515707 [1,0,0,0,0,1|2,0,0]=4 6356 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,0,0,0,0,1|1,0,0]=3 6357 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [1,0,0,0,0,1|1,0,1]=4 6358 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [1,0,0,0,0,1|1,0,1]=4 6359 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,0,0,0,0,1|2,0,0]=4 6360 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,0,0,0,0,1|1,0,0]=3 6361 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [1,0,0,0,0,1|1,0,1]=4 6362 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,0,0,0,0,1|1,0,0]=3 6363 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,0,0,0,0,1|1,0,0]=3 6364 B7R0.6 CC(N)CCS(=O)O Amb27839082 [1,0,0,0,0,1|2,0,0]=4 6365 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [1,0,0,0,0,1|2,0,0]=4 6366 B7R0.6 CC(N)CNC(N)=O Amb18202688 [1,0,0,0,0,1|2,0,0]=4 6367 B7R0.6 CC(N)COC(N)=O Amb29849466 [1,0,0,0,0,1|2,0,0]=4 6368 B7R0.6 CC(N)SCC(=O)O Amb27401691 [1,0,0,0,0,1|1,0,0]=3 6369 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [1,0,0,0,0,1|1,0,1]=4 6370 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [1,0,0,0,0,1|0,0,1]=3 6371 B7R0.6 CC(O)CCB(O)O Amb24594819 [1,0,0,0,0,1|1,0,1]=4 6372 B7R0.6 CC(O)CCC(=N)N Amb29849256 [1,0,0,0,0,1|2,0,0]=4 6373 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,0,0,0,0,1|0,0,0]=2 6374 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [1,0,0,0,0,1|0,0,1]=3 6375 B7R0.6 CC(O)CCC(C)O Amb2688714 [1,0,0,0,0,1|1,0,1]=4 6376 B7R0.6 CC(O)CCC(N)=S Amb28078352 [1,0,0,0,0,1|1,1,0]=4 6377 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [1,0,0,0,0,1|1,0,1]=4 6378 B7R0.6 CC(O)CNC(=N)N Amb27759521 [1,0,0,0,0,1|2,0,0]=4 6379 B7R0.6 CC(O)COB(O)O Amb28206200 [1,0,0,0,0,1|1,0,1]=4 6380 B7R0.6 CC(O)COC(N)=O Amb26359577 [1,0,0,0,0,1|1,0,0]=3 6381 B7R0.6 CC(O)COS(C)=O Amb27982299 [1,0,0,0,0,1|2,0,0]=4 6382 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,0,0,0,0,1|0,1,0]=3 6383 B7R0.6 CC(S)CCC(N)=O Amb28399630 [1,0,0,0,0,1|1,1,0]=4 6384 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,0,0,0,0,1|2,0,0]=4 6385 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,0,0,0,0,1|2,0,0]=4 6386 B7R0.6 CN(C)OCC(=O)O Amb28120004 [1,0,0,0,0,1|2,0,0]=4 6387 B7R0.6 CN(N)CCC(=O)O Amb2698078 [1,0,0,0,0,1|2,0,0]=4 6388 B7R0.6 CN(O)CCC(N)=O Amb27390605 [1,0,0,0,0,1|2,0,0]=4 6389 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [1,0,0,0,0,1|1,0,1]=4 6390 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [1,0,0,0,0,1|1,0,1]=4 6391 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [1,0,0,0,0,1|1,0,1]=4 6392 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,0,0,0,0,1|1,0,0]=3 6393 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,0,0,0,0,1|1,0,0]=3 6394 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [1,0,0,0,0,1|1,0,1]=4 6395 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [1,0,0,0,0,1|1,0,0]=3 6396 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [1,0,0,0,0,1|1,0,1]=4 6397 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,0,0,0,0,1|1,0,0]=3 6398 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,0,0,0,0,1|1,0,0]=3 6399 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,0,0,0,0,1|0,0,0]=2 6400 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [1,0,0,0,0,1|1,0,1]=4 6401 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [1,0,0,0,0,1|1,0,1]=4 6402 B7R0.6 C[C@H](O)CNC(=N)N Amb28135994 [1,0,0,0,0,1|2,0,0]=4 6403 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,0,0,0,0,1|0,1,0]=3 6404 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,0,0,0,0,1|2,0,0]=4 6405 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [1,0,0,0,0,1|1,0,1]=4 6406 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [1,0,0,0,0,1|2,0,0]=4 6407 B7R0.6 NC(=O)CCC(O)O Amb27254204 [1,0,0,0,0,1|2,0,0]=4 6408 B7R0.6 O=C(O)CCB(O)O Amb24640288 [1,0,0,0,0,1|2,0,0]=4 6409 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [1,0,0,0,0,1|1,0,1]=4 6410 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [1,0,0,0,0,1|1,0,1]=4 6411 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [1,0,0,0,0,1|2,0,0]=4 6412 B7R0.6 O=C(O)CCC(F)F Amb20623135 [1,0,0,0,0,1|2,0,0]=4 6413 B7R0.6 O=C(O)CCP(O)O Amb27424479 [1,0,0,0,0,1|2,0,0]=4 6414 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [1,0,0,0,0,1|2,0,0]=4 6415 B7R0.6 O=C(O)COC(F)F Amb26635492 [1,0,0,0,0,1|2,0,0]=4 6416 B7R0.6 O=C(O)CSC(F)F Amb9215372 [1,0,0,0,0,1|2,0,0]=4 6417 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,0,0,0,0,2|1,0,1]=4 6418 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,0,0,0,0,2|1,0,1]=4 6419 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,0,0,0,0,2|1,0,1]=4 6420 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,0,0,0,0,2|1,0,1]=4 6421 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [0,0,0,0,0,2|2,0,0]=4 6422 B9R0.7 CC(=O)C(C)SCC(C)O Amb27651284 [0,0,0,0,0,2|2,0,0]=4 6423 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,0,0,0,0,2|0,0,2]=4 6424 B9R0.7 CC(=O)CCC(C)C(C)O Amb27838958 [0,0,0,0,0,2|2,0,0]=4 6425 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,0,0,0,0,2|0,0,2]=4 6426 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,0,0,0,0,2|0,0,2]=4 6427 B9R0.7 CC(=O)CC[C@@H](C)[C@@H](C)O Amb25984868 [0,0,0,0,0,2|2,0,0]=4 6428 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,0,0,0,0,2|0,0,2]=4 6429 B9R0.7 CC(=O)CC[C@H](C)[C@@H](C)O Amb22747043 [0,0,0,0,0,2|2,0,0]=4 6430 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,0,0,0,0,2|0,0,2]=4 6431 B9R0.7 CC(=O)CSC(C)C(C)O Amb28344436 [0,0,0,0,0,2|2,0,0]=4 6432 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,0,0,0,0,2|0,0,2]=4 6433 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,0,0,0,0,2|0,0,2]=4 6434 B9R0.7 CC(=O)OCC(N)C(C)C Amb27604557 [0,0,0,0,0,2|2,0,0]=4 6435 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,0,0,0,0,2|0,0,2]=4 6436 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,0,0,0,0,2|0,0,2]=4 6437 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,0,0,0,0,2|0,0,2]=4 6438 B9R0.7 CC(=O)OC[C@H](N)C(C)C Amb28401299 [0,0,0,0,0,2|2,0,0]=4 6439 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,0,0,0,0,2|0,0,2]=4 6440 B9R0.7 CC(Br)C(Br)\C=C\C(=O)O Amb22347457 [0,0,0,0,0,2|2,0,0]=4 6441 B9R0.7 CC(C#CC(=O)O)[C@@H](C)O Amb28423499 [0,0,0,0,0,2|1,0,0]=3 6442 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,0,0,0,0,2|1,0,1]=4 6443 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,0,0,0,0,2|1,0,1]=4 6444 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,0,0,0,0,2|1,0,1]=4 6445 B9R0.7 CC(C)C#CC(C)C(=O)O Amb27646536 [0,0,0,0,0,2|2,0,0]=4 6446 B9R0.7 CC(C)C(N)C#CC(=O)O Amb27408416 [0,0,0,0,0,2|1,0,0]=3 6447 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,0,0,0,0,2|1,0,0]=3 6448 B9R0.7 CC(C)C(N)CNC(N)=O Amb27832804 [0,0,0,0,0,2|2,0,0]=4 6449 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,0,0,0,0,2|2,0,0]=4 6450 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,0,0,0,0,2|2,0,0]=4 6451 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,0,0,0,0,2|2,0,0]=4 6452 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,0,0,0,0,2|2,0,0]=4 6453 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [0,0,0,0,0,2|2,0,0]=4 6454 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,0,0,0,0,2|1,0,0]=3 6455 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,0,0,0,0,2|1,0,0]=3 6456 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [0,0,0,0,0,2|2,0,0]=4 6457 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,0,0,0,0,2|2,0,0]=4 6458 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,0,0,0,0,2|2,0,0]=4 6459 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,0,0,0,0,2|1,0,0]=3 6460 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,0,0,0,0,2|1,0,0]=3 6461 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,0,0,0,0,2|2,0,0]=4 6462 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,0,0,0,0,2|1,0,0]=3 6463 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,0,0,0,0,2|1,0,0]=3 6464 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,0,0,0,0,2|2,0,0]=4 6465 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,0,0,0,0,2|2,0,0]=4 6466 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,0,0,0,0,2|2,0,0]=4 6467 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,0,0,0,0,2|2,0,0]=4 6468 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,0,0,0,0,2|2,0,0]=4 6469 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,0,0,0,0,2|2,0,0]=4 6470 B9R0.7 CC(C)NCC(N)C(N)=O Amb27812569 [0,0,0,0,0,2|2,0,0]=4 6471 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,0,0,0,0,2|2,0,0]=4 6472 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,0,0,0,0,2|2,0,0]=4 6473 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,0,0,0,0,2|1,0,0]=3 6474 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,0,0,0,0,2|1,0,0]=3 6475 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,0,0,0,0,2|2,0,0]=4 6476 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,0,0,0,0,2|2,0,0]=4 6477 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,0,0,0,0,2|1,0,0]=3 6478 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,0,0,0,0,2|1,0,0]=3 6479 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,0,0,0,0,2|1,0,0]=3 6480 B9R0.7 CC(C)OC[C@H](N)C(N)=O Amb27184033 [0,0,0,0,0,2|2,0,0]=4 6481 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,0,0,0,0,2|1,0,0]=3 6482 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,0,0,0,0,2|2,0,0]=4 6483 B9R0.7 CC(F)C(N)CCC(=O)O Amb27207659 [0,0,0,0,0,2|1,0,0]=3 6484 B9R0.7 CC(N)C(O)CCC(=O)O Amb27881667 [0,0,0,0,0,2|2,0,0]=4 6485 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [0,0,0,0,0,2|2,0,0]=4 6486 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,0,0,0,0,2|1,0,0]=3 6487 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,0,0,0,0,2|1,0,0]=3 6488 B9R0.7 CC(NC[C@H](C)O)C(N)=O Amb27596825 [0,0,0,0,0,2|2,0,0]=4 6489 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,0,0,0,0,2|1,0,1]=4 6490 B9R0.7 CC(O)C(C)CCC(=O)O Amb27424805 [0,0,0,0,0,2|1,0,0]=3 6491 B9R0.7 CC(O)C(C)NCC(=O)O Amb27444950 [0,0,0,0,0,2|1,0,0]=3 6492 B9R0.7 CC(O)C(C)NCC(N)=O Amb27476355 [0,0,0,0,0,2|2,0,0]=4 6493 B9R0.7 CC(O)C(C)\C=C\C(=O)O Amb27759324 [0,0,0,0,0,2|1,0,0]=3 6494 B9R0.7 CC(O)C(O)CCC(N)=O Amb28146727 [0,0,0,0,0,2|2,0,0]=4 6495 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,0,0,0,0,2|1,0,1]=4 6496 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,0,0,0,0,2|0,0,0]=2 6497 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [0,0,0,0,0,2|1,0,0]=3 6498 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,0,0,0,0,2|0,0,0]=2 6499 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,0,0,0,0,2|0,0,0]=2 6500 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,0,0,0,0,2|1,0,0]=3 6501 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,0,0,0,0,2|1,0,0]=3 6502 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,0,0,0,0,2|1,0,0]=3 6503 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,0,0,0,0,2|0,0,0]=2 6504 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [0,0,0,0,0,2|0,0,0]=2 6505 B9R0.7 CC(O)\C=C\C(C)C(=O)O Amb28246267 [0,0,0,0,0,2|1,0,0]=3 6506 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [0,0,0,0,0,2|2,0,0]=4 6507 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [0,0,0,0,0,2|2,0,0]=4 6508 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [0,0,0,0,0,2|2,0,0]=4 6509 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [0,0,0,0,0,2|2,0,0]=4 6510 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [0,0,0,0,0,2|2,0,0]=4 6511 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [0,0,0,0,0,2|1,0,0]=3 6512 B9R0.7 CS(=N)CCC(N)C(=O)O Amb25243030 [0,0,0,0,0,2|2,0,0]=4 6513 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,0,0,0,0,2|1,0,1]=4 6514 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,0,0,0,0,2|1,0,1]=4 6515 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,0,0,0,0,2|1,0,1]=4 6516 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [0,0,0,0,0,2|1,0,1]=4 6517 B9R0.7 C[C@@H](F)[C@@H](N)CCC(=O)O Amb27604296 [0,0,0,0,0,2|1,0,0]=3 6518 B9R0.7 C[C@@H](F)[C@H](O)CCC(=O)O Amb28256347 [0,0,0,0,0,2|2,0,0]=4 6519 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [0,0,0,0,0,2|2,0,0]=4 6520 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,0,0,0,0,2|2,0,0]=4 6521 B9R0.7 C[C@@H](N)[C@@H](O)CCC(=O)O Amb27655533 [0,0,0,0,0,2|2,0,0]=4 6522 B9R0.7 C[C@@H](O)[C@@H](O)\C=C\C(=O)O Amb28067737 [0,0,0,0,0,2|1,0,0]=3 6523 B9R0.7 C[C@@H](O)[C@H](C)C#CC(=O)O Amb27831855 [0,0,0,0,0,2|1,0,0]=3 6524 B9R0.7 C[C@@H](O)[C@H](O)CCC(=O)O Amb27628876 [0,0,0,0,0,2|1,0,0]=3 6525 B9R0.7 C[C@H](Br)[C@H](O)\C=C\C(=O)O Amb27751397 [0,0,0,0,0,2|2,0,0]=4 6526 B9R0.7 C[C@H](F)[C@H](O)CCC(=O)O Amb28126864 [0,0,0,0,0,2|2,0,0]=4 6527 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,0,0,0,0,2|2,0,0]=4 6528 B9R0.7 C[C@H](O)[C@@H](C)\C=C\C(=O)O Amb28239463 [0,0,0,0,0,2|1,0,0]=3 6529 B9R0.7 C[C@H](O)[C@H](N)CCC(=O)O Amb27217393 [0,0,0,0,0,2|0,0,0]=2 6530 B9R0.7 C[C@H](O)\C=C\[C@@H](C)C(=O)O Amb27617100 [0,0,0,0,0,2|1,0,0]=3 6531 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [0,0,0,0,0,2|2,0,0]=4 6532 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [0,0,0,0,0,2|2,0,0]=4 6533 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [0,0,0,0,0,2|2,0,0]=4 6534 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [0,0,0,0,0,2|2,0,0]=4 6535 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [0,0,0,0,0,2|2,0,0]=4 6536 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [0,0,0,0,0,2|2,0,0]=4 6537 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [0,0,0,0,0,2|2,0,0]=4 6538 B9R0.7 C\C(=C/C[C@@H](C)O)C(=O)O Amb27254118 [0,0,0,0,0,2|1,0,1]=4 6539 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,0,0,0,0,2|1,0,1]=4 6540 B9R0.7 NC(CCB(O)O)C(=O)O Amb22497480 [0,0,0,0,0,2|2,0,0]=4 6541 B9R0.7 NC(CCC(=O)O)B(O)O Amb26983348 [0,0,0,0,0,2|2,0,0]=4 6542 B9R0.7 NC(CCC(=O)O)C(=O)O Amb8395158 [0,0,0,0,0,2|1,0,1]=4 6543 B9R0.7 NC(CCC(=O)O)C(=O)O Amb9703098 [0,0,0,0,0,2|1,0,1]=4 6544 B9R0.7 NC(CCC(=O)O)C(F)F Amb19148415 [0,0,0,0,0,2|2,0,0]=4 6545 B9R0.7 NC(COC(F)F)C(=O)O Amb27849786 [0,0,0,0,0,2|2,0,0]=4 6546 B9R0.7 NC(CSC(=O)O)C(=O)O Amb27491502 [0,0,0,0,0,2|1,0,1]=4 6547 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb34915082 [0,0,0,0,0,2|1,0,1]=4 6548 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb3940322 [0,0,0,0,0,2|1,0,1]=4 6549 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb8513626 [0,0,0,0,0,2|1,0,1]=4 6550 B9R0.7 N[C@@H](CCC(O)=S)C(=O)O Amb24480492 [0,0,0,0,0,2|1,0,1]=4 6551 B9R0.7 N[C@@H](CCS(=O)O)C(=O)O Amb25972325 [0,0,0,0,0,2|2,0,0]=4 6552 B9R0.7 N[C@@H](CC[PH](=O)O)C(=O)O Amb22904307 [0,0,0,0,0,2|2,0,0]=4 6553 B9R0.7 N[C@@H](CSC(=O)O)C(=O)O Amb27666945 [0,0,0,0,0,2|1,0,1]=4 6554 B9R0.7 N[C@H](CCC(=O)O)C(=O)O Amb2720565 [0,0,0,0,0,2|1,0,1]=4 6555 B9R0.7 N[C@H](COC(F)F)C(=O)O Amb27637675 [0,0,0,0,0,2|2,0,0]=4 6556 B9R0.7 N[C@H](CSC(F)F)C(=O)O Amb28290955 [0,0,0,0,0,2|2,0,0]=4 6557 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,0,0,0,0,2|1,0,1]=4 6558 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [0,0,0,0,0,2|2,0,0]=4 6559 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [0,0,0,0,0,2|2,0,0]=4 6560 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,0,0,0,0,2|2,0,0]=4 6561 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,0,0,0,0,2|1,0,0]=3 6562 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,0,0,0,0,2|2,0,0]=4 6563 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,0,0,0,0,2|2,0,0]=4 6564 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,0,0,0,0,2|1,0,0]=3 6565 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,0,0,0,0,2|1,0,0]=3 6566 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,0,0,0,0,2|2,0,0]=4 6567 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,0,0,0,0,2|1,0,0]=3 6568 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,0,0,0,0,2|1,0,0]=3 6569 B9R0.53 CC(C)C[C@H](N)CC(N)=O Amb28120875 [0,0,0,0,0,2|2,0,0]=4 6570 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,0,0,0,0,2|2,0,0]=4 6571 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,0,0,0,0,2|2,0,0]=4 6572 B9R0.53 CC(Cl)CC(Cl)CC(=O)O Amb28436914 [0,0,0,0,0,2|2,0,0]=4 6573 B9R0.53 CC(O)CC(C)NC(N)=O Amb27227923 [0,0,0,0,0,2|2,0,0]=4 6574 B9R0.53 CS(=O)C[C@H](N)CC(=O)O Amb27776743 [0,0,0,0,0,2|1,0,1]=4 6575 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,0,0,0,0,2|1,0,1]=4 6576 B9R0.53 NC(CC(=O)O)CC(=O)O Amb6296966 [0,0,0,0,0,2|1,0,1]=4